Compounds

Compounds are SupraBank's interpretation of everything that can moleculary interact. This can be a small molecule with another molecule or a protein or even a material. SupraBank offers several classes of compounds such as molecules, proteins, nanomaterials etc. pp. We try to provide more and more types of compounds for a versatile experience.

Interactions are parts of an interaction (experiment) as the central parts described by the parameters (binding constant) and conditions (solvent, T , pH ...)

Info	Name	Structure	M / g/mol	Interactions	Identifier	Updated
\|	4-Chlorophenol	4-Chlorophenol	128.56	2	PubChem \| InChI \| Smiles	"2021093013151633007740" 30 Sep 2021
\|	Tetraphene	Tetraphene	228.30	1	PubChem \| InChI \| Smiles	"2021100814581633705084" 08 Oct 2021
\|	1-Azatricyclo[3.3.3.0]undecan-1-ylium chloride		187.71	2	PubChem \| InChI \| Smiles	"2020103020091604088589" 30 Oct 2020
\|	β-CD	β-CD	1134.99	293	PubChem \| InChI \| Smiles	"2020092209171600766227" 22 Sep 2020
\|	Iron(II) tris(pyridylimine) chromophore		2397.99	3	PubChem \| InChI \| Smiles	"2020110110301604226621" 01 Nov 2020
\|	2-Aminoanthracene	2-Aminoanthracene	193.25	1	PubChem \| InChI \| Smiles	"2021093014131633011190" 30 Sep 2021
\|	Cy5	Cy5	625.82	1	PubChem \| InChI \| Smiles	"2020110209431604310215" 02 Nov 2020
\|	(R)-(-)-2-Phenylbutyric acid	(R)-(-)-2-Phenylbutyric acid	164.20	1	PubChem \| InChI \| Smiles	"2021093016231633019003" 30 Sep 2021
\|	Caffeine	Caffeine	194.19	3	PubChem \| InChI \| Smiles	"2021102115431634831009" 21 Oct 2021
\|	Neodymium trichloride	Neodymium trichloride	250.60	1	PubChem \| InChI \| Smiles	"2021100814221633702956" 08 Oct 2021
\|	Triphenylenol-tris([1,3]dioxole)-tris(bicyclo[3.3.1]nonanyl)hexylurea		1111.46	5	PubChem \| InChI \| Smiles	"2020102313541603461259" 23 Oct 2020
\|	Hamamelitannin	Hamamelitannin	484.40	2	PubChem \| InChI \| Smiles	"2021102612171635250673" 26 Oct 2021
\|	TMR-CB7	TMR-CB7	1962.88	4	PubChem \| InChI \| Smiles	"2020110110521604227954" 01 Nov 2020
\|	Samarium trichloride	Samarium trichloride	256.70	1	PubChem \| InChI \| Smiles	"2021101908341634632443" 19 Oct 2021
\|	Cycloheptane	Cycloheptane	98.19	1	PubChem \| InChI \| Smiles	"2021101215211634052088" 12 Oct 2021
\|	Azulene	Azulene	128.17	1	PubChem \| InChI \| Smiles	"2021092814331632839621" 28 Sep 2021
\|	(S)-Mandelic acid	(S)-Mandelic acid	152.15	1	PubChem \| InChI \| Smiles	"2021093016151633018550" 30 Sep 2021
\|	Ascorbic Acid	Ascorbic Acid	176.12	2	PubChem \| InChI \| Smiles	"2020102918541603997652" 29 Oct 2020
\|	Ac-GKG-NH2	Ac-GKG-NH2	302.35	1	PubChem \| InChI \| Smiles	"2021102612451635252349" 26 Oct 2021
\|	2-(2-amino-3-phenylpropanamido)-4-(methylthio)butanamide		295.40	1	PubChem \| InChI \| Smiles	"2021093014161633011375" 30 Sep 2021
\|	L-Threonine	L-Threonine	119.12	1	PubChem \| InChI \| Smiles	"2021101908321634632323" 19 Oct 2021
\|	Tetracaine hydrochloride	Tetracaine hydrochloride	300.82	12	PubChem \| InChI \| Smiles	"2020101210111602497500" 12 Oct 2020
\|	Mono(6-carboxymethylamino-6-deoxy)-β-CD		1192.04	5	PubChem \| InChI \| Smiles	"2020102219291603394942" 22 Oct 2020
\|	P-Xylylenediamine	P-Xylylenediamine	136.19	5	PubChem \| InChI \| Smiles	"2021092915121632928361" 29 Sep 2021
\|	Chrysene	Chrysene	228.30	1	PubChem \| InChI \| Smiles	"2021100814581633705104" 08 Oct 2021
\|	[C3mim]Br	[C3mim]Br	207.11	1	PubChem \| InChI \| Smiles	"2022063007481656575294" 30 Jun 2022
\|	Phe-Arg-His-Asp-Ser-Gly-Tyr-Glu-Val-His-His-Gln-Lys		1639.73	2	PubChem \| InChI \| Smiles	"2021051202331620786792" 12 May 2021
\|	(1R2R,3S,5R)-(-)-Pinanediol	(1R2R,3S,5R)-(-)-Pinanediol	170.25	1	PubChem \| InChI \| Smiles	"2021093016211633018899" 30 Sep 2021
\|	Sodium deoxycholate	Sodium deoxycholate	414.60	4	PubChem \| InChI \| Smiles	"2020102212001603368055" 22 Oct 2020
\|	1,5-Dihydroxynaphthalene	1,5-Dihydroxynaphthalene	160.17	3	PubChem \| InChI \| Smiles	"2021092816261632846374" 28 Sep 2021
\|	ExBox.4PF6	ExBox.4PF6	1252.73	10	PubChem \| InChI \| Smiles	"2022062909311656495088" 29 Jun 2022
\|	13-(2-Hydroxy-3-formyl-5-bromobenzyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane		432.30	2	PubChem \| InChI \| Smiles	"2020103019421604086938" 30 Oct 2020
\|	Sodium taurocholate	Sodium taurocholate	537.70	4	PubChem \| InChI \| Smiles	"2020102211411603366882" 22 Oct 2020
\|	Nandrolone	Nandrolone	274.40	32	PubChem \| InChI \| Smiles	"2020101213461602510376" 12 Oct 2020
\|	1,1'-bis(4-iodophenyl)-[4,4'-bipyridine]-1,1'-diium		562.19	1	PubChem \| InChI \| Smiles	"2020110915471604936839" 09 Nov 2020
\|	4,4'-(1,4-phenylene)bis(1-hexylpyridin-1-ium)		402.61	1	PubChem \| InChI \| Smiles	"2024042914481714402127" 29 Apr 2024
\|	Sodium oxalate	Sodium oxalate	134.00	1	PubChem \| InChI \| Smiles	"2021102712391635338363" 27 Oct 2021
\|	Ferulic acid	Ferulic acid	194.18	9	PubChem \| InChI \| Smiles	"2020100715161602083780" 07 Oct 2020
\|	Sodium glycocholate	Sodium glycocholate	487.60	4	PubChem \| InChI \| Smiles	"2020102211491603367379" 22 Oct 2020
\|	6,6,19,19-tetramethyl-12,13,25,26-tetraoxo-2,6,10,15,19,23-hexaazatricyclo[22.2.0.011,14]hexacosa-1(24),11(14)-diene-6,19-diium		476.62	4	PubChem \| InChI \| Smiles	"2022062308271655972828" 23 Jun 2022
\|	Mono(6-amino-6-deoxy)-β-Cyclodextrin	Mono(6-amino-6-deoxy)-β-Cyclodextrin	1134.00	4	PubChem \| InChI \| Smiles	"2020102208161603354606" 22 Oct 2020
\|	p-Toluidine	p-Toluidine	107.16	2	PubChem \| InChI \| Smiles	"2021092915111632928309" 29 Sep 2021
\|	3,4-Dihydroxybenzylamine hydrochloride		175.61	1	PubChem \| InChI \| Smiles	"2021092915181632928736" 29 Sep 2021
\|	L-Phenylalanyl-L-leucine-amide	L-Phenylalanyl-L-leucine-amide	277.36	1	PubChem \| InChI \| Smiles	"2023102416051698163507" 24 Oct 2023
\|	methionyllysylalanine	methionyllysylalanine	348.46	1	PubChem \| InChI \| Smiles	"2023102416131698164017" 24 Oct 2023
\|	Sodium cholate	Sodium cholate	430.60	4	PubChem \| InChI \| Smiles	"2020102219031603393397" 22 Oct 2020
\|	1,7-Dihydroxynaphthalene	1,7-Dihydroxynaphthalene	160.17	2	PubChem \| InChI \| Smiles	"2021093013021633006954" 30 Sep 2021
\|	Mono[6(1-hydroxymethylpropylamino)-6-deoxy)]-β-CD		1206.11	4	PubChem \| InChI \| Smiles	"2020102208141603354473" 22 Oct 2020
\|	2,3-diazabicyclo[3.2.2]non-2-ene	2,3-diazabicyclo[3.2.2]non-2-ene	124.18	3	PubChem \| InChI \| Smiles	"2020102620381603744684" 26 Oct 2020
\|	sCx5-6C	sCx5-6C	1346.68	5	PubChem \| InChI \| Smiles	"2020112009301605864630" 20 Nov 2020
\|	CyP6Q[6]	CyP6Q[6]	1237.21	4	PubChem \| InChI \| Smiles	"2024032810501711623036" 28 Mar 2024
\|	DMF	DMF	73.09	6	PubChem \| InChI \| Smiles	"2021093013531633009990" 30 Sep 2021
\|	(R)-10-Camphorsulfonic acid	(R)-10-Camphorsulfonic acid	232.29	1	PubChem \| InChI \| Smiles	"2021102420461635108363" 24 Oct 2021
\|	Tetrapropylammonium chloride	Tetrapropylammonium chloride	221.81	3	PubChem \| InChI \| Smiles	"2021100716451633625139" 07 Oct 2021
\|	[C4mim][BF4]	[C4mim][BF4]	226.03	1	PubChem \| InChI \| Smiles	"2022062922581656543502" 29 Jun 2022
\|	Diethylether	Diethylether	74.12	6	PubChem \| InChI \| Smiles	"2021092210261632306382" 22 Sep 2021
\|	GGWWGGY	GGWWGGY	781.81	1	PubChem \| InChI \| Smiles	"2024022216251708619111" 22 Feb 2024
\|	Oxepane	Oxepane	100.16	3	PubChem \| InChI \| Smiles	"2021092909071632906472" 29 Sep 2021
\|	Dysprosium trichloride	Dysprosium trichloride	268.85	1	PubChem \| InChI \| Smiles	"2021100814221633702979" 08 Oct 2021
\|	1-(hydroxymethyl)-ferrocene	1-(hydroxymethyl)-ferrocene	216.06	26	PubChem \| InChI \| Smiles	"2020102816201603902016" 28 Oct 2020
\|	picoplatin	picoplatin	376.14	1	PubChem \| InChI \| Smiles	"2022062412421656074559" 24 Jun 2022
\|	Oxetane	Oxetane	58.08	4	PubChem \| InChI \| Smiles	"2021092813551632837300" 28 Sep 2021
\|	sP5A	sP5A	1631.00	36	PubChem \| InChI \| Smiles	"2022062108541655801649" 21 Jun 2022
\|	TMPyP4	TMPyP4	678.80	3	PubChem \| InChI \| Smiles	"2021093010091632996582" 30 Sep 2021
\|	H-phe-leu-oh	H-phe-leu-oh	278.35	1	PubChem \| InChI \| Smiles	"2021093013481633009738" 30 Sep 2021
\|	Ytterbium trichloride	Ytterbium trichloride	279.40	4	PubChem \| InChI \| Smiles	"2021092815591632844772" 28 Sep 2021
\|	(E)-4-(2-(7-(diethylamino)-2-oxo-2H-chromen-3-yl)vinyl)-1-(3-(trimethylammonio)propyl)pyridin-1-ium bromide		581.38	1	PubChem \| InChI \| Smiles	"2021092907151632899733" 29 Sep 2021
\|	Methyl viologen	Methyl viologen	257.16	166	PubChem \| InChI \| Smiles	"2020092212151600776900" 22 Sep 2020
\|	Methyl CB8-Viologen-Rotaxane	Methyl CB8-Viologen-Rotaxane	3190.00	3	PubChem \| InChI \| Smiles	"2021102713391635341949" 27 Oct 2021
\|	1,3-Dimethylbarbituric acid	1,3-Dimethylbarbituric acid	156.14	1	PubChem \| InChI \| Smiles	"2021102115421634830974" 21 Oct 2021
\|	16-(2-Hydroxy-3-formyl-5-bromobenzyl)-1,4,7,10,13-pentaoxa-16-azacyclooctadecane		476.40	2	PubChem \| InChI \| Smiles	"2020103019391604086758" 30 Oct 2020
\|	sCx4-NHSO2(4-CO2H)Ph	sCx4-NHSO2(4-CO2H)Ph	860.82	4	PubChem \| InChI \| Smiles	"2020100115001601564432" 01 Oct 2020
\|	Europium trichloride	Europium trichloride	258.32	1	PubChem \| InChI \| Smiles	"2021101908121634631132" 19 Oct 2021
\|	sCx4-NH2	sCx4-NH2	676.00	3	PubChem \| InChI \| Smiles	"2020100114401601563247" 01 Oct 2020
\|	N-(2-bromobenzyl)-1-(2-bromophenyl)-N,N-dimethylmethanaminium		384.13	1	PubChem \| InChI \| Smiles	"2023030911001678359610" 09 Mar 2023
\|	DMSO	DMSO	78.14	7	PubChem \| InChI \| Smiles	"2021093008251632990359" 30 Sep 2021
\|	2,6-Pyridinedicarboxylic acid	2,6-Pyridinedicarboxylic acid	167.12	2	PubChem \| InChI \| Smiles	"2021092813541632837262" 28 Sep 2021
\|	L-Noradrenaline	L-Noradrenaline	169.18	12	PubChem \| InChI \| Smiles	"2020100319491601754590" 03 Oct 2020
\|	Procaine hydrochloride	Procaine hydrochloride	272.77	12	PubChem \| InChI \| Smiles	"2020100715271602084447" 07 Oct 2020
\|	Tetrahydropyran	Tetrahydropyran	86.13	3	PubChem \| InChI \| Smiles	"2022063014151656598500" 30 Jun 2022
\|	1-methyl-3-[[4-[(3-methylimidazol-3-ium-1-yl)methyl]phenyl]methyl]imidazol-1-ium		268.36	7	PubChem \| InChI \| Smiles	"2020101210131602497614" 12 Oct 2020
\|	Diammonium salt e	Diammonium salt e	788.58	1	PubChem \| InChI \| Smiles	"2024072913471722260877" 29 Jul 2024
\|	gamma-amino butyric acid	gamma-amino butyric acid	103.12	4	PubChem \| InChI \| Smiles	"2021101114181633961937" 11 Oct 2021
\|	Gly-Gly-Gly	Gly-Gly-Gly	189.17	2	PubChem \| InChI \| Smiles	"2021101908321634632361" 19 Oct 2021
\|	Piperazine	Piperazine	86.14	2	PubChem \| InChI \| Smiles	"2021101908121634631156" 19 Oct 2021
\|	5,6-dihydropyrazino[1,2,3,4-lmn]-1,10-phenanthrolinium		208.26	2	PubChem \| InChI \| Smiles	"2020102919041603998264" 29 Oct 2020
\|	Tetraphosphonate cyclophane	Tetraphosphonate cyclophane	1164.86	22	PubChem \| InChI \| Smiles	"2020092209471600768061" 22 Sep 2020
\|	Prilocaine	Prilocaine	220.31	2	PubChem \| InChI \| Smiles	"2021102409321635067928" 24 Oct 2021
\|	Trimethyllysine	Trimethyllysine	189.28	20	PubChem \| InChI \| Smiles	"2020092209501600768252" 22 Sep 2020
\|	DAPI 2H+	DAPI 2H+	279.34	22	PubChem \| InChI \| Smiles	"2020100716481602089284" 07 Oct 2020
\|	Acid Red 52	Acid Red 52	580.65	1	PubChem \| InChI \| Smiles	"2021093013291633008572" 30 Sep 2021
\|	Isoquinoline	Isoquinoline	129.16	2	PubChem \| InChI \| Smiles	"2021101109371633945070" 11 Oct 2021
\|	2,6-Dimethylpyridine	2,6-Dimethylpyridine	107.15	6	PubChem \| InChI \| Smiles	"2021100116261633105572" 01 Oct 2021
\|	Acridine Orange hydrochloride (protonated)		301.80	1	PubChem \| InChI \| Smiles	"2021101908361634632580" 19 Oct 2021
\|	1-methyl-3-[[4-[4-[(3-methylimidazol-3-ium-1-yl)methyl]phenyl]phenyl]methyl]imidazol-1-ium		344.46	7	PubChem \| InChI \| Smiles	"2020101210521602499958" 12 Oct 2020
\|	Cl-	Cl-	35.45	49	PubChem \| InChI \| Smiles	"2021110416101636042211" 04 Nov 2021
\|	4,4'-Dipyridine	4,4'-Dipyridine	156.18	3	PubChem \| InChI \| Smiles	"2021101109391633945162" 11 Oct 2021
\|	(1R,2R)-trans-1,2-Cyclohexanediol	(1R,2R)-trans-1,2-Cyclohexanediol	116.16	1	PubChem \| InChI \| Smiles	"2021102420221635106952" 24 Oct 2021
\|	L-glutamic acid	L-glutamic acid	147.13	4	PubChem \| InChI \| Smiles	"2021101308241634113454" 13 Oct 2021
\|	3,3-dimethylbutan-1-aminium	3,3-dimethylbutan-1-aminium	102.20	1	PubChem \| InChI \| Smiles	"2023062708521687855934" 27 Jun 2023
\|	Met-Arg-Gly-Gly-Tyr	Met-Arg-Gly-Gly-Tyr	582.67	1	PubChem \| InChI \| Smiles	"2022062308441655973851" 23 Jun 2022
\|	hydrogensulfate	hydrogensulfate	97.07	1	PubChem \| InChI \| Smiles	"2021081313431628862217" 13 Aug 2021
\|	4-methylpyridine	4-methylpyridine	93.13	6	PubChem \| InChI \| Smiles	"2021101109391633945183" 11 Oct 2021
\|	Gly-L-Leu	Gly-L-Leu	188.22	4	PubChem \| InChI \| Smiles	"2023102407331698132805" 24 Oct 2023
\|	Peroxydisulfate	Peroxydisulfate	192.13	2	PubChem \| InChI \| Smiles	"2020102913551603979748" 29 Oct 2020
\|	per-Butyl Oxatub[4]arene	per-Butyl Oxatub[4]arene	1257.67	38	PubChem \| InChI \| Smiles	"2023031610321678962751" 16 Mar 2023
\|	semithio-Bambus[6]uril	semithio-Bambus[6]uril	1189.46	6	PubChem \| InChI \| Smiles	"2020081411331597404806" 14 Aug 2020
\|	Tetrafluoroborate	Tetrafluoroborate	86.81	7	PubChem \| InChI \| Smiles	"2021110119261635794765" 01 Nov 2021
\|	Diammonium salt c	Diammonium salt c	772.58	1	PubChem \| InChI \| Smiles	"2024072914101722262225" 29 Jul 2024
\|	MPCP	MPCP	427.30	23	PubChem \| InChI \| Smiles	"2021020408271612427260" 04 Feb 2021
\|	CB8	CB8	1329.12	673	PubChem \| InChI \| Smiles	"2021102520281635193696" 25 Oct 2021
\|	Berberine chloride	Berberine chloride	371.82	144	PubChem \| InChI \| Smiles	"2020100107151601536542" 01 Oct 2020
\|	24-crown-8 dimer	24-crown-8 dimer	1139.33	8	PubChem \| InChI \| Smiles	"2024072913461722260775" 29 Jul 2024
\|	Tetraethylammonium	Tetraethylammonium	130.25	2	PubChem \| InChI \| Smiles	"2023032008141679300058" 20 Mar 2023
\|	Tetramethylammonium iodide	Tetramethylammonium iodide	201.05	2	PubChem \| InChI \| Smiles	"2021101908081634630916" 19 Oct 2021
\|	2,2'-Bipyridine	2,2'-Bipyridine	156.18	3	PubChem \| InChI \| Smiles	"2021110215341635867262" 02 Nov 2021
\|	stCx4	stCx4	816.89	46	PubChem \| InChI \| Smiles	"2020092113541600696486" 21 Sep 2020
\|	(BuBr)2DAP	(BuBr)2DAP	476.25	3	PubChem \| InChI \| Smiles	"2024031308281710318493" 13 Mar 2024
\|	sCx4 sodium salt	sCx4 sodium salt	832.70	44	PubChem \| InChI \| Smiles	"2020092113561600696572" 21 Sep 2020
\|	Dibenzyldimethylammonium	Dibenzyldimethylammonium	226.34	1	PubChem \| InChI \| Smiles	"2023032008151679300121" 20 Mar 2023
\|	Ala-Lys-Trp-Ala-Ala	Ala-Lys-Trp-Ala-Ala	545.63	1	PubChem \| InChI \| Smiles	"2022062313181655990302" 23 Jun 2022
\|	NEt2coumarinCHO	NEt2coumarinCHO	245.27	2	PubChem \| InChI \| Smiles	"2022062814051656425146" 28 Jun 2022
\|	KTTK	KTTK	476.57	1	PubChem \| InChI \| Smiles	"2021102620041635278698" 26 Oct 2021
\|	I-	I-	126.90	49	PubChem \| InChI \| Smiles	"2021110416101636042221" 04 Nov 2021
\|	L-Leu-L-Ala	L-Leu-L-Ala	202.25	2	PubChem \| InChI \| Smiles	"2020102521421603662150" 25 Oct 2020
\|	2-methylpyridine	2-methylpyridine	93.13	6	PubChem \| InChI \| Smiles	"2021100116251633105513" 01 Oct 2021
\|	Dodecakis(5‐carboxypentyl)bambus[6]uril		2294.47	11	PubChem \| InChI \| Smiles	"2020091814081600438128" 18 Sep 2020
\|	Tetraethylammonium bromide	Tetraethylammonium bromide	210.16	1	PubChem \| InChI \| Smiles	"2021101907571634630233" 19 Oct 2021
\|	Dibucaine	Dibucaine	343.50	2	PubChem \| InChI \| Smiles	"2021100116091633104563" 01 Oct 2021
\|	Sesamol	Sesamol	138.12	3	PubChem \| InChI \| Smiles	"2021092907211632900110" 29 Sep 2021
\|	O,O′-Di-p-toluoyl-L-tartaric acid	O,O′-Di-p-toluoyl-L-tartaric acid	386.36	1	PubChem \| InChI \| Smiles	"2021093016171633018650" 30 Sep 2021
\|	Trp-Gly	Trp-Gly	261.28	1	PubChem \| InChI \| Smiles	"2021100814561633704963" 08 Oct 2021
\|	Pyridin-4-ylmethanamine	Pyridin-4-ylmethanamine	108.14	2	PubChem \| InChI \| Smiles	"2021092915181632928682" 29 Sep 2021
\|	Bu,NEt2coumarinCHO	Bu,NEt2coumarinCHO	301.40	9	PubChem \| InChI \| Smiles	"2022062814061656425184" 28 Jun 2022
\|	1,2-Phenylenediamine	1,2-Phenylenediamine	108.14	13	PubChem \| InChI \| Smiles	"2021092915141632928480" 29 Sep 2021
\|	[Ir(ppy-CH2NH2Bu)2(bpy)]3+	[Ir(ppy-CH2NH2Bu)2(bpy)]3+	831.10	2	PubChem \| InChI \| Smiles	"2022062913411656510118" 29 Jun 2022
\|	2-naphtalenecarboxylate	2-naphtalenecarboxylate	171.17	2	PubChem \| InChI \| Smiles	"2020103015501604073021" 30 Oct 2020
\|	1,4‐diaminocyclohexane	1,4‐diaminocyclohexane	114.19	6	PubChem \| InChI \| Smiles	"2020102616421603730528" 26 Oct 2020
\|	sCx4-NHTs	sCx4-NHTs	830.00	3	PubChem \| InChI \| Smiles	"2020100114391601563183" 01 Oct 2020
\|	Cx4R [4-]	Cx4R [4-]	540.59	3	PubChem \| InChI \| Smiles	"2022071106561657522596" 11 Jul 2022
\|	2,3-Dihydroxynaphthalene	2,3-Dihydroxynaphthalene	160.17	3	PubChem \| InChI \| Smiles	"2021093009251632993930" 30 Sep 2021
\|	1-binaphthalene bypyridinium dye	1-binaphthalene bypyridinium dye	682.85	3	PubChem \| InChI \| Smiles	"2023103109201698744038" 31 Oct 2023
\|	CB7	CB7	1162.98	717	PubChem \| InChI \| Smiles	"2021030510321614940336" 05 Mar 2021
\|	Propanediurea Clip	Propanediurea Clip	540.58	4	PubChem \| InChI \| Smiles	"2021081808181629274721" 18 Aug 2021
\|	bicyclo[2.2.1]heptan-2-yl)acetate	bicyclo[2.2.1]heptan-2-yl)acetate	153.20	2	PubChem \| InChI \| Smiles	"2020103016071604074027" 30 Oct 2020
\|	Cesium tetrakis[3,5-bis(trifluoromethyl)phenyl]borate		996.12	1	PubChem \| InChI \| Smiles	"2022111808551668761744" 18 Nov 2022
\|	Tubocurarine	Tubocurarine	609.74	2	PubChem \| InChI \| Smiles	"2020103109411604137319" 31 Oct 2020
\|	(Ferrocen-1-yl)methyltrimethylammonium		385.07	4	PubChem \| InChI \| Smiles	"2020102611481603712894" 26 Oct 2020
\|	Inverted CB[7]	Inverted CB[7]	1162.96	10	PubChem \| InChI \| Smiles	"2020110110421604227326" 01 Nov 2020
\|	3-binaphthalene bipyridinium dye	3-binaphthalene bipyridinium dye	795.06	4	PubChem \| InChI \| Smiles	"2023103109201698744022" 31 Oct 2023
\|	Gly-L-Val	Gly-L-Val	174.20	4	PubChem \| InChI \| Smiles	"2021093010041632996267" 30 Sep 2021
\|	Perchlorate	Perchlorate	99.45	7	PubChem \| InChI \| Smiles	"2020100519451601927127" 05 Oct 2020
\|	(Aminomethyl)trimethylsilane	(Aminomethyl)trimethylsilane	103.24	7	PubChem \| InChI \| Smiles	"2021092915171632928638" 29 Sep 2021
\|	2-binaphthalene bipyridinium dye	2-binaphthalene bipyridinium dye	738.96	4	PubChem \| InChI \| Smiles	"2023103109201698744058" 31 Oct 2023
\|	Tri(9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylic acid)-cyclophane		1065.20	12	PubChem \| InChI \| Smiles	"2020102314021603461761" 23 Oct 2020
\|	1-Adamantyl(trimethyl)ammonium	1-Adamantyl(trimethyl)ammonium	194.34	11	PubChem \| InChI \| Smiles	"2020100519081601924925" 05 Oct 2020
\|	11-aminoundecanoic acid	11-aminoundecanoic acid	201.31	4	PubChem \| InChI \| Smiles	"2021093014141633011296" 30 Sep 2021
\|	Melatonin	Melatonin	232.28	1	PubChem \| InChI \| Smiles	"2022070507431657006990" 05 Jul 2022
\|	L-Leu-Gly	L-Leu-Gly	188.22	2	PubChem \| InChI \| Smiles	"2020103109171604135859" 31 Oct 2020
\|	Dimethyl-(4-methylphenyl)sulfanium	Dimethyl-(4-methylphenyl)sulfanium	153.27	2	PubChem \| InChI \| Smiles	"2021092915161632928563" 29 Sep 2021
\|	1,8-naphthalimide dicarboxylate	1,8-naphthalimide dicarboxylate	402.31	4	PubChem \| InChI \| Smiles	"2020102213571603375021" 22 Oct 2020
\|	Citrate	Citrate	189.10	2	PubChem \| InChI \| Smiles	"2020102913001603976415" 29 Oct 2020
\|	PDI-bis(Et-Me2N-EtOH).2Br	PDI-bis(Et-Me2N-EtOH).2Br	782.52	1	PubChem \| InChI \| Smiles	"2022062910561656500188" 29 Jun 2022
\|	Guanidinium	Guanidinium	60.08	1	PubChem \| InChI \| Smiles	"2021101908161634631409" 19 Oct 2021
\|	TMSP-d4	TMSP-d4	150.00	18	PubChem \| InChI \| Smiles	"2020092209551600768527" 22 Sep 2020
\|	L-Val	L-Val	117.15	7	PubChem \| InChI \| Smiles	"2023102407281698132538" 24 Oct 2023
\|	N,N-dimethyl-N-(3-(trifluoromethyl)benzyl)-1-(3-(trifluoromethyl)phenyl)methanaminium		362.33	1	PubChem \| InChI \| Smiles	"2023030815471678290432" 08 Mar 2023
\|	RPV	RPV	908.19	1	PubChem \| InChI \| Smiles	"2020081213341597239260" 12 Aug 2020
\|	Dodecakis(3‐carboxypropyl)bambus[6]uril		1957.83	22	PubChem \| InChI \| Smiles	"2020091216531599929614" 12 Sep 2020
\|	N-(4-(tert-butyl)benzyl)-1-(4-(tert-butyl)phenyl)-N,N-dimethylmethanaminium		338.55	2	PubChem \| InChI \| Smiles	"2023030616291678120152" 06 Mar 2023
\|	Gly-L-Phe	Gly-L-Phe	222.24	4	PubChem \| InChI \| Smiles	"2020102521391603661948" 25 Oct 2020
\|	Epirubicin	Epirubicin	543.50	1	PubChem \| InChI \| Smiles	"2021101907561634630205" 19 Oct 2021
\|	Br-	Br-	79.90	23	PubChem \| InChI \| Smiles	"2021092207431632296634" 22 Sep 2021
\|	Dodeca(4-carboxybenzyl)bambus[6]uril	Dodeca(4-carboxybenzyl)bambus[6]uril	2534.34	41	PubChem \| InChI \| Smiles	"2020090910231599647009" 09 Sep 2020
\|	Isoquinolinium	Isoquinolinium	130.17	2	PubChem \| InChI \| Smiles	"2021101908091634630942" 19 Oct 2021
\|	Gly-Gly	Gly-Gly	132.12	3	PubChem \| InChI \| Smiles	"2021093009231632993836" 30 Sep 2021
\|	Tetrabutylammonium	Tetrabutylammonium	242.46	14	PubChem \| InChI \| Smiles	"2021102613071635253666" 26 Oct 2021
\|	Tetraethylammonium iodide	Tetraethylammonium iodide	257.16	9	PubChem \| InChI \| Smiles	"2021093011421633002144" 30 Sep 2021
\|	Rubidium nitrate	Rubidium nitrate	147.47	1	PubChem \| InChI \| Smiles	"2021101216221634055771" 12 Oct 2021
\|	Methylated Propanediurea Clip	Methylated Propanediurea Clip	596.69	9	PubChem \| InChI \| Smiles	"2021081808191629274766" 18 Aug 2021
\|	Di(9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylicacid)-cyclophane		895.03	18	PubChem \| InChI \| Smiles	"2020102313591603461561" 23 Oct 2020
\|	Insuline human	Insuline human	5808.00	2	PubChem \| InChI \| Smiles	"2020081213341597239254" 12 Aug 2020
\|	(E)-4-(4-(1,4-dioxa-7,13-dithia-10-azacyclopentadecan-10-yl)styryl)-1-methylpyridin-1-ium		445.66	1	PubChem \| InChI \| Smiles	"2020110410141604484843" 04 Nov 2020
\|	Dansyl Chloride	Dansyl Chloride	269.74	1	PubChem \| InChI \| Smiles	"2020111814511605711062" 18 Nov 2020
\|	6-amino hexanoic acid	6-amino hexanoic acid	131.17	4	PubChem \| InChI \| Smiles	"2021100814221633702932" 08 Oct 2021
\|	i-Cx4-3C	i-Cx4-3C	1115.12	5	PubChem \| InChI \| Smiles	"2020100114281601562524" 01 Oct 2020
\|	heptakis-O-(2-hydroxypropyl)-β Cyclodextrin		1541.55	19	PubChem \| InChI \| Smiles	"2020101209261602494810" 12 Oct 2020
\|	butylammonium	butylammonium	74.15	4	PubChem \| InChI \| Smiles	"2021092207511632297113" 22 Sep 2021
\|	Lithium perchlorate	Lithium perchlorate	106.40	14	PubChem \| InChI \| Smiles	"2020092210081600769325" 22 Sep 2020
\|	sCx6-sodium salt	sCx6-sodium salt	1249.00	14	PubChem \| InChI \| Smiles	"2020092312491600865399" 23 Sep 2020
\|	2,2-dimethyl-4-pentenoic acid	2,2-dimethyl-4-pentenoic acid	128.17	2	PubChem \| InChI \| Smiles	"2021100814561633705008" 08 Oct 2021
\|	Acyclic (sodium 3,3'-(1,4-phenylenebis(oxy))bis(propane-1-sulfonate) Cucurbiturils		1541.39	9	PubChem \| InChI \| Smiles	"2020101218121602526369" 12 Oct 2020
\|	sodium 1-pentanesulfonate	sodium 1-pentanesulfonate	174.20	1	PubChem \| InChI \| Smiles	"2024081508151723709717" 15 Aug 2024
\|	Gallamine	Gallamine	423.64	2	PubChem \| InChI \| Smiles	"2021092818221632853329" 28 Sep 2021
\|	PtC	PtC	593.12	1	PubChem \| InChI \| Smiles	"2023061414231686752584" 14 Jun 2023
\|	4-diadamantylcarboxylic acid	4-diadamantylcarboxylic acid	232.32	1	PubChem \| InChI \| Smiles	"2020102816331603902800" 28 Oct 2020
\|	Hydrogen iodide	Hydrogen iodide	127.91	1	PubChem \| InChI \| Smiles	"2020112714071606486022" 27 Nov 2020
\|	Thiane	Thiane	102.20	2	PubChem \| InChI \| Smiles	"2021101109311633944671" 11 Oct 2021
\|	Amantadine	Amantadine	151.25	15	PubChem \| InChI \| Smiles	"2021092208511632300671" 22 Sep 2021
\|	sodium 1-propanesulfonate	sodium 1-propanesulfonate	146.14	1	PubChem \| InChI \| Smiles	"2024081508141723709654" 15 Aug 2024
\|	1-Pentylammonium	1-Pentylammonium	88.17	10	PubChem \| InChI \| Smiles	"2020101616291602865747" 16 Oct 2020
\|	Acyclic sodium 4,4'-(naphthalene-1,4-diyl)bis(butane-1-sulfonate) Cucurbituril		1641.51	11	PubChem \| InChI \| Smiles	"2020100521251601933139" 05 Oct 2020
\|	P5A-CH2CH2NMe3	P5A-CH2CH2NMe3	2340.21	5	PubChem \| InChI \| Smiles	"2024081611311723807866" 16 Aug 2024
\|	sCx4-PhOMe	sCx4-PhOMe	767.80	3	PubChem \| InChI \| Smiles	"2020100114511601563874" 01 Oct 2020
\|	Ar	Ar	39.90	1	PubChem \| InChI \| Smiles	"2022070112201656678046" 01 Jul 2022
\|	1-Adamantylpyridinium bromide	1-Adamantylpyridinium bromide	294.24	6	PubChem \| InChI \| Smiles	"2020101611281602847698" 16 Oct 2020
\|	LAC	LAC	153.22	1	PubChem \| InChI \| Smiles	"2024080813501723125003" 08 Aug 2024
\|	Bis(aminomethyl)anilino-1H-1,3,5-triazin-2-one		337.40	8	PubChem \| InChI \| Smiles	"2020101210181602497908" 12 Oct 2020
\|	Phloroglucinol	Phloroglucinol	126.11	3	PubChem \| InChI \| Smiles	"2021093013141633007665" 30 Sep 2021
\|	1-propanol	1-propanol	60.10	6	PubChem \| InChI \| Smiles	"2021092820391632861579" 28 Sep 2021
\|	Naphthalene-receptor 1	Naphthalene-receptor 1	611.78	4	PubChem \| InChI \| Smiles	"2022021413311644845497" 14 Feb 2022
\|	Ammonia	Ammonia	17.03	1	PubChem \| InChI \| Smiles	"2021092907111632899463" 29 Sep 2021
\|	p-Benzoquinone	p-Benzoquinone	108.10	2	PubChem \| InChI \| Smiles	"2021092210001632304810" 22 Sep 2021
\|	Cu2+	Cu2+	63.55	3	PubChem \| InChI \| Smiles	"2021110416051636041940" 04 Nov 2021
\|	Ethanol	Ethanol	46.07	9	PubChem \| InChI \| Smiles	"2021093009211632993674" 30 Sep 2021
\|	1-carboxyadamantane	1-carboxyadamantane	180.25	36	PubChem \| InChI \| Smiles	"2024081409351723628155" 14 Aug 2024
\|	2,6-TNS	2,6-TNS	335.35	15	PubChem \| InChI \| Smiles	"2020092209591600768746" 22 Sep 2020
\|	1,3-Propandiammonium	1,3-Propandiammonium	76.14	3	PubChem \| InChI \| Smiles	"2020102615321603726356" 26 Oct 2020
\|	sCx4-PhMe	sCx4-PhMe	751.00	3	PubChem \| InChI \| Smiles	"2020100114421601563328" 01 Oct 2020
\|	CX4-CO-tBu-Pyrene	CX4-CO-tBu-Pyrene	1191.00	1	PubChem \| InChI \| Smiles	"2020100215141601651692" 02 Oct 2020
\|	Methyldioxolane	Methyldioxolane	88.11	2	PubChem \| InChI \| Smiles	"2022063014171656598667" 30 Jun 2022
\|	p-Toluic acid	p-Toluic acid	136.15	4	PubChem \| InChI \| Smiles	"2021101109291633944552" 11 Oct 2021
\|	Tetrabutylammonium dihydrogenphosphate		339.45	2	PubChem \| InChI \| Smiles	"2021101209391634031577" 12 Oct 2021
\|	4-DMABN	4-DMABN	146.19	6	PubChem \| InChI \| Smiles	"2021092209561632304570" 22 Sep 2021
\|	6-aminohexanoate	6-aminohexanoate	131.17	1	PubChem \| InChI \| Smiles	"2021101908141634631245" 19 Oct 2021
\|	Zinc chloride	Zinc chloride	136.30	4	PubChem \| InChI \| Smiles	"2021092815571632844630" 28 Sep 2021
\|	N6-Acetyllysine	N6-Acetyllysine	188.22	1	PubChem \| InChI \| Smiles	"2021092818491632854966" 28 Sep 2021
\|	oleate	oleate	281.50	1	PubChem \| InChI \| Smiles	"2021030309451614764721" 03 Mar 2021
\|	Sodium periodate	Sodium periodate	213.89	2	PubChem \| InChI \| Smiles	"2021100716451633625107" 07 Oct 2021
\|	1-Propylamine	1-Propylamine	60.12	8	PubChem \| InChI \| Smiles	"2020101609551602842152" 16 Oct 2020
\|	Guanidinocalix[5]arene pentadodecyl ether		1676.54	5	PubChem \| InChI \| Smiles	"2021021813511613656311" 18 Feb 2021
\|	sCx4-PhCN	sCx4-PhCN	762.75	5	PubChem \| InChI \| Smiles	"2020100114301601562645" 01 Oct 2020
\|	sCx5	sCx5	925.87	53	PubChem \| InChI \| Smiles	"2020092113511600696291" 21 Sep 2020
\|	3-Aminopropan-1-ol	3-Aminopropan-1-ol	75.11	1	PubChem \| InChI \| Smiles	"2023072409191690190370" 24 Jul 2023
\|	2,4,6-triphenylpyrylium tetrafluoroborate		396.20	2	PubChem \| InChI \| Smiles	"2021101908141634631280" 19 Oct 2021
\|	Tetrathiafulvalene	Tetrathiafulvalene	204.40	1	PubChem \| InChI \| Smiles	"2021102613491635256164" 26 Oct 2021
\|	Succinylcholine	Succinylcholine	290.40	4	PubChem \| InChI \| Smiles	"2021100116221633105368" 01 Oct 2021
\|	sCx4	sCx4	740.71	259	PubChem \| InChI \| Smiles	"2020110408291604478580" 04 Nov 2020
\|	(6E,9E,16E,19E)-1,5,15(1,4),11(4,1)-tetrapyridin-1-iuma-3,8,13,18(1,4)-tetrabenzenacycloicosaphane-6,9,16,19-tetraene-11,51,111,151-tetraium		777.01	3	PubChem \| InChI \| Smiles	"2021011215171610464679" 12 Jan 2021
\|	(2S)-2-((2S)-2-((2S)-2-(2-((3R)-2-amino-3-hydroxybutanamido)acetamido)propanamido)-3-phenylpropanamido)-4-methylpentanamide		506.60	1	PubChem \| InChI \| Smiles	"2022062411301656070232" 24 Jun 2022
\|	5-Amino-1-pentanol	5-Amino-1-pentanol	103.16	1	PubChem \| InChI \| Smiles	"2023072409181690190282" 24 Jul 2023
\|	Asymmetric dimethylarginine	Asymmetric dimethylarginine	202.25	3	PubChem \| InChI \| Smiles	"2020102720161603829800" 27 Oct 2020
\|	CB5	CB5	830.70	26	PubChem \| InChI \| Smiles	"2022070112031656677008" 01 Jul 2022
\|	3-aminopropionitrile	3-aminopropionitrile	70.09	1	PubChem \| InChI \| Smiles	"2023072409141690190064" 24 Jul 2023
\|	AARKSAPY	AARKSAPY	904.02	9	PubChem \| InChI \| Smiles	"2020101209321602495134" 12 Oct 2020
\|	Naph-Cu2+ 1	Naph-Cu2+ 1	719.42	10	PubChem \| InChI \| Smiles	"2022021413331644845583" 14 Feb 2022
\|	L-Leu-L-Phe	L-Leu-L-Phe	278.35	2	PubChem \| InChI \| Smiles	"2023102314431698072223" 23 Oct 2023
\|	Potassium tetrakis[3,5-bis(trifluoromethyl)phenyl]borate		902.31	1	PubChem \| InChI \| Smiles	"2021101908101634631008" 19 Oct 2021
\|	Boc-D-Ser	Boc-D-Ser	205.21	1	PubChem \| InChI \| Smiles	"2021093014471633013250" 30 Sep 2021
\|	Phenyl-β-D-galactopyranoside	Phenyl-β-D-galactopyranoside	256.25	4	PubChem \| InChI \| Smiles	"2020102820581603918718" 28 Oct 2020
\|	sMeCx4	sMeCx4	796.82	3	PubChem \| InChI \| Smiles	"2020100114561601564208" 01 Oct 2020
\|	((3R)-2-amino-3-hydroxybutanoyl)glycyl-L-alanyl-L-phenylalanyl-L-leucine		507.58	1	PubChem \| InChI \| Smiles	"2022062411321656070378" 24 Jun 2022
\|	Rhodamine B	Rhodamine B	479.02	38	PubChem \| InChI \| Smiles	"2020112009181605863919" 20 Nov 2020
\|	1-Adamantane acetate	1-Adamantane acetate	232.36	2	PubChem \| InChI \| Smiles	"2020081213341597239260" 12 Aug 2020
\|	Symmetric dimethylarginine	Symmetric dimethylarginine	202.25	2	PubChem \| InChI \| Smiles	"2020102913221603977738" 29 Oct 2020
\|	1,4-Butandiol	1,4-Butandiol	90.12	1	PubChem \| InChI \| Smiles	"2021100814281633703317" 08 Oct 2021
\|	Nickel chloride	Nickel chloride	129.60	4	PubChem \| InChI \| Smiles	"2021092815571632844665" 28 Sep 2021
\|	O-Benzyl-D-Ser	O-Benzyl-D-Ser	195.22	1	PubChem \| InChI \| Smiles	"2021102420171635106649" 24 Oct 2021
\|	(-)-camphor	(-)-camphor	152.23	10	PubChem \| InChI \| Smiles	"2020102919251603999554" 29 Oct 2020
\|	IR780	IR780	667.11	2	PubChem \| InChI \| Smiles	"2022063014461656600395" 30 Jun 2022
\|	Propionic acid	Propionic acid	74.08	1	PubChem \| InChI \| Smiles	"2022062412231656073433" 24 Jun 2022
\|	1,1'-(tetradecane-1,14-diyl)bis(1,4-diazabicyclo[2.2.2]octan-1-ium)		420.72	1	PubChem \| InChI \| Smiles	"2023042613281682515731" 26 Apr 2023
\|	Potassium nitrate	Potassium nitrate	101.10	1	PubChem \| InChI \| Smiles	"2021101216231634055793" 12 Oct 2021
\|	syn oxatube	syn oxatube	1021.24	12	PubChem \| InChI \| Smiles	"2023042512061682424407" 25 Apr 2023
\|	Lithium tetrafluoroborate	Lithium tetrafluoroborate	93.80	1	PubChem \| InChI \| Smiles	"2021101215441634053486" 12 Oct 2021
\|	SBE7-β-CD	SBE7-β-CD	2242.01	11	PubChem \| InChI \| Smiles	"2020101209181602494288" 12 Oct 2020
\|	sCx4-mono(CH2CO2H)	sCx4-mono(CH2CO2H)	797.00	11	PubChem \| InChI \| Smiles	"2020103008111604045499" 30 Oct 2020
\|	1-Pentanol	1-Pentanol	88.15	3	PubChem \| InChI \| Smiles	"2021101113041633957495" 11 Oct 2021
\|	RKme3ST	RKme3ST	574.69	3	PubChem \| InChI \| Smiles	"2020103108551604134513" 31 Oct 2020
\|	RKST	RKST	531.61	3	PubChem \| InChI \| Smiles	"2020103108531604134401" 31 Oct 2020
\|	propiononitrile	propiononitrile	55.08	1	PubChem \| InChI \| Smiles	"2021100814281633703296" 08 Oct 2021
\|	AO HCl	AO HCl	265.36	15	PubChem \| InChI \| Smiles	"2020092213101600780201" 22 Sep 2020
\|	sCx4-PhCONH2	sCx4-PhCONH2	780.80	5	PubChem \| InChI \| Smiles	"2020101213071602508046" 12 Oct 2020
\|	7-Methoxycoumarin	7-Methoxycoumarin	176.17	4	PubChem \| InChI \| Smiles	"2021093016281633019309" 30 Sep 2021
\|	Methyllysine	Methyllysine	160.21	5	PubChem \| InChI \| Smiles	"2020101616471602866863" 16 Oct 2020
\|	1,4-dihexyl-1,4-diazabicyclo[2.2.2]octane-1,4-diium		282.51	1	PubChem \| InChI \| Smiles	"2024042915011714402887" 29 Apr 2024
\|	Phenol	Phenol	94.11	10	PubChem \| InChI \| Smiles	"2021092209541632304496" 22 Sep 2021
\|	ceftazidime	ceftazidime	546.60	1	PubChem \| InChI \| Smiles	"2022070507361657006570" 05 Jul 2022
\|	Baicalin	Baicalin	446.40	9	PubChem \| InChI \| Smiles	"2020100718341602095648" 07 Oct 2020
\|	α-CD	α-CD	972.85	93	PubChem \| InChI \| Smiles	"2020092209261600766815" 22 Sep 2020
\|	1-benzyl-3-methylimidazolium bromide	1-benzyl-3-methylimidazolium bromide	253.14	1	PubChem \| InChI \| Smiles	"2022062914501656514229" 29 Jun 2022
\|	5-aminopentanoate	5-aminopentanoate	117.15	1	PubChem \| InChI \| Smiles	"2021101816401634575218" 18 Oct 2021
\|	cyclohexanaminium chloride	cyclohexanaminium chloride	135.64	13	PubChem \| InChI \| Smiles	"2020092213181600780707" 22 Sep 2020
\|	Benzamide	Benzamide	121.14	2	PubChem \| InChI \| Smiles	"2021093012581633006721" 30 Sep 2021
\|	Silver chloride	Silver chloride	143.32	4	PubChem \| InChI \| Smiles	"2020101610301602844235" 16 Oct 2020
\|	(S)-(+)-2-Phenylpropionic acid	(S)-(+)-2-Phenylpropionic acid	150.18	1	PubChem \| InChI \| Smiles	"2021093015271633015673" 30 Sep 2021
\|	1,1'-(undecane-1,11-diyl)bis(1,4-diazabicyclo[2.2.2]octan-1-ium)		378.64	1	PubChem \| InChI \| Smiles	"2023042613111682514665" 26 Apr 2023
\|	Phenolphthalein	Phenolphthalein	318.30	6	PubChem \| InChI \| Smiles	"2021102420511635108698" 24 Oct 2021
\|	2NpCH2ImidMe	2NpCH2ImidMe	303.20	4	PubChem \| InChI \| Smiles	"2022062914561656514567" 29 Jun 2022
\|	sCx4-Ph-2,3-diOMe	sCx4-Ph-2,3-diOMe	797.00	3	PubChem \| InChI \| Smiles	"2020100114401601563232" 01 Oct 2020
\|	Choline	Choline	104.17	11	PubChem \| InChI \| Smiles	"2021092819041632855887" 28 Sep 2021
\|	1,4-Dihydroxybenzene	1,4-Dihydroxybenzene	110.11	6	PubChem \| InChI \| Smiles	"2021092816071632845254" 28 Sep 2021
\|	1-Butanol	1-Butanol	74.12	6	PubChem \| InChI \| Smiles	"2021093013271633008458" 30 Sep 2021
\|	[C3mim]Br	[C3mim]Br	205.10	1	PubChem \| InChI \| Smiles	"2022062922501656543054" 29 Jun 2022
\|	sCx4-Ph	sCx4-Ph	737.74	5	PubChem \| InChI \| Smiles	"2020093016181601482707" 30 Sep 2020
\|	sMeCx5	sMeCx5	996.02	3	PubChem \| InChI \| Smiles	"2020100114591601564363" 01 Oct 2020
\|	Lucigenin	Lucigenin	510.50	108	PubChem \| InChI \| Smiles	"2020100107131601536412" 01 Oct 2020
\|	3-Methoxyphenol	3-Methoxyphenol	124.14	2	PubChem \| InChI \| Smiles	"2021092315031632409383" 23 Sep 2021
\|	(Z)-2-(3,5-bis(trifluoromethyl)phenyl)but-2-enenitrile		279.18	1	PubChem \| InChI \| Smiles	"2022111808441668761081" 18 Nov 2022
\|	bicyclo[2.2.2]octane-1,4-diyldimethanamine		168.28	1	PubChem \| InChI \| Smiles	"2021030213481614692908" 02 Mar 2021
\|	Pseudocyclopeptide iodide	Pseudocyclopeptide iodide	1023.34	4	PubChem \| InChI \| Smiles	"2020110116161604247381" 01 Nov 2020
\|	Bromocyclobutane	Bromocyclobutane	135.00	2	PubChem \| InChI \| Smiles	"2021101816421634575327" 18 Oct 2021
\|	sCx4-Br	sCx4-Br	743.57	5	PubChem \| InChI \| Smiles	"2020093016141601482475" 30 Sep 2020
\|	Bicyclo[2.2.2]octane-1,4-diyldimethanol		170.25	1	PubChem \| InChI \| Smiles	"2021093014121633011128" 30 Sep 2021
\|	bisurea-receptor	bisurea-receptor	718.90	4	PubChem \| InChI \| Smiles	"2022062723181656371881" 27 Jun 2022
\|	AARKme3SAPY	AARKme3SAPY	947.11	10	PubChem \| InChI \| Smiles	"2020101209341602495288" 12 Oct 2020
\|	4-Bromobenzoic acid	4-Bromobenzoic acid	201.02	1	PubChem \| InChI \| Smiles	"2021101215221634052171" 12 Oct 2021
\|	Dibenzofuran-polyethylene-glycol 2	Dibenzofuran-polyethylene-glycol 2	2209.60	2	PubChem \| InChI \| Smiles	"2022062308411655973664" 23 Jun 2022
\|	2,2'-dipyridine.HCl	2,2'-dipyridine.HCl	192.64	2	PubChem \| InChI \| Smiles	"2023112110561700564205" 21 Nov 2023
\|	sCx4-NO2	sCx4-NO2	706.00	4	PubChem \| InChI \| Smiles	"2020100114401601563210" 01 Oct 2020
\|	OMeQ[6]	OMeQ[6]	700.83	2	PubChem \| InChI \| Smiles	"2023112110501700563850" 21 Nov 2023
\|	P1	P1	2238.10	23	PubChem \| InChI \| Smiles	"2020091512281600172938" 15 Sep 2020
\|	N-Acetyl-D-Trp	N-Acetyl-D-Trp	246.27	2	PubChem \| InChI \| Smiles	"2020102817151603905323" 28 Oct 2020
\|	Lanthanum chloride heptahydrate	Lanthanum chloride heptahydrate	371.37	6	PubChem \| InChI \| Smiles	"2021092915201632928826" 29 Sep 2021
\|	1-methyl-3-[[6-[(3-methylimidazol-3-ium-1-yl)methyl]naphthalen-2-yl]methyl]imidazol-1-ium		318.42	11	PubChem \| InChI \| Smiles	"2020100520151601928936" 05 Oct 2020
\|	Nitric acid	Nitric acid	63.01	2	PubChem \| InChI \| Smiles	"2021092907271632900459" 29 Sep 2021
\|	dibromomethane	dibromomethane	173.83	1	PubChem \| InChI \| Smiles	"2022061416021655222529" 14 Jun 2022
\|	2-[13,29,32-Tris(carboxymethyl)-8,15,27,34-tetraoxo-2,21-dioxa-7,10,13,16,26,29,32,35-octazapentacyclo[34.2.2.23,6.217,20.222,25]hexatetraconta-1(38),3(46),4,6(45),17(44),18,20(43),22,24,36,39,41-dodecaen-10-yl]acetic acid		912.90	5	PubChem \| InChI \| Smiles	"2021021910221613730146" 19 Feb 2021
\|	2-Methoxyphenol	2-Methoxyphenol	124.14	2	PubChem \| InChI \| Smiles	"2021093013141633007695" 30 Sep 2021
\|	PDI-Bis(Et-Me2N-Et-OH)	PDI-Bis(Et-Me2N-Et-OH)	622.70	37	PubChem \| InChI \| Smiles	"2020092209331600767229" 22 Sep 2020
\|	propene	propene	42.08	2	PubChem \| InChI \| Smiles	"2020102911241603970662" 29 Oct 2020
\|	L-Phe-L-Ala	L-Phe-L-Ala	236.27	2	PubChem \| InChI \| Smiles	"2020102817131603905196" 28 Oct 2020
\|	2-PB	2-PB	195.22	6	PubChem \| InChI \| Smiles	"2024032620571711486662" 26 Mar 2024
\|	(R)-Mandelic acid	(R)-Mandelic acid	152.15	1	PubChem \| InChI \| Smiles	"2021102420231635107018" 24 Oct 2021
\|	MDPP	MDPP	358.44	36	PubChem \| InChI \| Smiles	"2020101213101602508244" 12 Oct 2020
\|	Anthracene-polyethylene-glycol	Anthracene-polyethylene-glycol	2277.72	2	PubChem \| InChI \| Smiles	"2022062308311655973091" 23 Jun 2022
\|	Aniline	Aniline	93.13	7	PubChem \| InChI \| Smiles	"2021092209531632304438" 22 Sep 2021
\|	N-(2-iodobenzyl)-1-(2-iodophenyl)-N,N-dimethylmethanaminium		0.00	1	PubChem \| InChI \| Smiles	"2023030910571678359479" 09 Mar 2023
\|	1-BROMOPROPANE	1-BROMOPROPANE	122.99	1	PubChem \| InChI \| Smiles	"2022061416031655222582" 14 Jun 2022
\|	o-(H)2-1.1.1	o-(H)2-1.1.1	338.35	3	PubChem \| InChI \| Smiles	"2020101212141602504842" 12 Oct 2020
\|	2,4-diammoniumbutanoate	2,4-diammoniumbutanoate	117.15	1	PubChem \| InChI \| Smiles	"2022062412461656074819" 24 Jun 2022
\|	Indole	Indole	117.15	12	PubChem \| InChI \| Smiles	"2021092210011632304868" 22 Sep 2021
\|	sCx4-mono(CH2CONH2)	sCx4-mono(CH2CONH2)	797.75	11	PubChem \| InChI \| Smiles	"2020103008221604046133" 30 Oct 2020
\|	1-Acetamidonaphthalene	1-Acetamidonaphthalene	185.22	1	PubChem \| InChI \| Smiles	"2021093015031633014233" 30 Sep 2021
\|	(1S,2S,3R,5S)-(+)-Pinanediol	(1S,2S,3R,5S)-(+)-Pinanediol	170.25	1	PubChem \| InChI \| Smiles	"2021102420261635107173" 24 Oct 2021
\|	L-Phe-Ala-methyl ester HCl	L-Phe-Ala-methyl ester HCl	215.68	1	PubChem \| InChI \| Smiles	"2021093016241633019044" 30 Sep 2021
\|	2,7-Dihydroxynaphthalene	2,7-Dihydroxynaphthalene	160.17	4	PubChem \| InChI \| Smiles	"2021092210401632307208" 22 Sep 2021
\|	(+)-camphor	(+)-camphor	152.23	11	PubChem \| InChI \| Smiles	"2020102919261603999586" 29 Oct 2020
\|	Propane	Propane	44.10	2	PubChem \| InChI \| Smiles	"2021101113061633957615" 11 Oct 2021
\|	1-benzyl-1,4-diazabicyclo[2.2.2]octan-1-ium		203.30	3	PubChem \| InChI \| Smiles	"2024043010031714471393" 30 Apr 2024
\|	N-acetyl-D-tyrosine	N-acetyl-D-tyrosine	223.23	1	PubChem \| InChI \| Smiles	"2021093015291633015747" 30 Sep 2021
\|	Cx4-NH2	Cx4-NH2	484.55	3	PubChem \| InChI \| Smiles	"2020112008551605862526" 20 Nov 2020
\|	N1,N6-dimethylhex...	N1,N6-dimethylhex...	217.18	1	PubChem \| InChI \| Smiles	"2024030613111709730660" 06 Mar 2024
\|	(1R,3S)-Camphoric acid	(1R,3S)-Camphoric acid	200.23	1	PubChem \| InChI \| Smiles	"2021102420341635107650" 24 Oct 2021
\|	Coptisine	Coptisine	320.32	5	PubChem \| InChI \| Smiles	"2020101616551602867334" 16 Oct 2020
\|	pirarubicin	pirarubicin	627.60	1	PubChem \| InChI \| Smiles	"2021093007591632988742" 30 Sep 2021
\|	Ibuprofen sodium	Ibuprofen sodium	228.26	3	PubChem \| InChI \| Smiles	"2024081614251723818301" 16 Aug 2024
\|	1,3-phenylenedimethanaminium chloride	1,3-phenylenedimethanaminium chloride	209.12	1	PubChem \| InChI \| Smiles	"2022072008171658305057" 20 Jul 2022
\|	sCx6-C8	sCx6-C8	1922.27	1	PubChem \| InChI \| Smiles	"2020100115531601567628" 01 Oct 2020
\|	1-Adamantanol	1-Adamantanol	152.23	35	PubChem \| InChI \| Smiles	"2023072409151690190155" 24 Jul 2023
\|	Dodecyltrimethylammonium bromide	Dodecyltrimethylammonium bromide	308.34	3	PubChem \| InChI \| Smiles	"2021092816121632845530" 28 Sep 2021
\|	Acridine red	Acridine red	274.75	8	PubChem \| InChI \| Smiles	"2020101119341602444889" 11 Oct 2020
\|	Lithium chloride	Lithium chloride	42.40	3	PubChem \| InChI \| Smiles	"2021092315051632409542" 23 Sep 2021
\|	4-Methoxyphenol	4-Methoxyphenol	124.14	3	PubChem \| InChI \| Smiles	"2021093012591633006791" 30 Sep 2021
\|	Chloroform-D	Chloroform-D	120.38	1	PubChem \| InChI \| Smiles	"2022061416031655222609" 14 Jun 2022
\|	1-Methylhexylammonium	1-Methylhexylammonium	116.00	2	PubChem \| InChI \| Smiles	"2020103016541604076869" 30 Oct 2020
\|	3-Cyanophenol	3-Cyanophenol	119.12	2	PubChem \| InChI \| Smiles	"2021093013021633006924" 30 Sep 2021
\|	Propylamine	Propylamine	59.11	1	PubChem \| InChI \| Smiles	"2021093010021632996179" 30 Sep 2021
\|	sCx4-mono(C2H4NH2)	sCx4-mono(C2H4NH2)	783.00	11	PubChem \| InChI \| Smiles	"2020103008211604046111" 30 Oct 2020
\|	5-[4-(2-dihydroxyboryl-benzyl-N-methylamino)-butyroylamino]-m-xylylene bisphosphonic acid dimethyl ester dilithium salt		554.13	9	PubChem \| InChI \| Smiles	"2020100718581602097100" 07 Oct 2020
\|	3-Chlorobenzoic acid	3-Chlorobenzoic acid	156.56	1	PubChem \| InChI \| Smiles	"2021100116191633105186" 01 Oct 2021
\|	Methylamine	Methylamine	31.06	1	PubChem \| InChI \| Smiles	"2021093010061632996414" 30 Sep 2021
\|	Oxazine 1	Oxazine 1	324.40	4	PubChem \| InChI \| Smiles	"2020102216451603385139" 22 Oct 2020
\|	D,L-Noradrenaline	D,L-Noradrenaline	169.18	4	PubChem \| InChI \| Smiles	"2021100111311633087916" 01 Oct 2021
\|	silicon(IV) phthalocyanine	silicon(IV) phthalocyanine	746.93	5	PubChem \| InChI \| Smiles	"2020112311141606130094" 23 Nov 2020
\|	sCx4-12C	sCx4-12C	1413.98	7	PubChem \| InChI \| Smiles	"2020100115041601564660" 01 Oct 2020
\|	Amylamine	Amylamine	87.16	1	PubChem \| InChI \| Smiles	"2021093010071632996477" 30 Sep 2021
\|	5-[4-[2-(dihydroxyboryl)benzylaminomethyl]benzoylamino]-1,3-xylylenebis(phosphonic acid lithium methyl) ester salt		588.20	9	PubChem \| InChI \| Smiles	"2020100719051602097548" 07 Oct 2020
\|	[3,4,7,8-tetramethyl-1,10-phenanthroline][1,7-bis[4(4′-methyl-2,2′-bipyridyl)]heptane]ruthenium(II)		745.94	1	PubChem \| InChI \| Smiles	"2021022816521614531143" 28 Feb 2021
\|	5-[4-(2-dihydroxyboryl-benzylamino)-butyroylamino]-m-xylylene bisphosphonic acid dimethyl ester dilithium salt		540.10	9	PubChem \| InChI \| Smiles	"2020100718561602097002" 07 Oct 2020
\|	Alizarin complexone	Alizarin complexone	385.30	15	PubChem \| InChI \| Smiles	"2020092210071600769262" 22 Sep 2020
\|	Oxaliplatin	Oxaliplatin	395.30	4	PubChem \| InChI \| Smiles	"2021092909461632908774" 29 Sep 2021
\|	1-benzylpyridin-1-ium	1-benzylpyridin-1-ium	170.23	3	PubChem \| InChI \| Smiles	"2024043010151714472136" 30 Apr 2024
\|	aCx4-Bz-COOH	aCx4-Bz-COOH	1016.96	15	PubChem \| InChI \| Smiles	"2020112009071605863238" 20 Nov 2020
\|	cis-4-methylcyclohexanol	cis-4-methylcyclohexanol	114.19	1	PubChem \| InChI \| Smiles	"2022062412411656074486" 24 Jun 2022
\|	9-carboxytriamantane	9-carboxytriamantane	284.39	5	PubChem \| InChI \| Smiles	"2020102208591603357168" 22 Oct 2020
\|	6,7-dihydrodipyrido[1,2-a:2',1'-c]pyrazine-5,8-diium		184.24	1	PubChem \| InChI \| Smiles	"2023063014341688135654" 30 Jun 2023
\|	1-Methyl-3-phenylpropylamine	1-Methyl-3-phenylpropylamine	149.24	1	PubChem \| InChI \| Smiles	"2021102420351635107737" 24 Oct 2021
\|	bis(3-phenylpropanoyloxy)iodate(I)	bis(3-phenylpropanoyloxy)iodate(I)	425.24	1	PubChem \| InChI \| Smiles	"2020081213341597239261" 12 Aug 2020
\|	Cycloheptanol	Cycloheptanol	114.19	2	PubChem \| InChI \| Smiles	"2021101109381633945103" 11 Oct 2021
\|	4-Bromophenol	4-Bromophenol	173.01	4	PubChem \| InChI \| Smiles	"2021092816001632844809" 28 Sep 2021
\|	Ethanamine	Ethanamine	45.08	1	PubChem \| InChI \| Smiles	"2021093010101632996647" 30 Sep 2021
\|	4-diadamantylcarboxylic acid	4-diadamantylcarboxylic acid	232.32	6	PubChem \| InChI \| Smiles	"2024081409201723627233" 14 Aug 2024
\|	(3r,5r,7r)-1-benzyl-1,3,5,7-tetraazaadamantan-1-ium		231.32	3	PubChem \| InChI \| Smiles	"2024042913261714397219" 29 Apr 2024
\|	D-glutamic acid	D-glutamic acid	147.13	1	PubChem \| InChI \| Smiles	"2022021413231644845016" 14 Feb 2022
\|	Azanylpropyl trimethyl silane	Azanylpropyl trimethyl silane	162.35	1	PubChem \| InChI \| Smiles	"2023083107261693466776" 31 Aug 2023
\|	Ir(III)[phen]3	Ir(III)[phen]3	732.83	2	PubChem \| InChI \| Smiles	"2021031009091615367390" 10 Mar 2021
\|	Bis(3,5-dimethoxybenzyl)-4,4′-bipyridinium		458.55	2	PubChem \| InChI \| Smiles	"2020102913141603977294" 29 Oct 2020
\|	Lys-Ala-Trp-Ala-Ala	Lys-Ala-Trp-Ala-Ala	545.63	1	PubChem \| InChI \| Smiles	"2022062412021656072154" 24 Jun 2022
\|	N-TEG-N'-(3,5-dimethylbenzyl)-4,4'-bipyridinium		422.56	3	PubChem \| InChI \| Smiles	"2020102213431603374212" 22 Oct 2020
\|	4-Methylbenzylamine	4-Methylbenzylamine	121.18	10	PubChem \| InChI \| Smiles	"2021092208521632300769" 22 Sep 2021
\|	3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-6-ethyl-4-hydroxy-7-methoxy-2H-chromen-2-onety		354.36	1	PubChem \| InChI \| Smiles	"2022062412371656074258" 24 Jun 2022
\|	1,4-Phenylenedimethanamine dihydrochloride		209.11	1	PubChem \| InChI \| Smiles	"2024031216321710261157" 12 Mar 2024
\|	(S)-Propranolol hydrochloride	(S)-Propranolol hydrochloride	295.81	3	PubChem \| InChI \| Smiles	"2020102613261603718813" 26 Oct 2020
\|	((S)-2-amino-3-(4-(aminomethyl)phenyl)propanoyl)-L-methionine		325.43	1	PubChem \| InChI \| Smiles	"2021092915461632930419" 29 Sep 2021
\|	1-Heptylamine	1-Heptylamine	115.22	1	PubChem \| InChI \| Smiles	"2021093011431633002213" 30 Sep 2021
\|	Hexylammonium	Hexylammonium	102.20	8	PubChem \| InChI \| Smiles	"2020102612161603714612" 26 Oct 2020
\|	bis(acetoxy)iodate(I)	bis(acetoxy)iodate(I)	244.99	2	PubChem \| InChI \| Smiles	"2020103016031604073804" 30 Oct 2020
\|	Met-Lys-Val-Gly-Tyr	Met-Lys-Val-Gly-Tyr	596.74	1	PubChem \| InChI \| Smiles	"2022062411551656071745" 24 Jun 2022
\|	[C6mim]Cl	[C6mim]Cl	202.72	1	PubChem \| InChI \| Smiles	"2022062922481656542925" 29 Jun 2022
\|	D-Phe-Ala-methyl ester HCl	D-Phe-Ala-methyl ester HCl	215.68	1	PubChem \| InChI \| Smiles	"2021093016241633019078" 30 Sep 2021
\|	Diquat	Diquat	184.24	10	PubChem \| InChI \| Smiles	"2022062411191656069547" 24 Jun 2022
\|	Pyrenyl-polyethylene-glycol	Pyrenyl-polyethylene-glycol	2213.64	2	PubChem \| InChI \| Smiles	"2022062411531656071626" 24 Jun 2022
\|	Ir(III)[bpy]3	Ir(III)[bpy]3	660.77	2	PubChem \| InChI \| Smiles	"2021031009001615366816" 10 Mar 2021
\|	(S)-3-Phenyllactic acid	(S)-3-Phenyllactic acid	166.18	1	PubChem \| InChI \| Smiles	"2021093016221633018934" 30 Sep 2021
\|	2-naphthol	2-naphthol	144.17	6	PubChem \| InChI \| Smiles	"2022070223251656804331" 02 Jul 2022
\|	N-Acetyl-L-glutamic acid	N-Acetyl-L-glutamic acid	189.17	2	PubChem \| InChI \| Smiles	"2021102516421635180125" 25 Oct 2021
\|	Me12BU	Me12BU	1093.10	17	PubChem \| InChI \| Smiles	"2020091509091600160998" 15 Sep 2020
\|	Thr-Gly-Ser-Phe-M...	Thr-Gly-Ser-Phe-M...	540.63	1	PubChem \| InChI \| Smiles	"2022062411281656070124" 24 Jun 2022
\|	TBACl	TBACl	277.90	16	PubChem \| InChI \| Smiles	"2022062100151655770541" 21 Jun 2022
\|	(R)-Camphorquinone-3-oxime	(R)-Camphorquinone-3-oxime	181.24	2	PubChem \| InChI \| Smiles	"2020102720311603830703" 27 Oct 2020
\|	Aluminum trichloride	Aluminum trichloride	133.34	3	PubChem \| InChI \| Smiles	"2021092815591632844740" 28 Sep 2021
\|	1,1'-(1,4-phenylenebis(methylene))bis(pyridin-1-ium-4-carboxylate)		348.35	2	PubChem \| InChI \| Smiles	"2022062307481655970535" 23 Jun 2022
\|	Cinchonidine	Cinchonidine	294.39	12	PubChem \| InChI \| Smiles	"2020100318051601748340" 03 Oct 2020
\|	Sodium hydrosulfide hydrate	Sodium hydrosulfide hydrate	74.08	6	PubChem \| InChI \| Smiles	"2021093008241632990250" 30 Sep 2021
\|	sCx4-di(CH2COOH)	sCx4-di(CH2COOH)	856.00	1	PubChem \| InChI \| Smiles	"2020100207341601624041" 02 Oct 2020
\|	bisurea-receptor-F	bisurea-receptor-F	736.90	4	PubChem \| InChI \| Smiles	"2022062723171656371834" 27 Jun 2022
\|	Barium chloride	Barium chloride	208.23	4	PubChem \| InChI \| Smiles	"2020101610261602843999" 16 Oct 2020
\|	trans-2-Hexenoic acid	trans-2-Hexenoic acid	114.14	2	PubChem \| InChI \| Smiles	"2021092821561632866162" 28 Sep 2021
\|	N,N,N-trimethyl-1-phenylmethanaminium	N,N,N-trimethyl-1-phenylmethanaminium	150.24	3	PubChem \| InChI \| Smiles	"2024043013341714484059" 30 Apr 2024
\|	Ru(II)[bpy]3	Ru(II)[bpy]3	569.60	2	PubChem \| InChI \| Smiles	"2021031008591615366780" 10 Mar 2021
\|	Bn12BU	Bn12BU	2006.23	34	PubChem \| InChI \| Smiles	"2020090913151599657313" 09 Sep 2020
\|	MV0	MV0	186.25	4	PubChem \| InChI \| Smiles	"2024032712111711541493" 27 Mar 2024
\|	1,1'-(1,4-phenylenebis(methylene))bis(pyridin-1-ium-3-carboxylate)		348.35	2	PubChem \| InChI \| Smiles	"2022062407191656055176" 24 Jun 2022
\|	Ru(II)[phen]3	Ru(II)[phen]3	641.70	2	PubChem \| InChI \| Smiles	"2021101216261634056008" 12 Oct 2021
\|	Pt2-18C6	Pt2-18C6	1613.07	1	PubChem \| InChI \| Smiles	"2022071122361657578961" 11 Jul 2022
\|	CB10	CB10	1661.40	16	PubChem \| InChI \| Smiles	"2021021708481613551739" 17 Feb 2021
\|	Mitoxantrone	Mitoxantrone	444.50	5	PubChem \| InChI \| Smiles	"2022062814521656427971" 28 Jun 2022
\|	(s)-(-)-perillic acid	(s)-(-)-perillic acid	166.22	4	PubChem \| InChI \| Smiles	"2021093012521633006361" 30 Sep 2021
\|	L-cysteine	L-cysteine	121.16	1	PubChem \| InChI \| Smiles	"2022101807331666078412" 18 Oct 2022
\|	(cobaltocene)+	(cobaltocene)+	189.12	2	PubChem \| InChI \| Smiles	"2023011014221673360563" 10 Jan 2023
\|	mPheCB[6]	mPheCB[6]	1100.97	5	PubChem \| InChI \| Smiles	"2021093008181632989889" 30 Sep 2021
\|	MVE	MVE	212.13	13	PubChem \| InChI \| Smiles	"2020100311081601723321" 03 Oct 2020
\|	cyclometalated [N,C,N-Pt(II)] framework		901.37	1	PubChem \| InChI \| Smiles	"2022070407461656920769" 04 Jul 2022
\|	γ-CD	γ-CD	1297.13	44	PubChem \| InChI \| Smiles	"2020092209391600767598" 22 Sep 2020
\|	N-benzyl-N,N-dimethylpropan-1-aminium	N-benzyl-N,N-dimethylpropan-1-aminium	178.29	3	PubChem \| InChI \| Smiles	"2024043011451714477505" 30 Apr 2024
\|	Methylarginine	Methylarginine	188.23	1	PubChem \| InChI \| Smiles	"2021101908111634631080" 19 Oct 2021
\|	p-Iodophenol	p-Iodophenol	220.01	4	PubChem \| InChI \| Smiles	"2021092816191632845952" 28 Sep 2021
\|	Quinine	Quinine	324.42	12	PubChem \| InChI \| Smiles	"2020100318071601748457" 03 Oct 2020
\|	[{Ru(phen)2}2bb5] 4	[{Ru(phen)2}2bb5] 4	1331.50	1	PubChem \| InChI \| Smiles	"2021022817291614533379" 28 Feb 2021
\|	1-hexylpyridin-1-ium	1-hexylpyridin-1-ium	164.27	1	PubChem \| InChI \| Smiles	"2023063014101688134200" 30 Jun 2023
\|	Sulfonate phenylg...	Sulfonate phenylg...	2200.00	1	PubChem \| InChI \| Smiles	"2020082514061598364371" 25 Aug 2020
\|	L-Tyrosyl-L-Lysyl-L-Alanine	L-Tyrosyl-L-Lysyl-L-Alanine	380.44	1	PubChem \| InChI \| Smiles	"2023090513351693920958" 05 Sep 2023
\|	bisurea-receptor-tBu	bisurea-receptor-tBu	775.00	4	PubChem \| InChI \| Smiles	"2022062723151656371727" 27 Jun 2022
\|	N-(4-iodobenzyl)-1-(4-iodophenyl)-N,N-dimethylmethanaminium		478.13	7	PubChem \| InChI \| Smiles	"2023030614171678112222" 06 Mar 2023
\|	TBAI	TBAI	369.37	12	PubChem \| InChI \| Smiles	"2022062723571656374235" 27 Jun 2022
\|	DMAE-NDI dication	DMAE-NDI dication	409.46	2	PubChem \| InChI \| Smiles	"2021090716011631030498" 07 Sep 2021
\|	3-Trimethylsilylpropanoic acid	3-Trimethylsilylpropanoic acid	146.26	1	PubChem \| InChI \| Smiles	"2021093013311633008683" 30 Sep 2021
\|	4-Methylpentanoic acid	4-Methylpentanoic acid	116.16	2	PubChem \| InChI \| Smiles	"2021101215231634052235" 12 Oct 2021
\|	4-Chlorobenzoic acid	4-Chlorobenzoic acid	156.56	3	PubChem \| InChI \| Smiles	"2021101215201634052040" 12 Oct 2021
\|	Quinidine	Quinidine	324.42	12	PubChem \| InChI \| Smiles	"2020100318111601748664" 03 Oct 2020
\|	Ac-GGK-OH	Ac-GGK-OH	302.33	1	PubChem \| InChI \| Smiles	"2021102612571635253028" 26 Oct 2021
\|	N,N,N-trimethyladamantan-1-aminium iodide		321.24	2	PubChem \| InChI \| Smiles	"2020122109151608542143" 21 Dec 2020
\|	L-tyrosyl-L-alanyl-L-leucine	L-tyrosyl-L-alanyl-L-leucine	365.42	1	PubChem \| InChI \| Smiles	"2023102415471698162456" 24 Oct 2023
\|	D-phenylalanine amide	D-phenylalanine amide	164.20	1	PubChem \| InChI \| Smiles	"2021093009261632993966" 30 Sep 2021
\|	bisurea-receptor-NO2	bisurea-receptor-NO2	763.90	4	PubChem \| InChI \| Smiles	"2022062723141656371686" 27 Jun 2022
\|	N-benzyl-N,N-dimethylbutan-1-aminium	N-benzyl-N,N-dimethylbutan-1-aminium	192.32	3	PubChem \| InChI \| Smiles	"2024043011501714477849" 30 Apr 2024
\|	Bromochloromethane	Bromochloromethane	129.38	1	PubChem \| InChI \| Smiles	"2022061416031655222629" 14 Jun 2022
\|	H33342	H33342	452.55	8	PubChem \| InChI \| Smiles	"2022110410391667558396" 04 Nov 2022
\|	tetramethylammonium hexafluorophosphate(V)		219.11	1	PubChem \| InChI \| Smiles	"2023030616331678120411" 06 Mar 2023
\|	Cinchonine	Cinchonine	294.39	13	PubChem \| InChI \| Smiles	"2020100318091601748567" 03 Oct 2020
\|	1,10-Diaminodecane	1,10-Diaminodecane	172.31	2	PubChem \| InChI \| Smiles	"2021102512241635164683" 25 Oct 2021
\|	2-Methyl-4-pentenoic acid	2-Methyl-4-pentenoic acid	114.14	2	PubChem \| InChI \| Smiles	"2021100815011633705318" 08 Oct 2021
\|	Cyclopentanecarboxylic acid	Cyclopentanecarboxylic acid	114.14	1	PubChem \| InChI \| Smiles	"2021102515141635174897" 25 Oct 2021
\|	Zorb[4]arene	Zorb[4]arene	1257.67	24	PubChem \| InChI \| Smiles	"2023011010351673346912" 10 Jan 2023
\|	Chlorpromazine hydrochloride	Chlorpromazine hydrochloride	355.30	7	PubChem \| InChI \| Smiles	"2020101617441602870296" 16 Oct 2020
\|	(R)-Propranolol hydrochloride	(R)-Propranolol hydrochloride	295.81	1	PubChem \| InChI \| Smiles	"2020102616581603731511" 26 Oct 2020
\|	bisurea-receptor-OMe	bisurea-receptor-OMe	748.90	4	PubChem \| InChI \| Smiles	"2022062723161656371797" 27 Jun 2022
\|	Cycloheptanecarboxylic acid	Cycloheptanecarboxylic acid	142.20	2	PubChem \| InChI \| Smiles	"2021101215221634052121" 12 Oct 2021
\|	DSMI	DSMI	366.24	25	PubChem \| InChI \| Smiles	"2020092209531600768408" 22 Sep 2020
\|	(R)-(-)-1-Cyclohexylethylamine	(R)-(-)-1-Cyclohexylethylamine	127.23	1	PubChem \| InChI \| Smiles	"2021093014481633013281" 30 Sep 2021
\|	Valethamate bromide	Valethamate bromide	386.40	5	PubChem \| InChI \| Smiles	"2021092813561632837409" 28 Sep 2021
\|	Benzenemethanaminium, N,N,N-tripropyl-		234.40	1	PubChem \| InChI \| Smiles	"2024043012041714478660" 30 Apr 2024
\|	(R)-(-)-3-Bromo-2-methyl-1-propanol	(R)-(-)-3-Bromo-2-methyl-1-propanol	153.02	1	PubChem \| InChI \| Smiles	"2021093015061633014398" 30 Sep 2021
\|	Bromocyclohexane	Bromocyclohexane	163.06	5	PubChem \| InChI \| Smiles	"2021092813551632837343" 28 Sep 2021
\|	Iron(2+)	Iron(2+)	55.84	5	PubChem \| InChI \| Smiles	"2022111715371668699453" 17 Nov 2022
\|	bisurea-receptor-NMe2	bisurea-receptor-NMe2	761.90	4	PubChem \| InChI \| Smiles	"2022062723141656371658" 27 Jun 2022
\|	N-benzyl-N,N-dimethyl-1-phenylmethanaminium		226.34	4	PubChem \| InChI \| Smiles	"2024043011591714478352" 30 Apr 2024
\|	5-Hexenoic acid	5-Hexenoic acid	114.14	2	PubChem \| InChI \| Smiles	"2021100515551633449337" 05 Oct 2021
\|	sCx5-12C	sCx5-12C	1767.48	2	PubChem \| InChI \| Smiles	"2021082312261629721599" 23 Aug 2021
\|	[Ir(I)(ppy)2(bpy)]+	[Ir(I)(ppy)2(bpy)]+	708.81	2	PubChem \| InChI \| Smiles	"2021102107451634802347" 21 Oct 2021
\|	TBAnitrate	TBAnitrate	304.47	7	PubChem \| InChI \| Smiles	"2022070507321657006337" 05 Jul 2022
\|	Tetramethylrhodamine	Tetramethylrhodamine	386.45	1	PubChem \| InChI \| Smiles	"2020102721091603832976" 27 Oct 2020
\|	bisurea-receptor-Cl	bisurea-receptor-Cl	753.30	4	PubChem \| InChI \| Smiles	"2022062723131656371616" 27 Jun 2022
\|	Tyramine hydrochloride	Tyramine hydrochloride	173.64	7	PubChem \| InChI \| Smiles	"2021092907131632899602" 29 Sep 2021
\|	Resorcinol	Resorcinol	110.11	3	PubChem \| InChI \| Smiles	"2021093010061632996382" 30 Sep 2021
\|	sCx6-mono(CH2CO2H)	sCx6-mono(CH2CO2H)	1169.00	11	PubChem \| InChI \| Smiles	"2020103008211604046118" 30 Oct 2020
\|	Histamine	Histamine	111.15	11	PubChem \| InChI \| Smiles	"2020101119511602445878" 11 Oct 2020
\|	1,4-diazabicyclo[2.2.2]octane	1,4-diazabicyclo[2.2.2]octane	112.17	4	PubChem \| InChI \| Smiles	"2020102219171603394247" 22 Oct 2020
\|	[4,4′-Dimethyl-2,2′-dipyridyl]bis[2-(2-pyridinyl-N)phenyl-C]iridium(I)		686.85	2	PubChem \| InChI \| Smiles	"2021030513501614952204" 05 Mar 2021
\|	TMSP	TMSP	150.28	1	PubChem \| InChI \| Smiles	"2022082415041661353461" 24 Aug 2022
\|	naloxone	naloxone	327.40	1	PubChem \| InChI \| Smiles	"2024081613301723815033" 16 Aug 2024
\|	Cx4P-bis(Ph-CCH)	Cx4P-bis(Ph-CCH)	600.79	2	PubChem \| InChI \| Smiles	"2020100115211601565705" 01 Oct 2020
\|	Au-Cx5P-PTA	Au-Cx5P-PTA	953.91	2	PubChem \| InChI \| Smiles	"2020100115221601565766" 01 Oct 2020
\|	N-Phenyl-2-naphthylammonium cation	N-Phenyl-2-naphthylammonium cation	220.29	3	PubChem \| InChI \| Smiles	"2020102618281603736897" 26 Oct 2020
\|	Diisopropyl methylphosphonate	Diisopropyl methylphosphonate	180.18	4	PubChem \| InChI \| Smiles	"2022063008361656578186" 30 Jun 2022
\|	Pyridine	Pyridine	79.10	8	PubChem \| InChI \| Smiles	"2021092813491632836991" 28 Sep 2021
\|	Isohexane	Isohexane	86.18	2	PubChem \| InChI \| Smiles	"2021100116171633105039" 01 Oct 2021
\|	N-benzylethanaminium	N-benzylethanaminium	136.21	3	PubChem \| InChI \| Smiles	"2024043012311714480308" 30 Apr 2024
\|	sCx6	sCx6	1111.06	86	PubChem \| InChI \| Smiles	"2020092113421600695754" 21 Sep 2020
\|	Pancuronium	Pancuronium	572.88	10	PubChem \| InChI \| Smiles	"2020100518381601923110" 05 Oct 2020
\|	N,N-dimethyl-1-phenylmethanaminium	N,N-dimethyl-1-phenylmethanaminium	136.21	3	PubChem \| InChI \| Smiles	"2024043013241714483480" 30 Apr 2024
\|	Bromocyclopentane	Bromocyclopentane	149.03	5	PubChem \| InChI \| Smiles	"2021092907231632900185" 29 Sep 2021
\|	nandrolone-17-propionate	nandrolone-17-propionate	330.47	1	PubChem \| InChI \| Smiles	"2021092210081632305280" 22 Sep 2021
\|	KKLVFFAK	KKLVFFAK	980.25	1	PubChem \| InChI \| Smiles	"2022062413361656077770" 24 Jun 2022
\|	Soman	Soman	182.17	3	PubChem \| InChI \| Smiles	"2020102618421603737735" 26 Oct 2020
\|	Camphor	Camphor	152.23	3	PubChem \| InChI \| Smiles	"2020102620231603743818" 26 Oct 2020
\|	Cx4R	Cx4R	588.69	1	PubChem \| InChI \| Smiles	"2020081213341597239258" 12 Aug 2020
\|	cis-2-Butene	cis-2-Butene	56.11	2	PubChem \| InChI \| Smiles	"2021101113081633957718" 11 Oct 2021
\|	N-benzyl-N-ethylethanaminium	N-benzyl-N-ethylethanaminium	164.27	3	PubChem \| InChI \| Smiles	"2024043013461714484769" 30 Apr 2024
\|	1,1'-(3-carboxypentane-1,5-diyl)dipyridinium		272.34	3	PubChem \| InChI \| Smiles	"2020102316591603472346" 23 Oct 2020
\|	Boc-D-alanine methyl ester	Boc-D-alanine methyl ester	203.24	1	PubChem \| InChI \| Smiles	"2021093015311633015888" 30 Sep 2021
\|	Chromium(III)	Chromium(III)	52.00	5	PubChem \| InChI \| Smiles	"2022111715391668699547" 17 Nov 2022
\|	D-Glucose	D-Glucose	180.16	1	PubChem \| InChI \| Smiles	"2021102715151635347726" 27 Oct 2021
\|	(2R)-2-acetamido-4-methylpentanoic acid		172.20	4	PubChem \| InChI \| Smiles	"2020102211151603365329" 22 Oct 2020
\|	4,6-Dibromo-N,N'-bis[6-(pentanoylamino)pyrid-2-yl]isophthalamide		674.38	1	PubChem \| InChI \| Smiles	"2020101214291602512990" 12 Oct 2020
\|	3,7-Diaminophenoxazinylium chloride	3,7-Diaminophenoxazinylium chloride	247.68	2	PubChem \| InChI \| Smiles	"2020102817251603905957" 28 Oct 2020
\|	(1S,2R)-(+)-2-Amino-1,2-diphenylethanol		213.28	1	PubChem \| InChI \| Smiles	"2021102420481635108524" 24 Oct 2021
\|	Pyrimidine	Pyrimidine	80.09	4	PubChem \| InChI \| Smiles	"2021100413161633353406" 04 Oct 2021
\|	Noradrenaline hydrochloride	Noradrenaline hydrochloride	205.64	11	PubChem \| InChI \| Smiles	"2021092813571632837472" 28 Sep 2021
\|	sCx6-mono(CH2CONH2)	sCx6-mono(CH2CONH2)	1166.00	11	PubChem \| InChI \| Smiles	"2020103008221604046149" 30 Oct 2020
\|	Neopentane	Neopentane	72.15	2	PubChem \| InChI \| Smiles	"2021101114181633961890" 11 Oct 2021
\|	2,6-Dichloropyridine	2,6-Dichloropyridine	147.99	2	PubChem \| InChI \| Smiles	"2021101215171634051872" 12 Oct 2021
\|	GAB	GAB	171.24	1	PubChem \| InChI \| Smiles	"2024081508361723710993" 15 Aug 2024
\|	anti-Urea Naphthotube	anti-Urea Naphthotube	1105.32	10	PubChem \| InChI \| Smiles	"2020081411461597405597" 14 Aug 2020
\|	Pyrrole	Pyrrole	67.09	4	PubChem \| InChI \| Smiles	"2021093013521633009952" 30 Sep 2021
\|	Cyclohexanemethylamine	Cyclohexanemethylamine	113.20	15	PubChem \| InChI \| Smiles	"2021092907111632899504" 29 Sep 2021
\|	Propranolol hydrochloride	Propranolol hydrochloride	295.80	1	PubChem \| InChI \| Smiles	"2021102708531635324800" 27 Oct 2021
\|	Dodeca(3-methoxycarbonylpropyl)bambus[6]uril		2126.15	2	PubChem \| InChI \| Smiles	"2020081411331597404806" 14 Aug 2020
\|	Quinuclidine	Quinuclidine	111.18	4	PubChem \| InChI \| Smiles	"2020102219201603394424" 22 Oct 2020
\|	3-Phenylbutanoic acid	3-Phenylbutanoic acid	164.20	1	PubChem \| InChI \| Smiles	"2021101116101633968600" 11 Oct 2021
\|	bis(pyren-1-ylmethyl)propane-1,3-diaminium)		504.66	4	PubChem \| InChI \| Smiles	"2022062807041656399894" 28 Jun 2022
\|	1,3-dioxane	1,3-dioxane	88.11	7	PubChem \| InChI \| Smiles	"2020101211061602500809" 12 Oct 2020
\|	Acetone	Acetone	58.08	9	PubChem \| InChI \| Smiles	"2021092210041632305054" 22 Sep 2021
\|	4-[(E)-2-(3,10a-dihydropyren-1-yl)vinyl]-1-methyl-pyridine		320.41	5	PubChem \| InChI \| Smiles	"2020101617281602869334" 16 Oct 2020
\|	anti-Thiourea Naphthotube	anti-Thiourea Naphthotube	1137.45	8	PubChem \| InChI \| Smiles	"2020081411461597405597" 14 Aug 2020
\|	2,3-Dimethylpyrazine	2,3-Dimethylpyrazine	108.14	4	PubChem \| InChI \| Smiles	"2021093008261632990411" 30 Sep 2021
\|	Bupivacaine hydrochloride	Bupivacaine hydrochloride	324.90	1	PubChem \| InChI \| Smiles	"2024042313411713879669" 23 Apr 2024
\|	syn-Thiourea Naphthotube	syn-Thiourea Naphthotube	1137.45	8	PubChem \| InChI \| Smiles	"2020081411461597405597" 14 Aug 2020
\|	Vecuronium	Vecuronium	557.84	10	PubChem \| InChI \| Smiles	"2020100519171601925459" 05 Oct 2020
\|	2-Bromoadamantane	2-Bromoadamantane	215.13	6	PubChem \| InChI \| Smiles	"2021093009271632994036" 30 Sep 2021
\|	[C12mim]Br	[C12mim]Br	331.33	1	PubChem \| InChI \| Smiles	"2022062923061656544016" 29 Jun 2022
\|	Diammonium salt	Diammonium salt	730.50	3	PubChem \| InChI \| Smiles	"2024072913361722260214" 29 Jul 2024
\|	Benzimidazole	Benzimidazole	118.14	2	PubChem \| InChI \| Smiles	"2020121710441608201894" 17 Dec 2020
\|	Adrenaline hydrochloride	Adrenaline hydrochloride	219.66	8	PubChem \| InChI \| Smiles	"2020103016581604077130" 30 Oct 2020
\|	Pyridinium, 1,1'-[(2-carboxy-1,4-phenylene)bis(methylene)]bis-		306.36	4	PubChem \| InChI \| Smiles	"2020102316551603472129" 23 Oct 2020
\|	Tetramethylammonium	Tetramethylammonium	74.15	14	PubChem \| InChI \| Smiles	"2021092907091632899389" 29 Sep 2021
\|	24-crown-8 derivative	24-crown-8 derivative	500.54	4	PubChem \| InChI \| Smiles	"2024072913381722260306" 29 Jul 2024
\|	Pyridinium, 1,1'-[[2-(methoxycarbonyl)-1,4-phenylene]bis(methylene)]bis-		320.39	3	PubChem \| InChI \| Smiles	"2020102317041603472692" 23 Oct 2020
\|	6-Methoxy-2-naphthol	6-Methoxy-2-naphthol	174.20	2	PubChem \| InChI \| Smiles	"2021093013121633007552" 30 Sep 2021
\|	WGGQTARK(me3)STGGK	WGGQTARK(me3)STGGK	1419.61	1	PubChem \| InChI \| Smiles	"2020081213341597239258" 12 Aug 2020
\|	3-Bromopentane	3-Bromopentane	151.04	3	PubChem \| InChI \| Smiles	"2021100815011633705268" 08 Oct 2021
\|	1-V2+	1-V2+	0.00	2	PubChem \| InChI \| Smiles	"2024031115321710171155" 11 Mar 2024
\|	N2	N2	28.01	1	PubChem \| InChI \| Smiles	"2022070112381656679102" 01 Jul 2022
\|	2-Aminopyridine	2-Aminopyridine	94.11	2	PubChem \| InChI \| Smiles	"2021100116271633105620" 01 Oct 2021
\|	4-Aminopyridine	4-Aminopyridine	94.11	2	PubChem \| InChI \| Smiles	"2021100716421633624934" 07 Oct 2021
\|	2-V2+	2-V2+	1377.12	2	PubChem \| InChI \| Smiles	"2024031116461710175570" 11 Mar 2024
\|	Serotonin	Serotonin	176.22	29	PubChem \| InChI \| Smiles	"2020101119111602443469" 11 Oct 2020
\|	L-Glu-L-Trp	L-Glu-L-Trp	333.34	2	PubChem \| InChI \| Smiles	"2020102720591603832366" 27 Oct 2020
\|	Lumichrome	Lumichrome	242.24	2	PubChem \| InChI \| Smiles	"2021093013321633008721" 30 Sep 2021
\|	BDPP	BDPP	670.43	18	PubChem \| InChI \| Smiles	"2022032312521648039949" 23 Mar 2022
\|	2,2,6-Trimethylcyclohexanone	2,2,6-Trimethylcyclohexanone	140.22	2	PubChem \| InChI \| Smiles	"2022101712431666010583" 17 Oct 2022
\|	L-Trp-OMe	L-Trp-OMe	218.26	5	PubChem \| InChI \| Smiles	"2021092816221632846126" 28 Sep 2021
\|	(-)-Norephedrine hydrochloride	(-)-Norephedrine hydrochloride	187.66	2	PubChem \| InChI \| Smiles	"2020102916081603987735" 29 Oct 2020
\|	1-Phenyl-2-butanone	1-Phenyl-2-butanone	148.20	1	PubChem \| InChI \| Smiles	"2020122109261608542761" 21 Dec 2020
\|	Pentane	Pentane	72.15	2	PubChem \| InChI \| Smiles	"2021101109331633944808" 11 Oct 2021
\|	Tyr-gly	Tyr-gly	238.24	1	PubChem \| InChI \| Smiles	"2021101209391634031549" 12 Oct 2021
\|	Tetrabutylammonium 4-nitrobenzoate	Tetrabutylammonium 4-nitrobenzoate	408.60	2	PubChem \| InChI \| Smiles	"2021101216291634056181" 12 Oct 2021
\|	Dopamine hydrochloride	Dopamine hydrochloride	189.64	23	PubChem \| InChI \| Smiles	"2021092915161632928606" 29 Sep 2021
\|	1-Iodopentane	1-Iodopentane	198.05	3	PubChem \| InChI \| Smiles	"2021101209431634031791" 12 Oct 2021
\|	Zeolite L3.0	Zeolite L3.0	0.00	55	PubChem \| InChI \| Smiles	"2022032312421648039329" 23 Mar 2022
\|	MDAP	MDAP	234.30	154	PubChem \| InChI \| Smiles	"2020092209381600767528" 22 Sep 2020
\|	TEM-PE-MB	TEM-PE-MB	1737.93	9	PubChem \| InChI \| Smiles	"2020081622451597617929" 16 Aug 2020
\|	2-Adamantylamine hydrochloride	2-Adamantylamine hydrochloride	187.71	2	PubChem \| InChI \| Smiles	"2021093015051633014346" 30 Sep 2021
\|	Cholic acid	Cholic acid	408.58	3	PubChem \| InChI \| Smiles	"2020102617121603732359" 26 Oct 2020
\|	beta-alanine	beta-alanine	89.09	2	PubChem \| InChI \| Smiles	"2022070507331657006400" 05 Jul 2022
\|	sCx6-mono(C2H4NH2)	sCx6-mono(C2H4NH2)	1154.10	11	PubChem \| InChI \| Smiles	"2020103008221604046142" 30 Oct 2020
\|	Furan	Furan	68.07	4	PubChem \| InChI \| Smiles	"2021092915211632928863" 29 Sep 2021
\|	(2R,3R)-(-)-2-Benzyloxy-1,3,4-butanetriol		212.24	1	PubChem \| InChI \| Smiles	"2021093015301633015819" 30 Sep 2021
\|	4FBVI	4FBVI	257.21	3	PubChem \| InChI \| Smiles	"2021042212401619095225" 22 Apr 2021
\|	[C4Mim]Br	[C4Mim]Br	219.12	3	PubChem \| InChI \| Smiles	"2022062411211656069694" 24 Jun 2022
\|	L-Trp-L-Pro	L-Trp-L-Pro	301.34	2	PubChem \| InChI \| Smiles	"2023102416141698164079" 24 Oct 2023
\|	Adamantane	Adamantane	136.23	5	PubChem \| InChI \| Smiles	"2021092907091632899355" 29 Sep 2021
\|	tert-Butylbenzylketone	tert-Butylbenzylketone	176.25	1	PubChem \| InChI \| Smiles	"2020081213331597239237" 12 Aug 2020
\|	5FBMI	5FBMI	263.19	3	PubChem \| InChI \| Smiles	"2021042212511619095879" 22 Apr 2021
\|	D/L-Asp	D/L-Asp	132.09	9	PubChem \| InChI \| Smiles	"2020100519281601926116" 05 Oct 2020
\|	[C2mim][BF4]	[C2mim][BF4]	197.97	1	PubChem \| InChI \| Smiles	"2022062922481656542895" 29 Jun 2022
\|	1-Pentyl-3-methylmidazolium	1-Pentyl-3-methylmidazolium	153.24	1	PubChem \| InChI \| Smiles	"2021081808161629274601" 18 Aug 2021
\|	adamantyl-1-amine	adamantyl-1-amine	151.25	1	PubChem \| InChI \| Smiles	"2020081213341597239255" 12 Aug 2020
\|	D/L-Ser	D/L-Ser	105.09	9	PubChem \| InChI \| Smiles	"2020100717401602092444" 07 Oct 2020
\|	sCx5 sodium salt	sCx5 sodium salt	1040.83	6	PubChem \| InChI \| Smiles	"2020093016131601482419" 30 Sep 2020
\|	exo-OA	exo-OA	1729.52	7	PubChem \| InChI \| Smiles	"2020101207311602487890" 12 Oct 2020
\|	Bis(trimethylaminio)adamantane	Bis(trimethylaminio)adamantane	252.45	2	PubChem \| InChI \| Smiles	"2020102816311603902716" 28 Oct 2020
\|	3-noradamantanecarboxylic acid	3-noradamantanecarboxylic acid	166.22	1	PubChem \| InChI \| Smiles	"2020081213341597239255" 12 Aug 2020
\|	Isopropanol	Isopropanol	60.10	3	PubChem \| InChI \| Smiles	"2021093015041633014267" 30 Sep 2021
\|	3FBVI	3FBVI	239.22	3	PubChem \| InChI \| Smiles	"2021042213411619098910" 22 Apr 2021
\|	Al3+	Al3+	26.98	6	PubChem \| InChI \| Smiles	"2021100814211633702881" 08 Oct 2021
\|	ATROPINE	ATROPINE	289.40	1	PubChem \| InChI \| Smiles	"2024081610461723805197" 16 Aug 2024
\|	4-Methylbenzenesulfonate	4-Methylbenzenesulfonate	171.19	1	PubChem \| InChI \| Smiles	"2022071310371657708645" 13 Jul 2022
\|	stCx4 sodium salt	stCx4 sodium salt	904.82	12	PubChem \| InChI \| Smiles	"2020092312001600862448" 23 Sep 2020
\|	Iodocyclopentane	Iodocyclopentane	196.03	5	PubChem \| InChI \| Smiles	"2021092816061632845162" 28 Sep 2021
\|	Dibucaine hydrochloride	Dibucaine hydrochloride	379.90	10	PubChem \| InChI \| Smiles	"2020101120061602446815" 11 Oct 2020
\|	(S)-(+)-3-Bromo-2-methyl-1-propanol	(S)-(+)-3-Bromo-2-methyl-1-propanol	153.02	1	PubChem \| InChI \| Smiles	"2021102420341635107695" 24 Oct 2021
\|	sCx8	sCx8	1481.42	47	PubChem \| InChI \| Smiles	"2020092114021600696935" 21 Sep 2020
\|	GGFKAGY	GGFKAGY	698.77	1	PubChem \| InChI \| Smiles	"2024022216051708617940" 22 Feb 2024
\|	Diamantane diammonium-6	Diamantane diammonium-6	304.51	2	PubChem \| InChI \| Smiles	"2020103020041604088255" 30 Oct 2020
\|	(2R)-[4-(2-Methylpropyl)phenyl]propanoate		205.27	4	PubChem \| InChI \| Smiles	"2020102211081603364937" 22 Oct 2020
\|	1-Iodoadamantane	1-Iodoadamantane	262.13	6	PubChem \| InChI \| Smiles	"2021100515571633449427" 05 Oct 2021
\|	bis(dimethylpyridinium)diarylethene (closed form)		444.65	9	PubChem \| InChI \| Smiles	"2020100715101602083416" 07 Oct 2020
\|	Nizatidine	Nizatidine	331.45	2	PubChem \| InChI \| Smiles	"2020102720391603831198" 27 Oct 2020
\|	GGFKGGY	GGFKGGY	684.74	2	PubChem \| InChI \| Smiles	"2024022215571708617431" 22 Feb 2024
\|	Recombinant insulin human	Recombinant insulin human	5808.00	2	PubChem \| InChI \| Smiles	"2020103021211604092861" 30 Oct 2020
\|	1-Adamantylammonium chloride	1-Adamantylammonium chloride	187.71	9	PubChem \| InChI \| Smiles	"2020101212221602505336" 12 Oct 2020
\|	1-Fluoroadamantane	1-Fluoroadamantane	154.22	4	PubChem \| InChI \| Smiles	"2021101209441634031869" 12 Oct 2021
\|	5FBVI	5FBVI	275.20	3	PubChem \| InChI \| Smiles	"2021042212451619095556" 22 Apr 2021
\|	Cyanostilbene	Cyanostilbene	544.92	5	PubChem \| InChI \| Smiles	"2020102720461603831580" 27 Oct 2020
\|	6-((2-((2-amino-2-oxoethyl)amino)-2-oxoethyl)amino)-6-oxohexane-1,5-diaminium		261.00	1	PubChem \| InChI \| Smiles	"2021021911091613732986" 19 Feb 2021
\|	Hexanediamine dihydrochloride	Hexanediamine dihydrochloride	189.12	22	PubChem \| InChI \| Smiles	"2021030309251614763509" 03 Mar 2021
\|	1-Bromoadamantane	1-Bromoadamantane	215.13	6	PubChem \| InChI \| Smiles	"2021092907191632899952" 29 Sep 2021
\|	2FBVI	2FBVI	221.23	3	PubChem \| InChI \| Smiles	"2021042212441619095470" 22 Apr 2021
\|	(1S,3R)-(-)-Camphoric acid	(1S,3R)-(-)-Camphoric acid	200.23	1	PubChem \| InChI \| Smiles	"2021093016121633018375" 30 Sep 2021
\|	1-Chloroadamantane	1-Chloroadamantane	170.68	6	PubChem \| InChI \| Smiles	"2021101109321633944763" 11 Oct 2021
\|	(2S)-2-[4-(2-Methylpropyl)phenyl]propanoate		205.27	4	PubChem \| InChI \| Smiles	"2020102211071603364828" 22 Oct 2020
\|	5FBPy	5FBPy	260.18	3	PubChem \| InChI \| Smiles	"2021042213421619098957" 22 Apr 2021
\|	N-Boc-l-Alanine	N-Boc-l-Alanine	189.21	1	PubChem \| InChI \| Smiles	"2021093015021633014161" 30 Sep 2021
\|	Phenethyl Metabasket	Phenethyl Metabasket	1681.82	62	PubChem \| InChI \| Smiles	"2020100107161601536618" 01 Oct 2020
\|	Naphthalenediimide	Naphthalenediimide	408.45	1	PubChem \| InChI \| Smiles	"2020102920441604004265" 29 Oct 2020
\|	Phenyl-β-D-glucopyranoside	Phenyl-β-D-glucopyranoside	256.25	2	PubChem \| InChI \| Smiles	"2020102821001603918834" 28 Oct 2020
\|	Adamantane-1-carbonitrile	Adamantane-1-carbonitrile	161.24	5	PubChem \| InChI \| Smiles	"2021092909481632908880" 29 Sep 2021
\|	tpMe-PE-MB	tpMe-PE-MB	1737.93	24	PubChem \| InChI \| Smiles	"2020081412291597408165" 14 Aug 2020
\|	Azobenzene-polyethylene-glycol	Azobenzene-polyethylene-glycol	2281.72	2	PubChem \| InChI \| Smiles	"2022062308231655972607" 23 Jun 2022
\|	sCx8-mono(CH2CN)	sCx8-mono(CH2CN)	1520.43	9	PubChem \| InChI \| Smiles	"2020103008221604046161" 30 Oct 2020
\|	Biphenyl-polyethylene glycol	Biphenyl-polyethylene glycol	2253.70	2	PubChem \| InChI \| Smiles	"2022062313201655990426" 23 Jun 2022
\|	glycine	glycine	75.07	22	PubChem \| InChI \| Smiles	"2021030309181614763121" 03 Mar 2021
\|	D/L-Ala	D/L-Ala	89.09	12	PubChem \| InChI \| Smiles	"2020100319371601753877" 03 Oct 2020
\|	D/L-Leu	D/L-Leu	117.15	12	PubChem \| InChI \| Smiles	"2020100319401601754000" 03 Oct 2020
\|	ethane	ethane	30.07	5	PubChem \| InChI \| Smiles	"2022070112291656678586" 01 Jul 2022
\|	GGKFGGY	GGKFGGY	684.74	2	PubChem \| InChI \| Smiles	"2024022216111708618275" 22 Feb 2024
\|	(2S)-pyrrolidine-2-carboxylate	(2S)-pyrrolidine-2-carboxylate	114.12	3	PubChem \| InChI \| Smiles	"2020102613221603718557" 26 Oct 2020
\|	2,3-Diazabicyclo[2.2.1]-hept-2-ene	2,3-Diazabicyclo[2.2.1]-hept-2-ene	96.13	12	PubChem \| InChI \| Smiles	"2021093010101632996617" 30 Sep 2021
\|	D/L-Pro	D/L-Pro	115.13	12	PubChem \| InChI \| Smiles	"2020100319441601754291" 03 Oct 2020
\|	1-Hydroxynaphthalene	1-Hydroxynaphthalene	144.17	2	PubChem \| InChI \| Smiles	"2021092816101632845412" 28 Sep 2021
\|	1-methyl-1'-(3-aminiopropyl)-4,4'-bipyridinium		230.33	2	PubChem \| InChI \| Smiles	"2020102820131603915982" 28 Oct 2020
\|	D/L-Trp	D/L-Trp	204.23	12	PubChem \| InChI \| Smiles	"2020100319421601754143" 03 Oct 2020
\|	1,2-Dinitrobenzene	1,2-Dinitrobenzene	168.11	2	PubChem \| InChI \| Smiles	"2021101308171634113048" 13 Oct 2021
\|	trans-Merocyanine	trans-Merocyanine	352.39	2	PubChem \| InChI \| Smiles	"2020102916161603988164" 29 Oct 2020
\|	(2R)-pyrrolidine-2-carboxylate	(2R)-pyrrolidine-2-carboxylate	114.12	3	PubChem \| InChI \| Smiles	"2020102613211603718479" 26 Oct 2020
\|	Dihydrogenphosphate	Dihydrogenphosphate	96.99	8	PubChem \| InChI \| Smiles	"2021102711581635335915" 27 Oct 2021
\|	[10]Cycloparaphenylene	[10]Cycloparaphenylene	761.00	1	PubChem \| InChI \| Smiles	"2022062319571656014258" 23 Jun 2022
\|	(D/L)-Phe-perylene-diimides	(D/L)-Phe-perylene-diimides	686.66	2	PubChem \| InChI \| Smiles	"2020102720231603830187" 27 Oct 2020
\|	Cobaltocene hexafluorophosphate	Cobaltocene hexafluorophosphate	334.08	1	PubChem \| InChI \| Smiles	"2021093013241633008276" 30 Sep 2021
\|	(2S)-2-acetamido-4-methylpentanoate	(2S)-2-acetamido-4-methylpentanoate	172.20	2	PubChem \| InChI \| Smiles	"2020102211171603365457" 22 Oct 2020
\|	Dibenzofuran-polyethylene-glycol	Dibenzofuran-polyethylene-glycol	2297.71	2	PubChem \| InChI \| Smiles	"2022062309151655975705" 23 Jun 2022
\|	Trp-Gly-Gly	Trp-Gly-Gly	318.33	5	PubChem \| InChI \| Smiles	"2020101616351602866131" 16 Oct 2020
\|	Dimetoxinaphtaleneglycoluril tetramer	Dimetoxinaphtaleneglycoluril tetramer	1669.57	3	PubChem \| InChI \| Smiles	"2020103118191604168343" 31 Oct 2020
\|	pyrrole indene dione	pyrrole indene dione	584.75	5	PubChem \| InChI \| Smiles	"2022112115281669044517" 21 Nov 2022
\|	n-benzyl-n,n-dimethylethanaminium	n-benzyl-n,n-dimethylethanaminium	164.27	3	PubChem \| InChI \| Smiles	"2024043013411714484478" 30 Apr 2024
\|	Pyrrole benzonitrile	Pyrrole benzonitrile	580.76	5	PubChem \| InChI \| Smiles	"2022112115341669044868" 21 Nov 2022
\|	D/L-Lys	D/L-Lys	146.19	15	PubChem \| InChI \| Smiles	"2021092815531632844388" 28 Sep 2021
\|	Ethanolamine	Ethanolamine	61.08	3	PubChem \| InChI \| Smiles	"2021101908021634630568" 19 Oct 2021
\|	Pyrrole chromene carbonitrile	Pyrrole chromene carbonitrile	623.79	5	PubChem \| InChI \| Smiles	"2022112115471669045630" 21 Nov 2022
\|	phenolate BzO-	phenolate BzO-	93.10	7	PubChem \| InChI \| Smiles	"2023030614141678112060" 06 Mar 2023
\|	5, 10, 15, 20-Tetrakis-(4-sulfonatophenyl)-porphyrin		930.96	1	PubChem \| InChI \| Smiles	"2021010810521610103136" 08 Jan 2021
\|	GGRRGGY	GGRRGGY	735.79	1	PubChem \| InChI \| Smiles	"2024022216221708618954" 22 Feb 2024
\|	Xe	Xe	131.29	8	PubChem \| InChI \| Smiles	"2022070112171656677854" 01 Jul 2022
\|	all-cis Hexafluorocyclohexane	all-cis Hexafluorocyclohexane	192.10	8	PubChem \| InChI \| Smiles	"2020101119401602445209" 11 Oct 2020
\|	Thiabendazole	Thiabendazole	201.25	8	PubChem \| InChI \| Smiles	"2020102820281603916883" 28 Oct 2020
\|	Symmetric Tetramethyl Cucurbit[6]uril	Symmetric Tetramethyl Cucurbit[6]uril	1052.93	7	PubChem \| InChI \| Smiles	"2024032708361711528562" 27 Mar 2024
\|	1-(3-aminopropyl)-4-4'-bipyridinium	1-(3-aminopropyl)-4-4'-bipyridinium	215.29	2	PubChem \| InChI \| Smiles	"2020102820111603915867" 28 Oct 2020
\|	D/L-Arg	D/L-Arg	175.21	11	PubChem \| InChI \| Smiles	"2022071414251657808743" 14 Jul 2022
\|	(1S,5R)-hexa(N-me...	(1S,5R)-hexa(N-me...	1549.91	12	PubChem \| InChI \| Smiles	"2020082116011598025703" 21 Aug 2020
\|	sCx6-12C	sCx6-12C	1413.98	4	PubChem \| InChI \| Smiles	"2021091320341631565263" 13 Sep 2021
\|	Tetramethyl((2,2,10,10-tetramethyl-65,145-dinitro-4,8,12,16-tetraoxa-1,3,9,11(1,4),6,14(1,3)-hexabenzenacyclohexadecaphane-13,33,92,113-tetrayl)tetrakis(methylene))tetrakis(phosphonate)		1178.93	7	PubChem \| InChI \| Smiles	"2020101217581602525526" 12 Oct 2020
\|	L-Phe-L-Val	L-Phe-L-Val	264.32	3	PubChem \| InChI \| Smiles	"2020102521411603662081" 25 Oct 2020
\|	Dimetoxinaphtaleneglycoluril	Dimetoxinaphtaleneglycoluril	1115.04	2	PubChem \| InChI \| Smiles	"2020103117461604166415" 31 Oct 2020
\|	N,N'-(1,4-phenylenebis(methylene))bis(propan-1-aminium) chloride		293.28	1	PubChem \| InChI \| Smiles	"2024031413001710421225" 14 Mar 2024
\|	sCx6-6C	sCx6-6C	1616.02	4	PubChem \| InChI \| Smiles	"2020103008151604045722" 30 Oct 2020
\|	GAKFAGY	GAKFAGY	712.79	1	PubChem \| InChI \| Smiles	"2024022216031708617789" 22 Feb 2024
\|	sCx4-6C	sCx4-6C	1077.35	4	PubChem \| InChI \| Smiles	"2020103008171604045850" 30 Oct 2020
\|	pyrrole acrylonitrile	pyrrole acrylonitrile	674.92	6	PubChem \| InChI \| Smiles	"2022112115511669045918" 21 Nov 2022
\|	Furan malononitrile pyrrole	Furan malononitrile pyrrole	665.87	6	PubChem \| InChI \| Smiles	"2022112115081669043300" 21 Nov 2022
\|	4,5-dichloro-3,6-dioxocyclohexa-1,4-diene-1,2-dicarbonitrile		227.00	1	PubChem \| InChI \| Smiles	"2024042914301714401045" 29 Apr 2024
\|	Pyrrole fluorene dicarbonitrile	Pyrrole fluorene dicarbonitrile	654.84	6	PubChem \| InChI \| Smiles	"2022112115411669045273" 21 Nov 2022
\|	Tetrakis(pyridin-4-ylsulfanyl)-phthalocyaninato zinc(II)		1074.64	13	PubChem \| InChI \| Smiles	"2021110119251635794728" 01 Nov 2021
\|	Pyrrole trifluoro acrylonitrile	Pyrrole trifluoro acrylonitrile	691.75	6	PubChem \| InChI \| Smiles	"2022112115571669046243" 21 Nov 2022
\|	Pyrophosphate	Pyrophosphate	172.01	5	PubChem \| InChI \| Smiles	"2023030617251678123534" 06 Mar 2023
\|	1,1',1''-((2,4,6-triethylbenzene-1,3,5-triyl)tris(methylene))tris(3-(4-(dimethylamino)naphthalen-1-yl)thiourea)		934.33	3	PubChem \| InChI \| Smiles	"2022111808551668761703" 18 Nov 2022
\|	Adamantane-1,3-diamine	Adamantane-1,3-diamine	166.26	1	PubChem \| InChI \| Smiles	"2022062409551656064501" 24 Jun 2022
\|	D/L-His	D/L-His	155.15	13	PubChem \| InChI \| Smiles	"2020100311441601725488" 03 Oct 2020
\|	(R)-(−)-Mandelate	(R)-(−)-Mandelate	152.15	5	PubChem \| InChI \| Smiles	"2020102211261603365990" 22 Oct 2020
\|	Thiazole orange	Thiazole orange	476.60	4	PubChem \| InChI \| Smiles	"2020102219241603394657" 22 Oct 2020
\|	15-Crown-5	15-Crown-5	220.26	8	PubChem \| InChI \| Smiles	"2020101120121602447125" 11 Oct 2020
\|	GGWKGGY	GGWKGGY	723.78	1	PubChem \| InChI \| Smiles	"2024022216231708619027" 22 Feb 2024
\|	Camptothecin	Camptothecin	348.40	7	PubChem \| InChI \| Smiles	"2020101616061602864367" 16 Oct 2020
\|	PBS-1086	PBS-1086	312.28	5	PubChem \| InChI \| Smiles	"2020102209581603360710" 22 Oct 2020
\|	Sodium methanethiosulfonate	Sodium methanethiosulfonate	134.16	4	PubChem \| InChI \| Smiles	"2021093013181633007934" 30 Sep 2021
\|	Dimetoxixylyleneglycoluril trimer	Dimetoxixylyleneglycoluril trimer	1375.25	4	PubChem \| InChI \| Smiles	"2020103118031604167431" 31 Oct 2020
\|	sCx8-mono(C2H4NH2)	sCx8-mono(C2H4NH2)	1524.00	9	PubChem \| InChI \| Smiles	"2020103008221604046155" 30 Oct 2020
\|	KKLVFF	KKLVFF	781.00	3	PubChem \| InChI \| Smiles	"2020103109161604135774" 31 Oct 2020
\|	Napthalene-monofunctionalized CB6	Napthalene-monofunctionalized CB6	1120.98	17	PubChem \| InChI \| Smiles	"2020092211171600773473" 22 Sep 2020
\|	Cesium chloride	Cesium chloride	168.36	13	PubChem \| InChI \| Smiles	"2021092208551632300928" 22 Sep 2021
\|	Dimetoxixylyleneglycoluril tetramer	Dimetoxixylyleneglycoluril tetramer	1569.45	3	PubChem \| InChI \| Smiles	"2020103118171604168237" 31 Oct 2020
\|	N-Acetyl-L-Trp-NH2	N-Acetyl-L-Trp-NH2	245.28	4	PubChem \| InChI \| Smiles	"2021070207531625212396" 02 Jul 2021
\|	6-(3-(((pyridin-2-yl-l3-oxidaneyl)sulfonyl)methyl)ureido)hexyl 3,4,5-tris(dodecyloxy)benzoate		990.48	2	PubChem \| InChI \| Smiles	"2020103119341604172860" 31 Oct 2020
\|	Ziprasidone	Ziprasidone	412.90	3	PubChem \| InChI \| Smiles	"2020102720361603830975" 27 Oct 2020
\|	PL	PL	167.16	1	PubChem \| InChI \| Smiles	"2022062413291656077359" 24 Jun 2022
\|	1-pentylpyridin-1-ium	1-pentylpyridin-1-ium	150.24	1	PubChem \| InChI \| Smiles	"2023030809251678267539" 08 Mar 2023
\|	Ferroceneacroboxylate	Ferroceneacroboxylate	229.00	2	PubChem \| InChI \| Smiles	"2020102913541603979665" 29 Oct 2020
\|	PMCD-perylene bisimides	PMCD-perylene bisimides	3171.32	2	PubChem \| InChI \| Smiles	"2022062307351655969713" 23 Jun 2022
\|	1,1'-(propane-1,3-diyl)bis(4-(tert-butyl)pyridin-1-ium)		312.49	1	PubChem \| InChI \| Smiles	"2024042914571714402656" 29 Apr 2024
\|	Dimetoxinaphtaleneglycoluril trimer	Dimetoxinaphtaleneglycoluril trimer	1475.37	4	PubChem \| InChI \| Smiles	"2020103118051604167524" 31 Oct 2020
\|	((3-(6-((3,4,5-tris(dodecyloxy)benzoyl)oxy)hexyl)ureido)methyl)phosphonic acid		911.30	2	PubChem \| InChI \| Smiles	"2020103119221604172164" 31 Oct 2020
\|	sCX4-CH2CON(Me)2	sCX4-CH2CON(Me)2	1081.00	2	PubChem \| InChI \| Smiles	"2020100115341601566471" 01 Oct 2020
\|	Acetylcholine chloride	Acetylcholine chloride	181.66	4	PubChem \| InChI \| Smiles	"2021092907051632899144" 29 Sep 2021
\|	esa(a-methyl, met...	esa(a-methyl, met...	1982.03	12	PubChem \| InChI \| Smiles	"2020081411451597405534" 14 Aug 2020
\|	(S)-(+)-Mandelate	(S)-(+)-Mandelate	152.15	5	PubChem \| InChI \| Smiles	"2020102211271603366076" 22 Oct 2020
\|	(1R,5S)-2-(4-Carb...	(1R,5S)-2-(4-Carb...	1982.03	12	PubChem \| InChI \| Smiles	"2020082115331598024001" 21 Aug 2020
\|	Phenyltrimethylammonium	Phenyltrimethylammonium	136.21	10	PubChem \| InChI \| Smiles	"2021101116131633968793" 11 Oct 2021
\|	d-sCx4	d-sCx4	1533.49	1	PubChem \| InChI \| Smiles	"2021030515021614956548" 05 Mar 2021
\|	1,1'-bis(3,5-diethoxybenzyl)-[4,4'-bipyridine]-1,1'-diium		514.66	1	PubChem \| InChI \| Smiles	"2020122110111608545502" 21 Dec 2020
\|	GGYLGGY	GGYLGGY	685.72	1	PubChem \| InChI \| Smiles	"2024022216261708619191" 22 Feb 2024
\|	Tetrahydrofuran	Tetrahydrofuran	72.11	8	PubChem \| InChI \| Smiles	"2022063014181656598708" 30 Jun 2022
\|	sCX4-CCOOH	sCX4-CCOOH	972.00	5	PubChem \| InChI \| Smiles	"2020103008121604045524" 30 Oct 2020
\|	12-Crown-4	12-Crown-4	176.21	5	PubChem \| InChI \| Smiles	"2020101612391602851944" 16 Oct 2020
\|	1-adamantane carboxylate	1-adamantane carboxylate	179.24	7	PubChem \| InChI \| Smiles	"2020102208411603356114" 22 Oct 2020
\|	(1R,2S)-2-Amino-1,2-diphenylethanol	(1R,2S)-2-Amino-1,2-diphenylethanol	213.28	1	PubChem \| InChI \| Smiles	"2021100815041633705481" 08 Oct 2021
\|	Acyclic sodium 3,3'-(naphthalene-1,4-diylbis(oxy))bis(propane-1-sulfonate) Cucurbituril		1641.51	10	PubChem \| InChI \| Smiles	"2020100521361601933777" 05 Oct 2020
\|	Gly-tyr-gly	Gly-tyr-gly	295.29	1	PubChem \| InChI \| Smiles	"2021093013421633009363" 30 Sep 2021
\|	paraquat ion	paraquat ion	186.25	30	PubChem \| InChI \| Smiles	"2021082316561629737771" 23 Aug 2021
\|	sCX4-di(C2OC2)	sCX4-di(C2OC2)	884.00	2	PubChem \| InChI \| Smiles	"2020100115301601566247" 01 Oct 2020
\|	Potassium chloride	Potassium chloride	74.55	10	PubChem \| InChI \| Smiles	"2021092909481632908918" 29 Sep 2021
\|	H-Trp-Lys-Arg-Thr-Leu-Arg-Arg-Leu-OH	H-Trp-Lys-Arg-Thr-Leu-Arg-Arg-Leu-OH	1128.37	2	PubChem \| InChI \| Smiles	"2020103108491604134183" 31 Oct 2020
\|	2,3-diazabicyclo[2.2.2]oct-2-en-1-ylmethanamine		139.20	1	PubChem \| InChI \| Smiles	"2020120316041607011483" 03 Dec 2020
\|	Molecular Tweezer-sodium dimethylphosphonate		734.57	25	PubChem \| InChI \| Smiles	"2020101208411602492075" 12 Oct 2020
\|	Europium trinitrate hexahydrate	Europium trinitrate hexahydrate	446.07	34	PubChem \| InChI \| Smiles	"2020092209421600767750" 22 Sep 2020
\|	4-HAB	4-HAB	198.22	2	PubChem \| InChI \| Smiles	"2022062412351656074105" 24 Jun 2022
\|	N,N-dimethyl-N-(4-(trifluoromethyl)benzyl)-1-(4-(trifluoromethyl)phenyl)methanaminium		362.33	2	PubChem \| InChI \| Smiles	"2023030614151678112145" 06 Mar 2023
\|	sCx4-CH2-COOH-twisted	sCx4-CH2-COOH-twisted	974.87	2	PubChem \| InChI \| Smiles	"2020100115381601566701" 01 Oct 2020
\|	Phenyltrimethylammonium Chloride	Phenyltrimethylammonium Chloride	171.67	5	PubChem \| InChI \| Smiles	"2023041813191681823977" 18 Apr 2023
\|	Triphenyleno[2,3-d:6,7-d':10,11-d'']tris([1,3]dioxole)-dimethylbutyl-3-hexylurea		997.31	1	PubChem \| InChI \| Smiles	"2020102313551603461351" 23 Oct 2020
\|	18-Crown-6	18-Crown-6	264.31	18	PubChem \| InChI \| Smiles	"2020100318181601749089" 03 Oct 2020
\|	H-Leu-Arg-Arg-Trp-Ser-Leu-Gly-OH	H-Leu-Arg-Arg-Trp-Ser-Leu-Gly-OH	887.04	2	PubChem \| InChI \| Smiles	"2020103108471604134066" 31 Oct 2020
\|	AntNMe2+-2kPEG	AntNMe2+-2kPEG	2335.23	5	PubChem \| InChI \| Smiles	"2022070113501656683453" 01 Jul 2022
\|	1,3,5-tris[[(4s)-4-[3-[4-(sodiosulfo)butoxy]phenyl]-2-oxazoline-2-yl]methyl]-2,4,6-trimethylbenzene		1120.20	10	PubChem \| InChI \| Smiles	"2021092907161632899818" 29 Sep 2021
\|	D,L-tyrosine methyl ester hydrochloride		231.67	2	PubChem \| InChI \| Smiles	"2021101209351634031346" 12 Oct 2021
\|	1,3,5-tris[[(4s)-4-[3-[4-(sodiosulfo)butoxy]phenyl]-2-oxazoline-2-yl]methyl]-2,4,6-triethylbenzene		1162.30	10	PubChem \| InChI \| Smiles	"2021100116151633104932" 01 Oct 2021
\|	Berberine	Berberine	336.36	6	PubChem \| InChI \| Smiles	"2023091108371694421439" 11 Sep 2023
\|	1,8-ANS	1,8-ANS	299.34	12	PubChem \| InChI \| Smiles	"2020100520041601928287" 05 Oct 2020
\|	Codeine	Codeine	299.40	1	PubChem \| InChI \| Smiles	"2021092814001632837654" 28 Sep 2021
\|	Fenchol	Fenchol	154.25	3	PubChem \| InChI \| Smiles	"2020102617271603733223" 26 Oct 2020
\|	Barium nitrate	Barium nitrate	261.34	1	PubChem \| InChI \| Smiles	"2021100814571633705041" 08 Oct 2021
\|	Tetramethylammonium chloride	Tetramethylammonium chloride	109.60	15	PubChem \| InChI \| Smiles	"2021100111271633087677" 01 Oct 2021
\|	Pyranine	Pyranine	524.37	1	PubChem \| InChI \| Smiles	"2021100515541633449275" 05 Oct 2021
\|	Palmatine	Palmatine	352.41	18	PubChem \| InChI \| Smiles	"2020102919001603998039" 29 Oct 2020
\|	methane	methane	16.04	7	PubChem \| InChI \| Smiles	"2022070112291656678542" 01 Jul 2022
\|	Guanidinium Chloride	Guanidinium Chloride	95.53	2	PubChem \| InChI \| Smiles	"2021100413131633353216" 04 Oct 2021
\|	cis-2,3-Dimethyloxirane	cis-2,3-Dimethyloxirane	72.11	2	PubChem \| InChI \| Smiles	"2022063014141656598462" 30 Jun 2022
\|	(R)-Binaphthalene-diol	(R)-Binaphthalene-diol	286.33	10	PubChem \| InChI \| Smiles	"2020101212441602506689" 12 Oct 2020
\|	tetrabutylammonium 2,2'-bisphenolcyclophosphate		489.63	2	PubChem \| InChI \| Smiles	"2020102213271603373243" 22 Oct 2020
\|	MVI2	MVI2	440.06	12	PubChem \| InChI \| Smiles	"2020092212191600777140" 22 Sep 2020
\|	sCx4-4C	sCx4-4C	965.13	17	PubChem \| InChI \| Smiles	"2020092307551600847737" 23 Sep 2020
\|	2,3-[1,2-phenylen...	2,3-[1,2-phenylen...	1003.19	1	PubChem \| InChI \| Smiles	"2020081213341597239248" 12 Aug 2020
\|	2,2-Dimethyloxirane	2,2-Dimethyloxirane	72.11	2	PubChem \| InChI \| Smiles	"2021101214551634050535" 12 Oct 2021
\|	L-Lys	L-Lys	146.19	33	PubChem \| InChI \| Smiles	"2022062307461655970394" 23 Jun 2022
\|	Cyclopentylacetic acid	Cyclopentylacetic acid	128.17	3	PubChem \| InChI \| Smiles	"2021101215211634052062" 12 Oct 2021
\|	tetrabutylammonium 5-oxylato-5h-dibenzophosphole 5-oxide		457.63	2	PubChem \| InChI \| Smiles	"2020102213311603373494" 22 Oct 2020
\|	4-Bromophenyl-methylpyridinium	4-Bromophenyl-methylpyridinium	249.13	5	PubChem \| InChI \| Smiles	"2023081711151692270945" 17 Aug 2023
\|	Hg2+	Hg2+	200.59	9	PubChem \| InChI \| Smiles	"2021110416031636041817" 04 Nov 2021
\|	2-naphthyl-polyethylene glycol monomethyl ether polymer		5223.27	2	PubChem \| InChI \| Smiles	"2022062308491655974178" 23 Jun 2022
\|	Sulforhodamine B	Sulforhodamine B	558.70	1	PubChem \| InChI \| Smiles	"2021093013301633008623" 30 Sep 2021
\|	sCx4-5C	sCx4-5C	1021.24	7	PubChem \| InChI \| Smiles	"2020093016171601482639" 30 Sep 2020
\|	N-Acetyl-L-aspartic acid	N-Acetyl-L-aspartic acid	175.14	1	PubChem \| InChI \| Smiles	"2021102516261635179174" 25 Oct 2021
\|	5,6-dihydropyrazino[1,2,3,4-lmn][1,10]phenanthroline-4,7-diium		208.26	5	PubChem \| InChI \| Smiles	"2023081814591692370761" 18 Aug 2023
\|	N-Acetyl-l-alanine	N-Acetyl-l-alanine	131.13	2	PubChem \| InChI \| Smiles	"2021102516121635178342" 25 Oct 2021
\|	WNBP	WNBP	1313.27	30	PubChem \| InChI \| Smiles	"2023081711041692270279" 17 Aug 2023
\|	(S)-N-diaminomethylcarbamoyl-1H-pyrrol-2-yl-methyl-3-methoxy-3-oxopropane-1,2-diaminium		286.33	5	PubChem \| InChI \| Smiles	"2020102611441603712641" 26 Oct 2020
\|	tetraallyl-bicyclic guanidinium iodide		427.37	6	PubChem \| InChI \| Smiles	"2020103013431604065412" 30 Oct 2020
\|	H-Leu-Arg-Arg-Trp-pSer-Leu-Gly-OH	H-Leu-Arg-Arg-Trp-pSer-Leu-Gly-OH	967.02	2	PubChem \| InChI \| Smiles	"2020103108461604133980" 31 Oct 2020
\|	Tetrabutylammonium 4,6-bis(phenylethynyl)-5-oxylato-5h-dibenzophosphole 5-oxide		657.86	2	PubChem \| InChI \| Smiles	"2020102213391603373988" 22 Oct 2020
\|	tetracarboxamide-bicyclic guanidinium iodide		607.53	6	PubChem \| InChI \| Smiles	"2020103013441604065445" 30 Oct 2020
\|	Cyclobis(paraquat-1,4-phenylene) tetrakis(hexafluorophosphate)		1100.54	6	PubChem \| InChI \| Smiles	"2020101217411602524506" 12 Oct 2020
\|	Sodium sulfate	Sodium sulfate	142.04	6	PubChem \| InChI \| Smiles	"2021102712411635338516" 27 Oct 2021
\|	(R)-3-Phenylbutyric acid	(R)-3-Phenylbutyric acid	164.20	1	PubChem \| InChI \| Smiles	"2021102420211635106884" 24 Oct 2021
\|	sodium benzoate	sodium benzoate	144.10	1	PubChem \| InChI \| Smiles	"2022070507411657006880" 05 Jul 2022
\|	D-Glucosamine	D-Glucosamine	179.17	2	PubChem \| InChI \| Smiles	"2020103017421604079754" 30 Oct 2020
\|	Sodium fluoride	Sodium fluoride	41.99	7	PubChem \| InChI \| Smiles	"2021102711541635335655" 27 Oct 2021
\|	Leu-Gly-Gly	Leu-Gly-Gly	245.28	2	PubChem \| InChI \| Smiles	"2020103108151604132132" 31 Oct 2020
\|	Sodium cyanoborohydride	Sodium cyanoborohydride	59.82	10	PubChem \| InChI \| Smiles	"2020100714541602082498" 07 Oct 2020
\|	s-sCx4	s-sCx4	1507.45	2	PubChem \| InChI \| Smiles	"2020120302371606963054" 03 Dec 2020
\|	GGFRGGY	GGFRGGY	712.75	1	PubChem \| InChI \| Smiles	"2024022216081708618131" 22 Feb 2024
\|	Boronic acid-containing coumarin aldehyde		478.40	7	PubChem \| InChI \| Smiles	"2020101211251602501942" 12 Oct 2020
\|	N-(furan-2-ylmethyl)prop-2-en-1-amine	N-(furan-2-ylmethyl)prop-2-en-1-amine	137.18	2	PubChem \| InChI \| Smiles	"2022062411361656070567" 24 Jun 2022
\|	p-Nitrobenzyltrimethylammonium	p-Nitrobenzyltrimethylammonium	195.24	4	PubChem \| InChI \| Smiles	"2020102217071603386451" 22 Oct 2020
\|	1,4-Diaminobutane dihydrochloride	1,4-Diaminobutane dihydrochloride	161.07	2	PubChem \| InChI \| Smiles	"2021102509461635155170" 25 Oct 2021
\|	(-)-ephedrine	(-)-ephedrine	165.24	1	PubChem \| InChI \| Smiles	"2021101209361634031377" 12 Oct 2021
\|	(1R,5S)-hexa(N-me...	(1R,5S)-hexa(N-me...	1633.81	9	PubChem \| InChI \| Smiles	"2020082116051598025938" 21 Aug 2020
\|	Cyclopentene oxide	Cyclopentene oxide	84.12	2	PubChem \| InChI \| Smiles	"2021101214541634050488" 12 Oct 2021
\|	Bis(5-carboxypentyl)-N,N'-bipyridiniium		386.48	14	PubChem \| InChI \| Smiles	"2020101120521602449572" 11 Oct 2020
\|	6-methyl-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole		151.21	2	PubChem \| InChI \| Smiles	"2022062411221656069743" 24 Jun 2022
\|	Benzyltriethylammonium	Benzyltriethylammonium	192.33	6	PubChem \| InChI \| Smiles	"2021092907061632899180" 29 Sep 2021
\|	Ac-Lys-OMe	Ac-Lys-OMe	238.71	19	PubChem \| InChI \| Smiles	"2021093011411633002112" 30 Sep 2021
\|	4-Pyridinecarboxaldehyde	4-Pyridinecarboxaldehyde	107.11	1	PubChem \| InChI \| Smiles	"2021100116251633105550" 01 Oct 2021
\|	Molecular Tweezer-lithium diphosphate	Molecular Tweezer-lithium diphosphate	750.38	25	PubChem \| InChI \| Smiles	"2020101208401602492054" 12 Oct 2020
\|	Phenylalanine hydrochloride	Phenylalanine hydrochloride	201.65	2	PubChem \| InChI \| Smiles	"2021102509521635155554" 25 Oct 2021
\|	La3+	La3+	138.91	5	PubChem \| InChI \| Smiles	"2021110416071636042030" 04 Nov 2021
\|	SbF6	SbF6	235.75	2	PubChem \| InChI \| Smiles	"2021081313271628861258" 13 Aug 2021
\|	SACx4	SACx4	1249.11	2	PubChem \| InChI \| Smiles	"2021112410251637749501" 24 Nov 2021
\|	Proflavin protonated	Proflavin protonated	210.25	2	PubChem \| InChI \| Smiles	"2020103017531604080380" 30 Oct 2020
\|	5-(aminobutyl)amino)naphthalene-1-sulfonate		293.00	56	PubChem \| InChI \| Smiles	"2020090907091599635346" 09 Sep 2020
\|	Molecular Tweezer-sodium diacetate	Molecular Tweezer-sodium diacetate	726.72	9	PubChem \| InChI \| Smiles	"2020101208391602491940" 12 Oct 2020
\|	CB7-OH	CB7-OH	1178.96	8	PubChem \| InChI \| Smiles	"2021102510061635156379" 25 Oct 2021
\|	Gly-L-His	Gly-L-His	212.21	2	PubChem \| InChI \| Smiles	"2023102314461698072403" 23 Oct 2023
\|	D-(+)-3-Phenyllactic acid	D-(+)-3-Phenyllactic acid	166.18	1	PubChem \| InChI \| Smiles	"2021093016221633018966" 30 Sep 2021
\|	Na+	Na+	22.99	74	PubChem \| InChI \| Smiles	"2021110416061636041993" 04 Nov 2021
\|	Sodium triflate	Sodium triflate	172.06	8	PubChem \| InChI \| Smiles	"2021093008241632990290" 30 Sep 2021
\|	N,N-bis(diisopropylphenyl)isophthalamide		484.67	4	PubChem \| InChI \| Smiles	"2020102215451603381543" 22 Oct 2020
\|	Bis[quinoxaline-2,3-diylbis[oxy(3,6-dioxaoctane-1,8-diyl)oxy]]-9,10-dipropylanthracene		1107.20	3	PubChem \| InChI \| Smiles	"2020102617071603732055" 26 Oct 2020
\|	Isopentane	Isopentane	72.15	2	PubChem \| InChI \| Smiles	"2021101113051633957535" 11 Oct 2021
\|	H-Arg-OMe	H-Arg-OMe	261.15	1	PubChem \| InChI \| Smiles	"2021101908381634632698" 19 Oct 2021
\|	L-Phenylglycine	L-Phenylglycine	151.16	1	PubChem \| InChI \| Smiles	"2022020816171644337051" 08 Feb 2022
\|	Sodium chloride	Sodium chloride	58.44	18	PubChem \| InChI \| Smiles	"2021092315041632409454" 23 Sep 2021
\|	N,N'-[p-phenylenebis(oxy-p-phenylenemethylene)]bis(benzenemethaneaminium)		502.60	3	PubChem \| InChI \| Smiles	"2020102621101603746655" 26 Oct 2020
\|	Cyclohexene oxide	Cyclohexene oxide	98.14	2	PubChem \| InChI \| Smiles	"2021101214551634050512" 12 Oct 2021
\|	Dibenzylazanium	Dibenzylazanium	198.28	9	PubChem \| InChI \| Smiles	"2021102214441634913892" 22 Oct 2021
\|	tyrosylmethionylalanine	tyrosylmethionylalanine	383.50	1	PubChem \| InChI \| Smiles	"2023102416071698163663" 24 Oct 2023
\|	4-Amino-1-butanol	4-Amino-1-butanol	89.14	1	PubChem \| InChI \| Smiles	"2023072409181690190327" 24 Jul 2023
\|	1,2-phenylenediamine dihydrochloride	1,2-phenylenediamine dihydrochloride	181.06	2	PubChem \| InChI \| Smiles	"2022062409531656064391" 24 Jun 2022
\|	Ac-Arg-OMe	Ac-Arg-OMe	266.72	13	PubChem \| InChI \| Smiles	"2020100519571601927868" 05 Oct 2020
\|	Bis[quinoxaline-2...	Bis[quinoxaline-2...	1305.53	1	PubChem \| InChI \| Smiles	"2020081213341597239248" 12 Aug 2020
\|	lauric acid	lauric acid	200.32	1	PubChem \| InChI \| Smiles	"2021101209341634031284" 12 Oct 2021
\|	6,7-diazabicyclo(3.2.2)non-6-ene	6,7-diazabicyclo(3.2.2)non-6-ene	124.18	7	PubChem \| InChI \| Smiles	"2020101213531602510818" 12 Oct 2020
\|	N-(4-cyanobenzyl)-1-(4-cyanophenyl)-N,N-dimethylmethanaminium		276.36	2	PubChem \| InChI \| Smiles	"2023030614161678112185" 06 Mar 2023
\|	spermine	spermine	202.34	6	PubChem \| InChI \| Smiles	"2023090812321694176349" 08 Sep 2023
\|	Phe-Gly-Gly	Phe-Gly-Gly	279.29	4	PubChem \| InChI \| Smiles	"2021093013211633008063" 30 Sep 2021
\|	Sodium dicyanamide	Sodium dicyanamide	89.03	7	PubChem \| InChI \| Smiles	"2020101210071602497268" 12 Oct 2020
\|	1,2-Butylene oxide	1,2-Butylene oxide	72.11	2	PubChem \| InChI \| Smiles	"2021101209341634031262" 12 Oct 2021
\|	Tris[2,3-quinoxalinediylbis(oxyethyleneoxyethyleneoxyethyleneoxy)]triphenylene		1495.60	3	PubChem \| InChI \| Smiles	"2020102617061603731966" 26 Oct 2020
\|	TEMOA	TEMOA	1785.60	37	PubChem \| InChI \| Smiles	"2020082107091597993757" 21 Aug 2020
\|	Ca2+	Ca2+	40.08	20	PubChem \| InChI \| Smiles	"2021110416061636041962" 04 Nov 2021
\|	N1,N6-bis(2-azidoethyl)hexane-1,6-diaminium chloride		327.26	1	PubChem \| InChI \| Smiles	"2024031410271710412021" 14 Mar 2024
\|	2-(pent-4-en-1-yl)oxirane	2-(pent-4-en-1-yl)oxirane	112.17	4	PubChem \| InChI \| Smiles	"2022063014151656598556" 30 Jun 2022
\|	1,1',1''-((benzene-1,1,1',1''-((benzene-1,3,5-triyltris(oxy))tris(benzene-4,1-diyl))tris(N-benzylmethanaminium)		1149.82	3	PubChem \| InChI \| Smiles	"2020102621071603746472" 26 Oct 2020
\|	2,3-[1,2-phenylenebis[oxy(3,6-dioxaoctane-1,8-diyl)oxy]]quinoxaline		500.50	9	PubChem \| InChI \| Smiles	"2020100715551602086141" 07 Oct 2020
\|	Triphenylene	Triphenylene	228.30	1	PubChem \| InChI \| Smiles	"2021100817571633715857" 08 Oct 2021
\|	4-Nitro-D-phenylalanine	4-Nitro-D-phenylalanine	210.19	1	PubChem \| InChI \| Smiles	"2021092815081632841732" 28 Sep 2021
\|	Acetamido-cyclohexyl-4-nitro-1H-pyrrole-2-bisaniline		502.60	4	PubChem \| InChI \| Smiles	"2020102215421603381355" 22 Oct 2020
\|	Proflavine	Proflavine	210.26	7	PubChem \| InChI \| Smiles	"2021092209011632301269" 22 Sep 2021
\|	Bisglycouril tetraoxypropylsulphite sodium		1309.24	35	PubChem \| InChI \| Smiles	"2020100716181602087496" 07 Oct 2020
\|	Sodium perrhenate	Sodium perrhenate	273.19	10	PubChem \| InChI \| Smiles	"2020100519501601927436" 05 Oct 2020
\|	Mg2+	Mg2+	24.30	17	PubChem \| InChI \| Smiles	"2021110416061636041985" 04 Nov 2021
\|	Arg-arg	Arg-arg	330.39	2	PubChem \| InChI \| Smiles	"2020102918391603996765" 29 Oct 2020
\|	Sodium hexafluorophosphate	Sodium hexafluorophosphate	167.95	14	PubChem \| InChI \| Smiles	"2020091913591600523970" 19 Sep 2020
\|	Fluorenyl-polyethylene-glycol	Fluorenyl-polyethylene-glycol	2177.61	2	PubChem \| InChI \| Smiles	"2022062309161655975819" 23 Jun 2022
\|	permethylated α-cyclodextrin	permethylated α-cyclodextrin	1225.30	13	PubChem \| InChI \| Smiles	"2020100311561601726212" 03 Oct 2020
\|	Di-Trp Gly6 target	Di-Trp Gly6 target	1116.10	2	PubChem \| InChI \| Smiles	"2020102319591603483169" 23 Oct 2020
\|	Molecular Tweezer-sodium disulfonate	Molecular Tweezer-sodium disulfonate	770.00	15	PubChem \| InChI \| Smiles	"2020101208401602492045" 12 Oct 2020
\|	L-Lys-Lys-Lys	L-Lys-Lys-Lys	402.50	2	PubChem \| InChI \| Smiles	"2020103109001604134808" 31 Oct 2020
\|	di-methyl viologen gly6 scaffold	di-methyl viologen gly6 scaffold	883.01	5	PubChem \| InChI \| Smiles	"2020102320081603483728" 23 Oct 2020
\|	Sr2+	Sr2+	87.60	20	PubChem \| InChI \| Smiles	"2021110416061636042000" 04 Nov 2021
\|	4-((1E,3E)-4-(4-(dimethylamino)phenyl)buta-1,3-dien-1-yl)-1-methylpyridin-1-ium		265.40	2	PubChem \| InChI \| Smiles	"2021093013431633009413" 30 Sep 2021
\|	(S)-N,N-Dimethyl-1-ferrocenylethylamine		257.16	1	PubChem \| InChI \| Smiles	"2020111213041605186256" 12 Nov 2020
\|	Tri-Trp Gly4 target	Tri-Trp Gly4 target	1762.66	1	PubChem \| InChI \| Smiles	"2020102319541603482873" 23 Oct 2020
\|	2-Methyl-3-phenyloxirane	2-Methyl-3-phenyloxirane	134.17	8	PubChem \| InChI \| Smiles	"2021093010071632996443" 30 Sep 2021
\|	N,N-Bis(dimethylamino)-2,6-diisopropylphenyl)isophthalamide		570.81	4	PubChem \| InChI \| Smiles	"2020102215491603381750" 22 Oct 2020
\|	Sodium iodide	Sodium iodide	149.89	15	PubChem \| InChI \| Smiles	"2021092907221632900145" 29 Sep 2021
\|	Cyclohexanone	Cyclohexanone	98.14	6	PubChem \| InChI \| Smiles	"2021101214571634050630" 12 Oct 2021
\|	Acridine Yellow G	Acridine Yellow G	273.76	3	PubChem \| InChI \| Smiles	"2021093013301633008653" 30 Sep 2021
\|	(trimethyl-azaneyl)cyclohexane	(trimethyl-azaneyl)cyclohexane	454.17	4	PubChem \| InChI \| Smiles	"2020102217091603386572" 22 Oct 2020
\|	Trichloroacetamido-cyclohexyl-4-nitro-1H-pyrrole-bisaniline		605.94	4	PubChem \| InChI \| Smiles	"2020102215391603381143" 22 Oct 2020
\|	Tribromoacetamido-cyclohexyl-4-nitro-1H-pyrrole-bisaniline		739.29	4	PubChem \| InChI \| Smiles	"2020102215351603380939" 22 Oct 2020
\|	Mono-Trp Gly4 target	Mono-Trp Gly4 target	473.48	5	PubChem \| InChI \| Smiles	"2020102319481603482494" 23 Oct 2020
\|	N,N-Dihexylisophthalamide	N,N-Dihexylisophthalamide	332.48	4	PubChem \| InChI \| Smiles	"2020102213581603375084" 22 Oct 2020
\|	N,N-bis(diisopropyl-4-nitrophenyl)isophthalamide		574.67	4	PubChem \| InChI \| Smiles	"2020102215471603381653" 22 Oct 2020
\|	Decyltrimethylammonium bromide	Decyltrimethylammonium bromide	280.29	3	PubChem \| InChI \| Smiles	"2021092816131632845599" 28 Sep 2021
\|	Trifluoroacetamido-cyclohexyl-4-nitro-1H-pyrrole-bisaniline		556.58	4	PubChem \| InChI \| Smiles	"2020102215401603381224" 22 Oct 2020
\|	Mono-methyl viologen Gly4 scaffold	Mono-methyl viologen Gly4 scaffold	613.67	3	PubChem \| InChI \| Smiles	"2020102320011603483308" 23 Oct 2020
\|	L-Alanine	L-Alanine	89.09	9	PubChem \| InChI \| Smiles	"2020101617011602867716" 16 Oct 2020
\|	[Ru(bpy)2dppz]2+	[Ru(bpy)2dppz]2+	695.70	1	PubChem \| InChI \| Smiles	"2020122109501608544201" 21 Dec 2020
\|	tBu Phe-Gly-Gly	tBu Phe-Gly-Gly	335.40	1	PubChem \| InChI \| Smiles	"2022062411261656069976" 24 Jun 2022
\|	Dehydrocorydaline	Dehydrocorydaline	366.44	12	PubChem \| InChI \| Smiles	"2021092915131632928420" 29 Sep 2021
\|	Rhodamine 800	Rhodamine 800	495.96	2	PubChem \| InChI \| Smiles	"2020102618451603737914" 26 Oct 2020
\|	L-Ile	L-Ile	131.17	3	PubChem \| InChI \| Smiles	"2020102619121603739547" 26 Oct 2020
\|	Mono-methyl viologen Gly6 scaffold	Mono-methyl viologen Gly6 scaffold	727.77	3	PubChem \| InChI \| Smiles	"2020102320041603483475" 23 Oct 2020
\|	K+	K+	39.10	45	PubChem \| InChI \| Smiles	"2021110416061636041971" 04 Nov 2021
\|	scopolamine	scopolamine	303.35	1	PubChem \| InChI \| Smiles	"2024081609591723802394" 16 Aug 2024
\|	Sodium bromide	Sodium bromide	102.89	13	PubChem \| InChI \| Smiles	"2021100515561633449372" 05 Oct 2021
\|	norcamphor	norcamphor	110.15	5	PubChem \| InChI \| Smiles	"2022101712111666008703" 17 Oct 2022
\|	Stearyltrimethylammonium Bromide	Stearyltrimethylammonium Bromide	392.50	2	PubChem \| InChI \| Smiles	"2021093013541633010048" 30 Sep 2021
\|	Gly-Gly-Trp	Gly-Gly-Trp	318.33	3	PubChem \| InChI \| Smiles	"2020102521361603661800" 25 Oct 2020
\|	Mono-Trp Gly6 target	Mono-Trp Gly6 target	587.59	4	PubChem \| InChI \| Smiles	"2020102319581603483091" 23 Oct 2020
\|	Sodium thiocyanate	Sodium thiocyanate	81.07	13	PubChem \| InChI \| Smiles	"2021100116161633104973" 01 Oct 2021
\|	Sodium perchlorate	Sodium perchlorate	122.44	52	PubChem \| InChI \| Smiles	"2020090910281599647287" 09 Sep 2020
\|	L-Leu	L-Leu	131.17	5	PubChem \| InChI \| Smiles	"2020102216001603382404" 22 Oct 2020
\|	Octa acid	Octa acid	1729.50	120	PubChem \| InChI \| Smiles	"2020081622311597617094" 16 Aug 2020
\|	Sodium chlorate	Sodium chlorate	106.44	8	PubChem \| InChI \| Smiles	"2021102711571635335853" 27 Oct 2021
\|	meso-Cx4-di(OPr)CHOHPO3H2	meso-Cx4-di(OPr)CHOHPO3H2	728.66	15	PubChem \| InChI \| Smiles	"2020092311571600862241" 23 Sep 2020
\|	2-Adamantanone	2-Adamantanone	150.22	1	PubChem \| InChI \| Smiles	"2022101712441666010698" 17 Oct 2022
\|	Magnesium chloride	Magnesium chloride	95.21	5	PubChem \| InChI \| Smiles	"2020081213341597239251" 12 Aug 2020
\|	Li+	Li+	6.94	29	PubChem \| InChI \| Smiles	"2021093009181632993504" 30 Sep 2021
\|	H-gly-phe-gly-oh	H-gly-phe-gly-oh	279.29	2	PubChem \| InChI \| Smiles	"2020102918411603996868" 29 Oct 2020
\|	Di-Trp Gly4 target	Di-Trp Gly4 target	887.90	2	PubChem \| InChI \| Smiles	"2020102319541603482898" 23 Oct 2020
\|	Ammonium	Ammonium	18.04	8	PubChem \| InChI \| Smiles	"2021092907181632899882" 29 Sep 2021
\|	Benzidine	Benzidine	184.24	1	PubChem \| InChI \| Smiles	"2021102512251635164708" 25 Oct 2021
\|	L-Trp	L-Trp	204.23	30	PubChem \| InChI \| Smiles	"2021092210221632306135" 22 Sep 2021
\|	1-Adamantaneamine HCl	1-Adamantaneamine HCl	187.71	1	PubChem \| InChI \| Smiles	"2024042313261713878784" 23 Apr 2024
\|	di-methyl viologen gly4 scaffold	di-methyl viologen gly4 scaffold	1168.26	5	PubChem \| InChI \| Smiles	"2020102320031603483385" 23 Oct 2020
\|	Cx4	Cx4	424.50	66	PubChem \| InChI \| Smiles	"2020092113471600696047" 21 Sep 2020
\|	Ephedrine hydrochloride	Ephedrine hydrochloride	201.69	2	PubChem \| InChI \| Smiles	"2020102916011603987308" 29 Oct 2020
\|	2,3-Diazabicyclo(2.2.2)oct-2-ene	2,3-Diazabicyclo(2.2.2)oct-2-ene	110.16	62	PubChem \| InChI \| Smiles	"2021092816081632845331" 28 Sep 2021
\|	TEEtOA	TEEtOA	1841.73	4	PubChem \| InChI \| Smiles	"2020123119011609441281" 31 Dec 2020
\|	Adenine	Adenine	135.13	1	PubChem \| InChI \| Smiles	"2021102512231635164621" 25 Oct 2021
\|	4-Nitrophenol	4-Nitrophenol	139.11	1	PubChem \| InChI \| Smiles	"2021101109331633944835" 11 Oct 2021
\|	propane-1,3-diaminium chloride	propane-1,3-diaminium chloride	147.05	9	PubChem \| InChI \| Smiles	"2020100718191602094743" 07 Oct 2020
\|	Me6CB6	Me6CB6	1080.98	17	PubChem \| InChI \| Smiles	"2021120613331638797607" 06 Dec 2021
\|	Zn2+	Zn2+	65.40	5	PubChem \| InChI \| Smiles	"2021110416051636041920" 04 Nov 2021
\|	Neutral Red protonated	Neutral Red protonated	253.32	22	PubChem \| InChI \| Smiles	"2020100715331602084809" 07 Oct 2020
\|	Basic blue 6	Basic blue 6	310.78	2	PubChem \| InChI \| Smiles	"2021093016281633019334" 30 Sep 2021
\|	Neutral red hydrochloride	Neutral red hydrochloride	288.78	16	PubChem \| InChI \| Smiles	"2020101209461602495990" 12 Oct 2020
\|	Benzylamine hydrochloride	Benzylamine hydrochloride	143.61	3	PubChem \| InChI \| Smiles	"2021100111301633087813" 01 Oct 2021
\|	Phosphoramidon	Phosphoramidon	543.50	1	PubChem \| InChI \| Smiles	"2021093013481633009699" 30 Sep 2021
\|	bis(dimethylpyridinium)diarylethene (open form)		444.65	4	PubChem \| InChI \| Smiles	"2020102316331603470812" 23 Oct 2020
\|	1-Butene	1-Butene	56.11	2	PubChem \| InChI \| Smiles	"2021101113061633957560" 11 Oct 2021
\|	trityl triazole iodane	trityl triazole iodane	1007.93	1	PubChem \| InChI \| Smiles	"2020081213341597239261" 12 Aug 2020
\|	GGFFGGY	GGFFGGY	703.74	1	PubChem \| InChI \| Smiles	"2024022216061708617964" 22 Feb 2024
\|	PDI-bis(Hex-Me2N-EtOH).2Br	PDI-bis(Hex-Me2N-EtOH).2Br	894.73	1	PubChem \| InChI \| Smiles	"2022062910551656500139" 29 Jun 2022
\|	GCA	GCA	503.60	3	PubChem \| InChI \| Smiles	"2021011503321610681550" 15 Jan 2021
\|	Rotaxane	Rotaxane	4760.10	9	PubChem \| InChI \| Smiles	"2023090512301693917013" 05 Sep 2023
\|	ExBox.4Cl	ExBox.4Cl	814.67	4	PubChem \| InChI \| Smiles	"2022062909351656495303" 29 Jun 2022
\|	Uranine	Uranine	376.28	7	PubChem \| InChI \| Smiles	"2020101209531602496406" 12 Oct 2020
\|	pCx4-OPr	pCx4-OPr	912.73	7	PubChem \| InChI \| Smiles	"2020103007531604044386" 30 Oct 2020
\|	1-pyrenebutyric acid sodium salt	1-pyrenebutyric acid sodium salt	310.32	4	PubChem \| InChI \| Smiles	"2022062411051656068710" 24 Jun 2022
\|	Perylene-Bridged Bis(b-cyclodextrin)	Perylene-Bridged Bis(b-cyclodextrin)	3271.48	5	PubChem \| InChI \| Smiles	"2021010714001610028051" 07 Jan 2021
\|	2-phenylethylamine hydrochloride	2-phenylethylamine hydrochloride	157.64	6	PubChem \| InChI \| Smiles	"2021100111301633087841" 01 Oct 2021
\|	((6-((3,4,5-tris(dodecyloxy)benzoyl)oxy)hexyl)carbamoyl)glycine		875.33	2	PubChem \| InChI \| Smiles	"2020103119221604172153" 31 Oct 2020
\|	8-amino octanoic acid	8-amino octanoic acid	159.23	3	PubChem \| InChI \| Smiles	"2021100814241633703097" 08 Oct 2021
\|	2-aminoethanol hydrochloride	2-aminoethanol hydrochloride	97.54	4	PubChem \| InChI \| Smiles	"2021100111291633087753" 01 Oct 2021
\|	Sodium deoxycholate	Sodium deoxycholate	414.60	3	PubChem \| InChI \| Smiles	"2022071310311657708288" 13 Jul 2022
\|	MeO-pCx4-OPr	MeO-pCx4-OPr	992.00	7	PubChem \| InChI \| Smiles	"2020103007561604044611" 30 Oct 2020
\|	PM-β-CD	PM-β-CD	1429.54	6	PubChem \| InChI \| Smiles	"2022062307241655969076" 23 Jun 2022
\|	GGRFGGY	GGRFGGY	712.75	1	PubChem \| InChI \| Smiles	"2024022216211708618882" 22 Feb 2024
\|	Dibenzyldiethylaminium	Dibenzyldiethylaminium	254.40	1	PubChem \| InChI \| Smiles	"2023032008141679300082" 20 Mar 2023
\|	Morphine	Morphine	285.34	2	PubChem \| InChI \| Smiles	"2020102816351603902915" 28 Oct 2020
\|	6I-O-(8-hydroxyquinoline)-2I,31- di-O-methylhexakis(2II-VII,3II-VII,6II-VII- tri-O-methyl)-B-cyclodextrin		1542.66	4	PubChem \| InChI \| Smiles	"2022062307271655969246" 23 Jun 2022
\|	6I-O-(1-naphtholxy)-2I,31-di-O- methylhexakis(2II-VII,3II-VII,6II-VII-tri-O-methyl)-B-cyclodextrin		1541.67	4	PubChem \| InChI \| Smiles	"2022072612321658838731" 26 Jul 2022
\|	(6S,11R,12R)-6,11-dihydro-6,11-[1,2]epicyclopentapyrido[1,2-b]isoquinolin-5-ium		246.30	2	PubChem \| InChI \| Smiles	"2020102821321603920779" 28 Oct 2020
\|	Rubidium chloride	Rubidium chloride	120.92	5	PubChem \| InChI \| Smiles	"2021092315051632409503" 23 Sep 2021
\|	GGLYGGY	GGLYGGY	685.72	1	PubChem \| InChI \| Smiles	"2024022216201708618810" 22 Feb 2024
\|	(2-((((10-formylanthracen-9-yl)methyl)(methyl)amino)methyl)phenyl)boronic acid		383.25	4	PubChem \| InChI \| Smiles	"2020102216501603385425" 22 Oct 2020
\|	(2-(((anthracen-9-ylmethyl)(methyl)amino)methyl)phenyl)boronic acid		355.20	4	PubChem \| InChI \| Smiles	"2020102216481603385320" 22 Oct 2020
\|	Dimethylhexane-1,6-diaminium chloride	Dimethylhexane-1,6-diaminium chloride	217.18	6	PubChem \| InChI \| Smiles	"2020101612521602852729" 16 Oct 2020
\|	diammonium-1,5-pentane chloride	diammonium-1,5-pentane chloride	175.10	4	PubChem \| InChI \| Smiles	"2021102712441635338654" 27 Oct 2021
\|	1,3-Phenylenediamine	1,3-Phenylenediamine	108.14	7	PubChem \| InChI \| Smiles	"2021092910461632912398" 29 Sep 2021
\|	5-Aminovaleric acid	5-Aminovaleric acid	117.15	2	PubChem \| InChI \| Smiles	"2021101114161633961809" 11 Oct 2021
\|	GGLLGGY	GGLLGGY	635.71	1	PubChem \| InChI \| Smiles	"2024022216181708618694" 22 Feb 2024
\|	Cytosine	Cytosine	111.10	1	PubChem \| InChI \| Smiles	"2021093009231632993806" 30 Sep 2021
\|	Trp-met-gly	Trp-met-gly	392.50	1	PubChem \| InChI \| Smiles	"2021092915421632930135" 29 Sep 2021
\|	Epiberberine	Epiberberine	336.40	1	PubChem \| InChI \| Smiles	"2021093014141633011258" 30 Sep 2021
\|	Progesterone	Progesterone	314.47	3	PubChem \| InChI \| Smiles	"2020102521351603661707" 25 Oct 2020
\|	Iodocyclohexane	Iodocyclohexane	210.06	5	PubChem \| InChI \| Smiles	"2021093007561632988588" 30 Sep 2021
\|	BVI	BVI	185.25	3	PubChem \| InChI \| Smiles	"2021042214071619100436" 22 Apr 2021
\|	1,6-Hexanediamine	1,6-Hexanediamine	116.21	23	PubChem \| InChI \| Smiles	"2022062411141656069291" 24 Jun 2022
\|	GAFKGGY	GAFKGGY	698.77	1	PubChem \| InChI \| Smiles	"2024022216011708617696" 22 Feb 2024
\|	5-Nitro-N,N'-bis[6-(2-ethylhexanoylamino)pyrid-2-yl]isophthalamide		645.75	1	PubChem \| InChI \| Smiles	"2020101214471602514036" 12 Oct 2020
\|	o-Xylyleneglycoluriltetramer	o-Xylyleneglycoluriltetramer	844.81	6	PubChem \| InChI \| Smiles	"2020102213361603373780" 22 Oct 2020
\|	Tetrahydropyridazinophthalazine-tetraone-CB6		1557.04	37	PubChem \| InChI \| Smiles	"2020110110211604226070" 01 Nov 2020
\|	Cyclohexylmethanaminium	Cyclohexylmethanaminium	114.21	17	PubChem \| InChI \| Smiles	"2021093007571632988624" 30 Sep 2021
\|	(R)-Glycidyl butyrate	(R)-Glycidyl butyrate	144.17	2	PubChem \| InChI \| Smiles	"2024080809141723108441" 08 Aug 2024
\|	CB6	CB6	996.84	308	PubChem \| InChI \| Smiles	"2022062922331656542035" 29 Jun 2022
\|	N-(4-methoxybenzyl)-1-(4-methoxyphenyl)-N,N-dimethylmethanaminium		286.39	2	PubChem \| InChI \| Smiles	"2023030616311678120283" 06 Mar 2023
\|	(1R,4S)-norcamphor	(1R,4S)-norcamphor	110.15	2	PubChem \| InChI \| Smiles	"2020102816421603903371" 28 Oct 2020
\|	cyclohepta-2,4,6-trien-1-ylium	cyclohepta-2,4,6-trien-1-ylium	91.13	2	PubChem \| InChI \| Smiles	"2023030809281678267686" 08 Mar 2023
\|	hethyl 5-(6-ethyl-4-Hydroxy-7-methoxy-2-oxo-2H-chromen-3-yl)furan-2-carboxylate		358.35	1	PubChem \| InChI \| Smiles	"2021100116211633105273" 01 Oct 2021
\|	2-PENTANOL	2-PENTANOL	88.15	2	PubChem \| InChI \| Smiles	"2024080809121723108327" 08 Aug 2024
\|	LiBArF	LiBArF	870.15	2	PubChem \| InChI \| Smiles	"2020103017331604079208" 30 Oct 2020
\|	BENZOYLFORMIC ACID	BENZOYLFORMIC ACID	150.13	2	PubChem \| InChI \| Smiles	"2023072512021690286548" 25 Jul 2023
\|	N-Hexyltrimethylammonium chloride	N-Hexyltrimethylammonium chloride	179.73	6	PubChem \| InChI \| Smiles	"2021101109331633944788" 11 Oct 2021
\|	L-Ala-L-Phe	L-Ala-L-Phe	236.27	2	PubChem \| InChI \| Smiles	"2020102816091603901354" 28 Oct 2020
\|	o-(CH3)2-1.1.1	o-(CH3)2-1.1.1	366.40	6	PubChem \| InChI \| Smiles	"2020081213341597239254" 12 Aug 2020
\|	TBABr	TBABr	322.37	16	PubChem \| InChI \| Smiles	"2020100718071602094063" 07 Oct 2020
\|	PEG12BU	PEG12BU	2678.97	14	PubChem \| InChI \| Smiles	"2020092210141600769682" 22 Sep 2020
\|	2-acetamido-2-phenylacetic acid	2-acetamido-2-phenylacetic acid	193.20	2	PubChem \| InChI \| Smiles	"2023072712011690459269" 27 Jul 2023
\|	1,3-diaminopropane	1,3-diaminopropane	74.13	1	PubChem \| InChI \| Smiles	"2022070507331657006423" 05 Jul 2022
\|	Phenethyltrimethylammonium chloride	Phenethyltrimethylammonium chloride	199.72	5	PubChem \| InChI \| Smiles	"2021100716441633625082" 07 Oct 2021
\|	2-Aminobutan-1-ol	2-Aminobutan-1-ol	89.14	2	PubChem \| InChI \| Smiles	"2024072914091722262185" 29 Jul 2024
\|	Hydrocinnamic acid	Hydrocinnamic acid	150.18	3	PubChem \| InChI \| Smiles	"2021093015001633014028" 30 Sep 2021
\|	Agmatine	Agmatine	130.19	6	PubChem \| InChI \| Smiles	"2021093013501633009859" 30 Sep 2021
\|	D/L-Phe	D/L-Phe	165.19	13	PubChem \| InChI \| Smiles	"2020100519341601926455" 05 Oct 2020
\|	Isobutane-d10	Isobutane-d10	68.18	1	PubChem \| InChI \| Smiles	"2021101113091633957779" 11 Oct 2021
\|	4-ETHYLPHENOL	4-ETHYLPHENOL	122.16	1	PubChem \| InChI \| Smiles	"2022070507341657006454" 05 Jul 2022
\|	4-Cyanobenzoic acid	4-Cyanobenzoic acid	147.13	4	PubChem \| InChI \| Smiles	"2021101215131634051603" 12 Oct 2021
\|	10-((pyridin-2-yl-l3-oxidaneyl)sulfonyl)decyl 3,4,5-tris(dodecyloxy)benzoate		974.52	2	PubChem \| InChI \| Smiles	"2020103119351604172942" 31 Oct 2020
\|	(10-((3,4,5-tris(dodecyloxy)benzoyl)oxy)decyl)phosphonic acid		895.34	2	PubChem \| InChI \| Smiles	"2020103119301604172603" 31 Oct 2020
\|	4-Cyanophenol	4-Cyanophenol	119.12	3	PubChem \| InChI \| Smiles	"2021093013001633006822" 30 Sep 2021
\|	Adamantylurea-functionalized dendrimer 2		647.91	6	PubChem \| InChI \| Smiles	"2020101219051602529521" 12 Oct 2020
\|	CB*6	CB*6	1321.37	17	PubChem \| InChI \| Smiles	"2024030414341709562887" 04 Mar 2024
\|	Adamantylurea-functionalized dendrimer 1		675.96	6	PubChem \| InChI \| Smiles	"2020101219111602529893" 12 Oct 2020
\|	GGKWGGY	GGKWGGY	723.78	1	PubChem \| InChI \| Smiles	"2024022216141708618442" 22 Feb 2024
\|	3-Bromo-1-propanol	3-Bromo-1-propanol	138.99	1	PubChem \| InChI \| Smiles	"2021093016261633019169" 30 Sep 2021
\|	Hexanoic acid	Hexanoic acid	116.16	5	PubChem \| InChI \| Smiles	"2021101114151633961737" 11 Oct 2021
\|	Pyrene	Pyrene	202.25	21	PubChem \| InChI \| Smiles	"2021093015031633014198" 30 Sep 2021
\|	5-Hexynoic acid	5-Hexynoic acid	112.13	4	PubChem \| InChI \| Smiles	"2020102219101603393806" 22 Oct 2020
\|	TARKSTGY	TARKSTGY	885.00	1	PubChem \| InChI \| Smiles	"2022062412451656074717" 24 Jun 2022
\|	2-phenylacetic acid	2-phenylacetic acid	136.15	4	PubChem \| InChI \| Smiles	"2023101714311697553115" 17 Oct 2023
\|	Macrobicyclic cyclophane	Macrobicyclic cyclophane	1250.81	18	PubChem \| InChI \| Smiles	"2020102314291603463363" 23 Oct 2020
\|	gCx5-6C	gCx5-6C	1241.72	25	PubChem \| InChI \| Smiles	"2020092114121600697551" 21 Sep 2020
\|	tBu Phe	tBu Phe	221.29	1	PubChem \| InChI \| Smiles	"2021093013451633009552" 30 Sep 2021
\|	3-Nitrobenzoic acid	3-Nitrobenzoic acid	167.12	4	PubChem \| InChI \| Smiles	"2021101109301633944637" 11 Oct 2021
\|	Fluorescein	Fluorescein	330.29	21	PubChem \| InChI \| Smiles	"2020092210071600769240" 22 Sep 2020
\|	1,2-Ethylenediamine	1,2-Ethylenediamine	62.11	3	PubChem \| InChI \| Smiles	"2020102615331603726414" 26 Oct 2020
\|	D/L-Ornithine	D/L-Ornithine	132.16	2	PubChem \| InChI \| Smiles	"2020102921111604005915" 29 Oct 2020
\|	Phenylmalonic acid	Phenylmalonic acid	180.16	4	PubChem \| InChI \| Smiles	"2023072511571690286268" 25 Jul 2023
\|	METHYL PHENYLACETATE	METHYL PHENYLACETATE	150.17	4	PubChem \| InChI \| Smiles	"2023072712481690462097" 27 Jul 2023
\|	TARK(me3)STGY	TARK(me3)STGY	927.08	1	PubChem \| InChI \| Smiles	"2022062407111656054677" 24 Jun 2022
\|	Dapoxyl	Dapoxyl	343.38	27	PubChem \| InChI \| Smiles	"2022062412381656074303" 24 Jun 2022
\|	syn amine naphthotube	syn amine naphthotube	1291.45	22	PubChem \| InChI \| Smiles	"2023072013551689861333" 20 Jul 2023
\|	1-Phenylethyl acetate	1-Phenylethyl acetate	164.20	2	PubChem \| InChI \| Smiles	"2024072914041722261871" 29 Jul 2024
\|	(2S,5R,6R)-6-[(2-carboxy-2-phenylacetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid		378.40	2	PubChem \| InChI \| Smiles	"2023072714071690466856" 27 Jul 2023
\|	anti amine naphthotube	anti amine naphthotube	1291.45	22	PubChem \| InChI \| Smiles	"2023072014041689861882" 20 Jul 2023
\|	Styrene oxide	Styrene oxide	120.15	8	PubChem \| InChI \| Smiles	"2021100814211633702909" 08 Oct 2021
\|	5FBTMA	5FBTMA	240.19	3	PubChem \| InChI \| Smiles	"2021042213361619098565" 22 Apr 2021
\|	1-Methylbutyl acetate	1-Methylbutyl acetate	130.18	2	PubChem \| InChI \| Smiles	"2024080809091723108158" 08 Aug 2024
\|	Famotidine	Famotidine	337.44	2	PubChem \| InChI \| Smiles	"2020102820471603918040" 28 Oct 2020
\|	1-Aminopropan-2-ol	1-Aminopropan-2-ol	75.11	2	PubChem \| InChI \| Smiles	"2024072914091722262145" 29 Jul 2024
\|	1,5-diazacyclooctane	1,5-diazacyclooctane	114.19	3	PubChem \| InChI \| Smiles	"2021093009241632993864" 30 Sep 2021
\|	Homopiperazine	Homopiperazine	100.16	4	PubChem \| InChI \| Smiles	"2021092815001632841201" 28 Sep 2021
\|	sCx4-strappedCH2CH2O	sCx4-strappedCH2CH2O	880.89	1	PubChem \| InChI \| Smiles	"2020100215051601651125" 02 Oct 2020
\|	P5A-CH2CH2NMe3	P5A-CH2CH2NMe3	2271.20	1	PubChem \| InChI \| Smiles	"2024081611291723807767" 16 Aug 2024
\|	4-Bromoadamantane-1-carboxylic acid	4-Bromoadamantane-1-carboxylic acid	259.14	2	PubChem \| InChI \| Smiles	"2020102816111603901497" 28 Oct 2020
\|	SEC-BUTYLAMINE	SEC-BUTYLAMINE	73.14	2	PubChem \| InChI \| Smiles	"2024072913271722259653" 29 Jul 2024
\|	1,3-Dioxolane, 4,5-dimethyl-2-phenyl-	1,3-Dioxolane, 4,5-dimethyl-2-phenyl-	178.23	2	PubChem \| InChI \| Smiles	"2024080809101723108252" 08 Aug 2024
\|	o-(Me)2-2.1.1	o-(Me)2-2.1.1	410.46	7	PubChem \| InChI \| Smiles	"2020101211171602501473" 12 Oct 2020
\|	Tetrabutylammonium perrhenate	Tetrabutylammonium perrhenate	492.67	1	PubChem \| InChI \| Smiles	"2021102508071635149251" 25 Oct 2021
\|	4-Methylbenzenesulfinamide	4-Methylbenzenesulfinamide	155.22	2	PubChem \| InChI \| Smiles	"2024072913531722261180" 29 Jul 2024
\|	1-Phenyl-1,2-ethanediol	1-Phenyl-1,2-ethanediol	138.16	2	PubChem \| InChI \| Smiles	"2024072914041722261895" 29 Jul 2024
\|	Lisinopril	Lisinopril	405.50	2	PubChem \| InChI \| Smiles	"2021100116121633104734" 01 Oct 2021
\|	2,2'-(hexane-1,6-diylbis(methylazanediyl))bis(N-(2,6-dimethylphenyl)acetamide)		466.66	1	PubChem \| InChI \| Smiles	"2024042313591713880787" 23 Apr 2024
\|	Iron trichloride	Iron trichloride	162.20	3	PubChem \| InChI \| Smiles	"2021092815551632844556" 28 Sep 2021
\|	RB	RB	1017.64	1	PubChem \| InChI \| Smiles	"2022062307411655970118" 23 Jun 2022
\|	4,4'-Dihydroxybiphenyl	4,4'-Dihydroxybiphenyl	186.21	2	PubChem \| InChI \| Smiles	"2021102715191635347942" 27 Oct 2021
\|	4-Isopropylphenol	4-Isopropylphenol	136.19	2	PubChem \| InChI \| Smiles	"2021102712391635338380" 27 Oct 2021
\|	Acyclic sodium 3,3'-(naphthalene-2,7-diyl)bis(propane-1-sulfonate) Cucurbituril		1577.52	8	PubChem \| InChI \| Smiles	"2020101218201602526828" 12 Oct 2020
\|	METHYL ORANGE	METHYL ORANGE	327.34	5	PubChem \| InChI \| Smiles	"2021102508161635149763" 25 Oct 2021
\|	alanylmethionyltyrosine	alanylmethionyltyrosine	383.50	1	PubChem \| InChI \| Smiles	"2023102416111698163898" 24 Oct 2023
\|	AlPcS4	AlPcS4	895.21	1	PubChem \| InChI \| Smiles	"2021030309081614762526" 03 Mar 2021
\|	Methyl-(R)-(-)-mandelate	Methyl-(R)-(-)-mandelate	166.18	2	PubChem \| InChI \| Smiles	"2021092820501632862252" 28 Sep 2021
\|	DiMVCP	DiMVCP	698.42	6	PubChem \| InChI \| Smiles	"2024031314471710341239" 13 Mar 2024
\|	4-Hydroxyphenylpyruvic acid	4-Hydroxyphenylpyruvic acid	180.16	1	PubChem \| InChI \| Smiles	"2022070507341657006481" 05 Jul 2022
\|	Tetrahelicene	Tetrahelicene	228.30	1	PubChem \| InChI \| Smiles	"2021102514161635171376" 25 Oct 2021
\|	syn-Amide Naphthotube	syn-Amide Naphthotube	1123.08	86	PubChem \| InChI \| Smiles	"2021102015301634743845" 20 Oct 2021
\|	Glycidyl methyl ether	Glycidyl methyl ether	88.11	2	PubChem \| InChI \| Smiles	"2024072913551722261312" 29 Jul 2024
\|	anti-Amide Naphthotube	anti-Amide Naphthotube	1123.08	89	PubChem \| InChI \| Smiles	"2021102015301634743836" 20 Oct 2021
\|	N-ethylacetamide	N-ethylacetamide	87.12	3	PubChem \| InChI \| Smiles	"2021092814591632841149" 28 Sep 2021
\|	Flavopereirine perchlorate	Flavopereirine perchlorate	346.80	2	PubChem \| InChI \| Smiles	"2021093010051632996303" 30 Sep 2021
\|	o-(Me)2-2.2.1	o-(Me)2-2.2.1	454.51	7	PubChem \| InChI \| Smiles	"2020101212031602504233" 12 Oct 2020
\|	(R)-3-Bromo-8-camphorsulfonic acid	(R)-3-Bromo-8-camphorsulfonic acid	311.19	1	PubChem \| InChI \| Smiles	"2021093015361633016203" 30 Sep 2021
\|	Thymine	Thymine	126.11	1	PubChem \| InChI \| Smiles	"2021093011441633002253" 30 Sep 2021
\|	MVCP	MVCP	453.36	6	PubChem \| InChI \| Smiles	"2024031314431710340992" 13 Mar 2024
\|	Mono[2-O-(2-hydroxypropyl)]-β-CD	Mono[2-O-(2-hydroxypropyl)]-β-CD	1193.07	5	PubChem \| InChI \| Smiles	"2020101615561602863797" 16 Oct 2020
\|	Ac-His-OMe	Ac-His-OMe	269.30	1	PubChem \| InChI \| Smiles	"2022063008311656577870" 30 Jun 2022
\|	gCx4-OEG	gCx4-OEG	1241.48	1	PubChem \| InChI \| Smiles	"2021030514041614953055" 05 Mar 2021
\|	Mono(6-O-a-maltosyl)-β-CD	Mono(6-O-a-maltosyl)-β-CD	1459.27	4	PubChem \| InChI \| Smiles	"2020102219571603396652" 22 Oct 2020
\|	DiMPCP	DiMPCP	646.34	6	PubChem \| InChI \| Smiles	"2024031314451710341105" 13 Mar 2024
\|	quinoline	quinoline	129.16	2	PubChem \| InChI \| Smiles	"2021010513511609854697" 05 Jan 2021
\|	Thr-Gly-Gly-Phe-Met-NH2	Thr-Gly-Gly-Phe-Met-NH2	510.61	1	PubChem \| InChI \| Smiles	"2021092915461632930373" 29 Sep 2021
\|	spermidine	spermidine	145.25	1	PubChem \| InChI \| Smiles	"2024032813131711631627" 28 Mar 2024
\|	L-Arg-Arg-Arg	L-Arg-Arg-Arg	486.60	2	PubChem \| InChI \| Smiles	"2020102918431603997017" 29 Oct 2020
\|	Berberrubine chloride	Berberrubine chloride	357.80	1	PubChem \| InChI \| Smiles	"2023072412101690200638" 24 Jul 2023
\|	Tos-Arg-OMe	Tos-Arg-OMe	378.87	2	PubChem \| InChI \| Smiles	"2022072008031658304191" 20 Jul 2022
\|	Heptanoic acid	Heptanoic acid	130.18	1	PubChem \| InChI \| Smiles	"2022062411391656070740" 24 Jun 2022
\|	Vitamin C	Vitamin C	176.12	1	PubChem \| InChI \| Smiles	"2021101821481634593720" 18 Oct 2021
\|	N1,N1,N6,N6-Tetramethylhexane-1,6-diamine dihydrochloride		245.23	1	PubChem \| InChI \| Smiles	"2024030613181709731114" 06 Mar 2024
\|	4-Fluorophenol	4-Fluorophenol	112.10	2	PubChem \| InChI \| Smiles	"2021093012591633006751" 30 Sep 2021
\|	N1,N6-dibenzylhexane-1,6-diaminium chloride		369.37	1	PubChem \| InChI \| Smiles	"2024031412211710418873" 14 Mar 2024
\|	Melamine	Melamine	126.12	4	PubChem \| InChI \| Smiles	"2020102212141603368861" 22 Oct 2020
\|	1,2-dichloroethane	1,2-dichloroethane	98.96	1	PubChem \| InChI \| Smiles	"2021101214581634050709" 12 Oct 2021
\|	(H)BU[6]	(H)BU[6]	924.76	1	PubChem \| InChI \| Smiles	"2020081916181597853935" 19 Aug 2020
\|	floxuridine	floxuridine	246.19	1	PubChem \| InChI \| Smiles	"2021101113021633957331" 11 Oct 2021
\|	Carbamylcholine	Carbamylcholine	147.20	2	PubChem \| InChI \| Smiles	"2021100814231633703030" 08 Oct 2021
\|	Paracetamol	Paracetamol	151.16	3	PubChem \| InChI \| Smiles	"2021100116101633104637" 01 Oct 2021
\|	CESIUM BROMIDE	CESIUM BROMIDE	212.81	1	PubChem \| InChI \| Smiles	"2021101215251634052303" 12 Oct 2021
\|	4-DEABN	4-DEABN	174.24	4	PubChem \| InChI \| Smiles	"2021093013261633008416" 30 Sep 2021
\|	Tetrabutylammonium methanesulfonate	Tetrabutylammonium methanesulfonate	337.60	9	PubChem \| InChI \| Smiles	"2021092208361632299817" 22 Sep 2021
\|	etidronate	etidronate	202.00	1	PubChem \| InChI \| Smiles	"2021010713091610024988" 07 Jan 2021
\|	L-tyrosyl-L-leucyl-L-alanine	L-tyrosyl-L-leucyl-L-alanine	365.42	1	PubChem \| InChI \| Smiles	"2022062308421655973768" 23 Jun 2022
\|	1-Heptanol	1-Heptanol	116.20	1	PubChem \| InChI \| Smiles	"2022062407051656054313" 24 Jun 2022
\|	(1S,2D,5S)-(-)-2-Hydroxy-3-pinanone	(1S,2D,5S)-(-)-2-Hydroxy-3-pinanone	168.24	1	PubChem \| InChI \| Smiles	"2021102420441635108248" 24 Oct 2021
\|	trans-2-hexenoate	trans-2-hexenoate	113.13	1	PubChem \| InChI \| Smiles	"2021102213331634909602" 22 Oct 2021
\|	2-Cyanophenol	2-Cyanophenol	119.12	3	PubChem \| InChI \| Smiles	"2021093013011633006894" 30 Sep 2021
\|	H-Phe-Met-OH	H-Phe-Met-OH	296.39	1	PubChem \| InChI \| Smiles	"2021092913011632920519" 29 Sep 2021
\|	Acetyl-D/L-Carnitine	Acetyl-D/L-Carnitine	203.24	7	PubChem \| InChI \| Smiles	"2021093010081632996517" 30 Sep 2021
\|	Dodecakis(4‐nitro...	Dodecakis(4‐nitro...	2517.20	1	PubChem \| InChI \| Smiles	"2020082109351598002550" 21 Aug 2020
\|	pamidronate	pamidronate	235.07	1	PubChem \| InChI \| Smiles	"2021102613391635255599" 26 Oct 2021
\|	trans-azobenzene-TEG	trans-azobenzene-TEG	330.38	1	PubChem \| InChI \| Smiles	"2022062908021656489765" 29 Jun 2022
\|	(S)-Camphorquinone 3-oxime	(S)-Camphorquinone 3-oxime	181.24	2	PubChem \| InChI \| Smiles	"2020102816411603903303" 28 Oct 2020
\|	1,7-Heptanediammonium	1,7-Heptanediammonium	132.25	3	PubChem \| InChI \| Smiles	"2022062412221656073345" 24 Jun 2022
\|	MBBI	MBBI	216.29	25	PubChem \| InChI \| Smiles	"2023061415051686755117" 14 Jun 2023
\|	sCx4-2,4-diNHSO2(4-CO2)Ph	sCx4-2,4-diNHSO2(4-CO2)Ph	978.00	2	PubChem \| InChI \| Smiles	"2020100115271601566072" 01 Oct 2020
\|	Dimetoxixylyleneglycoluril dimer	Dimetoxixylyleneglycoluril dimer	1209.11	1	PubChem \| InChI \| Smiles	"2020103117541604166884" 31 Oct 2020
\|	(S)-(+)-1-Phenyl-1,2-ethanediol	(S)-(+)-1-Phenyl-1,2-ethanediol	138.17	1	PubChem \| InChI \| Smiles	"2021102420461635108411" 24 Oct 2021
\|	5-Iodo-N,N'-bis[6-(pentanoylamino)pyrid-2-yl]isophthalamide		642.49	3	PubChem \| InChI \| Smiles	"2020101214511602514309" 12 Oct 2020
\|	Monoquat	Monoquat	171.22	2	PubChem \| InChI \| Smiles	"2021093013121633007521" 30 Sep 2021
\|	sCx4-NHSO2(4-Br)Ph	sCx4-NHSO2(4-Br)Ph	895.75	2	PubChem \| InChI \| Smiles	"2020100115201601565647" 01 Oct 2020
\|	N-(4-(cyclohepta-2,4,6-trien-1-ylidene)cyclohexa-2,5-dien-1-ylidene)-N-methylmethanaminium		210.30	1	PubChem \| InChI \| Smiles	"2021102613481635256095" 26 Oct 2021
\|	N,N,N-trimethylbenzenaminium	N,N,N-trimethylbenzenaminium	136.21	1	PubChem \| InChI \| Smiles	"2024042914361714401400" 29 Apr 2024
\|	5-Nitro-N,N'-bis[6-(pentanoylamino)pyrid-2-yl]isophthalamide		561.59	5	PubChem \| InChI \| Smiles	"2020101215031602515008" 12 Oct 2020
\|	Azobenzene-polyethylene-glycol 2	Azobenzene-polyethylene-glycol 2	2193.61	2	PubChem \| InChI \| Smiles	"2022062308551655974506" 23 Jun 2022
\|	5-Benzoyloxy-N,N'-bis[6-(pentanoylamino)pyrid-2-yl]isophthalamide		636.70	3	PubChem \| InChI \| Smiles	"2020101214401602513628" 12 Oct 2020
\|	sCx4-NH(CO)Bz	sCx4-NH(CO)Bz	780.00	2	PubChem \| InChI \| Smiles	"2020100115241601565864" 01 Oct 2020
\|	Propylene carbonate	Propylene carbonate	102.09	4	PubChem \| InChI \| Smiles	"2022063014161656598583" 30 Jun 2022
\|	5-Iodo-N,N'-Bis[6-(2-ethylhexanoylamino)pyrid-2-yl]isophthalamide		726.65	3	PubChem \| InChI \| Smiles	"2020101214451602513937" 12 Oct 2020
\|	Boc-L-Ala-OMe	Boc-L-Ala-OMe	203.24	1	PubChem \| InChI \| Smiles	"2021100716431633624994" 07 Oct 2021
\|	Barbital	Barbital	184.19	19	PubChem \| InChI \| Smiles	"2020100310451601721936" 03 Oct 2020
\|	Betaine	Betaine	117.15	3	PubChem \| InChI \| Smiles	"2021100116271633105643" 01 Oct 2021
\|	5-Benzoyloxy-N,N'-bis[6-(2-ethylhexanoyl)aminopyrid-2-yl]isophthalamide		720.86	3	PubChem \| InChI \| Smiles	"2020101214491602514179" 12 Oct 2020
\|	Norfloxacin	Norfloxacin	319.33	8	PubChem \| InChI \| Smiles	"2020101119221602444160" 11 Oct 2020
\|	Benzyltrimethylammonium chloride	Benzyltrimethylammonium chloride	185.69	4	PubChem \| InChI \| Smiles	"2020102217021603386126" 22 Oct 2020
\|	ARTK(me3)QTARKSTGY	ARTK(me3)QTARKSTGY	1509.73	7	PubChem \| InChI \| Smiles	"2020101212161602505011" 12 Oct 2020
\|	Tris[2,3-quinoxalinediylbis(oxyethyleneoxyethyleneoxyethyleneoxy)]triphenylene + Dibenzylammonium guest		1693.86	1	PubChem \| InChI \| Smiles	"2020081213341597239248" 12 Aug 2020
\|	ARTKQTARK(me3)STGY	ARTKQTARK(me3)STGY	1509.73	7	PubChem \| InChI \| Smiles	"2020101211091602500966" 12 Oct 2020
\|	paclitaxel	paclitaxel	853.90	1	PubChem \| InChI \| Smiles	"2021102612081635250118" 26 Oct 2021
\|	2-(1H-benzimidazol-2-yl)phenol	2-(1H-benzimidazol-2-yl)phenol	210.23	1	PubChem \| InChI \| Smiles	"2020122109321608543155" 21 Dec 2020
\|	sCx4-NH(CO)Np	sCx4-NH(CO)Np	830.00	2	PubChem \| InChI \| Smiles	"2020100115251601565941" 01 Oct 2020
\|	(R)-(-)-1-Phenyl-1,2-ethanediol	(R)-(-)-1-Phenyl-1,2-ethanediol	138.17	1	PubChem \| InChI \| Smiles	"2021093015001633014059" 30 Sep 2021
\|	(R)-1,1,2,4,4-pentamethylpiperazine-1,4-diium		158.28	1	PubChem \| InChI \| Smiles	"2023011610321673865172" 16 Jan 2023
\|	3-Methoxy-2-naphthol	3-Methoxy-2-naphthol	174.20	2	PubChem \| InChI \| Smiles	"2021093013131633007623" 30 Sep 2021
\|	Dibenzoyl-D-tartaric acid	Dibenzoyl-D-tartaric acid	358.30	1	PubChem \| InChI \| Smiles	"2021093016181633018732" 30 Sep 2021
\|	Thr-Gly-D-Ala-Phe...	Thr-Gly-D-Ala-Phe...	524.63	1	PubChem \| InChI \| Smiles	"2022062411241656069897" 24 Jun 2022
\|	Buckminsterfullerene	Buckminsterfullerene	720.60	2	PubChem \| InChI \| Smiles	"2022070507421657006938" 05 Jul 2022
\|	Corral[5]arene	Corral[5]arene	1181.33	23	PubChem \| InChI \| Smiles	"2022112814251669645556" 28 Nov 2022
\|	heptakis(2,6-di-methyl)-β-Cyclodextrine		1331.37	1	PubChem \| InChI \| Smiles	"2020081213331597239234" 12 Aug 2020
\|	2-HE-β-CD	2-HE-β-CD	1179.04	1	PubChem \| InChI \| Smiles	"2020081213331597239235" 12 Aug 2020
\|	Corticosterone	Corticosterone	346.47	1	PubChem \| InChI \| Smiles	"2021092816141632845659" 28 Sep 2021
\|	Dicyclohexano-18-Crown-6	Dicyclohexano-18-Crown-6	372.50	17	PubChem \| InChI \| Smiles	"2022071107161657523790" 11 Jul 2022
\|	Tetrabutylammonium trifluoromethanesulfonate		391.50	2	PubChem \| InChI \| Smiles	"2021092208151632298529" 22 Sep 2021
\|	sCx4-TEG-NBD	sCx4-TEG-NBD	1185.00	1	PubChem \| InChI \| Smiles	"2020100215241601652260" 02 Oct 2020
\|	1-Octylammonium	1-Octylammonium	130.25	4	PubChem \| InChI \| Smiles	"2020102619061603739176" 26 Oct 2020
\|	Butyl Rhodamine B	Butyl Rhodamine B	499.67	21	PubChem \| InChI \| Smiles	"2022062407031656054235" 24 Jun 2022
\|	RGD	RGD	346.34	3	PubChem \| InChI \| Smiles	"2020103108591604134742" 31 Oct 2020
\|	Perrhenate	Perrhenate	250.20	7	PubChem \| InChI \| Smiles	"2020100519521601927528" 05 Oct 2020
\|	ACh	ACh	146.21	18	PubChem \| InChI \| Smiles	"2021092818211632853275" 28 Sep 2021
\|	N-(1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)-11-oxo-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinoline-10-carboxamide		388.42	2	PubChem \| InChI \| Smiles	"2021100116071633104462" 01 Oct 2021
\|	HCO3	HCO3	61.02	1	PubChem \| InChI \| Smiles	"2022062411101656069047" 24 Jun 2022
\|	N1,N1'-(1,4-phenylenebis(methylene))bis(propane-1,3-diaminium) chloride		396.23	1	PubChem \| InChI \| Smiles	"2022062413371656077878" 24 Jun 2022
\|	N-((5-chlorofuran-2-yl)methyl)prop-2-en-1-amine		171.62	2	PubChem \| InChI \| Smiles	"2022062407181656055083" 24 Jun 2022
\|	Sodium hexafluoroantimonate	Sodium hexafluoroantimonate	258.74	2	PubChem \| InChI \| Smiles	"2021100111271633087649" 01 Oct 2021
\|	Gly-Phe	Gly-Phe	222.24	2	PubChem \| InChI \| Smiles	"2020102816081603901288" 28 Oct 2020
\|	Viologen-cyclophane-C7	Viologen-cyclophane-C7	1088.61	1	PubChem \| InChI \| Smiles	"2020121713441608212665" 17 Dec 2020
\|	O-Benzyl-L-Ser	O-Benzyl-L-Ser	195.22	1	PubChem \| InChI \| Smiles	"2021093015301633015859" 30 Sep 2021
\|	(S)-(+)-alpha-Methoxyphenylacetic acid		166.18	1	PubChem \| InChI \| Smiles	"2021101214491634050178" 12 Oct 2021
\|	Cyclohexanohemi cucurbit[8]uril	Cyclohexanohemi cucurbit[8]uril	1217.58	12	PubChem \| InChI \| Smiles	"2020102313501603461021" 23 Oct 2020
\|	Spermine (fully protonated form)	Spermine (fully protonated form)	206.37	16	PubChem \| InChI \| Smiles	"2022063014501656600611" 30 Jun 2022
\|	Tetrabutylammonium tetrafluoroborate	Tetrabutylammonium tetrafluoroborate	329.30	1	PubChem \| InChI \| Smiles	"2021100116201633105222" 01 Oct 2021
\|	Phenylenebis[oxy(3,6-dioxaoctane-1,8-diyl)oxy]]quinoxaline and two benzene-triyltris(oxy))tris(benzenediyl))tris(N-benzylmethanaminium)		2150.89	1	PubChem \| InChI \| Smiles	"2020081213331597239236" 12 Aug 2020
\|	AntNMe3.Cl	AntNMe3.Cl	271.78	5	PubChem \| InChI \| Smiles	"2022062917241656523450" 29 Jun 2022
\|	Dimetoxinaphtaleneglycoluril dimer	Dimetoxinaphtaleneglycoluril dimer	1309.23	2	PubChem \| InChI \| Smiles	"2020103117561604166967" 31 Oct 2020
\|	Benzothiazole-polyethylene-glycol-polymer		2236.69	2	PubChem \| InChI \| Smiles	"2022062411491656071385" 24 Jun 2022
\|	Valinomycin	Valinomycin	1111.30	9	PubChem \| InChI \| Smiles	"2020103119481604173722" 31 Oct 2020
\|	Acridine	Acridine	179.22	2	PubChem \| InChI \| Smiles	"2021092207271632295664" 22 Sep 2021
\|	1,4-Dioxane	1,4-Dioxane	88.11	8	PubChem \| InChI \| Smiles	"2020101119061602443184" 11 Oct 2020
\|	Mesylate	Mesylate	95.10	5	PubChem \| InChI \| Smiles	"2020101615501602863432" 16 Oct 2020
\|	[3.3.3]Cryptand	[3.3.3]Cryptand	508.65	12	PubChem \| InChI \| Smiles	"2020100716081602086906" 07 Oct 2020
\|	[C4mim][PF6]	[C4mim][PF6]	284.18	1	PubChem \| InChI \| Smiles	"2022062922491656542963" 29 Jun 2022
\|	Cs+	Cs+	132.91	29	PubChem \| InChI \| Smiles	"2021110416071636042040" 04 Nov 2021
\|	Tyramine	Tyramine	137.18	5	PubChem \| InChI \| Smiles	"2021093013501633009824" 30 Sep 2021
\|	Triphenylene receptor	Triphenylene receptor	888.56	21	PubChem \| InChI \| Smiles	"2021100114091633097348" 01 Oct 2021
\|	Pyrocatechol	Pyrocatechol	110.11	17	PubChem \| InChI \| Smiles	"2021092210141632305666" 22 Sep 2021
\|	3,5-trifluoromethylbenzyl-BU	3,5-trifluoromethylbenzyl-BU	3586.11	5	PubChem \| InChI \| Smiles	"2020082114581598021897" 21 Aug 2020
\|	D-3-Bromocamphor-8-sulfonic acid ammonium salt		328.22	1	PubChem \| InChI \| Smiles	"2021093015371633016272" 30 Sep 2021
\|	Triflate	Triflate	149.07	5	PubChem \| InChI \| Smiles	"2020101617061602867962" 16 Oct 2020
\|	[3.2.2]Cryptand	[3.2.2]Cryptand	420.50	23	PubChem \| InChI \| Smiles	"2020092209451600767903" 22 Sep 2020
\|	3-benzyl-1-methyl-1H-imidazol-3-ium	3-benzyl-1-methyl-1H-imidazol-3-ium	173.23	3	PubChem \| InChI \| Smiles	"2024043009391714469981" 30 Apr 2024
\|	4-trifluoromethylthiobenzyl-BU	4-trifluoromethylthiobenzyl-BU	3122.83	7	PubChem \| InChI \| Smiles	"2020082115041598022283" 21 Aug 2020
\|	Bn12F60Bambu	Bn12F60Bambu	3001.50	5	PubChem \| InChI \| Smiles	"2020082115071598022426" 21 Aug 2020
\|	(S)-3-Phenylbutyric acid	(S)-3-Phenylbutyric acid	164.20	1	PubChem \| InChI \| Smiles	"2021102509511635155475" 25 Oct 2021
\|	Lithium nitrate	Lithium nitrate	69.00	1	PubChem \| InChI \| Smiles	"2021101216231634055817" 12 Oct 2021
\|	1(ammoniomethyl),1'(carboxylic)ferrocene		290.16	4	PubChem \| InChI \| Smiles	"2020101615071602860828" 16 Oct 2020
\|	[2.1.1]Cryptand	[2.1.1]Cryptand	288.39	23	PubChem \| InChI \| Smiles	"2020092209461600768006" 22 Sep 2020
\|	Diammonium salt d	Diammonium salt d	786.61	1	PubChem \| InChI \| Smiles	"2024072914111722262265" 29 Jul 2024
\|	NaBArF	NaBArF	886.20	3	PubChem \| InChI \| Smiles	"2020102720501603831815" 27 Oct 2020
\|	Ba2+	Ba2+	137.33	30	PubChem \| InChI \| Smiles	"2021110416021636041774" 04 Nov 2021
\|	[2.2.C8]Cryptand	[2.2.C8]Cryptand	372.50	8	PubChem \| InChI \| Smiles	"2020100319311601753487" 03 Oct 2020
\|	Diammonium salt f	Diammonium salt f	832.64	1	PubChem \| InChI \| Smiles	"2024072913521722261140" 29 Jul 2024
\|	[2.2.2]Cryptand	[2.2.2]Cryptand	376.49	24	PubChem \| InChI \| Smiles	"2020092209441600767875" 22 Sep 2020
\|	KTTKS	KTTKS	563.64	1	PubChem \| InChI \| Smiles	"2022072008041658304296" 20 Jul 2022
\|	Dimethyl-tetraoxa-diazacyclooctadecane		290.40	8	PubChem \| InChI \| Smiles	"2020101119531602446033" 11 Oct 2020
\|	Rb+	Rb+	85.47	30	PubChem \| InChI \| Smiles	"2021110416061636042008" 04 Nov 2021
\|	EDTA	EDTA	292.24	9	PubChem \| InChI \| Smiles	"2020100716581602089939" 07 Oct 2020
\|	[2.2.1]Cryptand	[2.2.1]Cryptand	332.44	24	PubChem \| InChI \| Smiles	"2020092209461600767984" 22 Sep 2020
\|	[3.3.2]Cryptand	[3.3.2]Cryptand	494.60	13	PubChem \| InChI \| Smiles	"2020100716081602086937" 07 Oct 2020
\|	Uramildiacetic acid	Uramildiacetic acid	259.17	7	PubChem \| InChI \| Smiles	"2020101210571602500270" 12 Oct 2020
\|	dibenzylazanium;h...	dibenzylazanium;h...	343.25	4	PubChem \| InChI \| Smiles	"2024072913401722260435" 29 Jul 2024
\|	Urea	Urea	60.06	1	PubChem \| InChI \| Smiles	"2021100818021633716136" 08 Oct 2021
\|	Methylammonium chloride	Methylammonium chloride	67.52	3	PubChem \| InChI \| Smiles	"2020102515401603640449" 25 Oct 2020
\|	FcG+	FcG+	0.00	2	PubChem \| InChI \| Smiles	"2024032812251711628718" 28 Mar 2024
\|	N-Methyl thebaine	N-Methyl thebaine	328.43	2	PubChem \| InChI \| Smiles	"2020102821111603919466" 28 Oct 2020
\|	Pyrazine	Pyrazine	80.09	6	PubChem \| InChI \| Smiles	"2020101609501602841854" 16 Oct 2020
\|	Enniatin b	Enniatin b	639.80	9	PubChem \| InChI \| Smiles	"2020100717521602093150" 07 Oct 2020
\|	Diethyl phosphate	Diethyl phosphate	153.09	2	PubChem \| InChI \| Smiles	"2020102912441603975489" 29 Oct 2020
\|	Dibutyl phosphate	Dibutyl phosphate	209.20	2	PubChem \| InChI \| Smiles	"2020102912481603975693" 29 Oct 2020
\|	6-Amino-1-hexanol	6-Amino-1-hexanol	117.19	1	PubChem \| InChI \| Smiles	"2023072409171690190229" 24 Jul 2023
\|	safranin O	safranin O	350.84	1	PubChem \| InChI \| Smiles	"2022072008181658305083" 20 Jul 2022
\|	(S)-(+)-Benzyl glycidyl ether	(S)-(+)-Benzyl glycidyl ether	164.20	1	PubChem \| InChI \| Smiles	"2021093015291633015781" 30 Sep 2021
\|	P5A-COOH	P5A-COOH	1192.00	10	PubChem \| InChI \| Smiles	"2020093015411601480483" 30 Sep 2020
\|	Cyclopentanol	Cyclopentanol	86.13	2	PubChem \| InChI \| Smiles	"2021101215191634051965" 12 Oct 2021
\|	(PMB)BU[6]	(PMB)BU[6]	2366.54	1	PubChem \| InChI \| Smiles	"2020082510261598351204" 25 Aug 2020
\|	syn-Urea Naphthotube	syn-Urea Naphthotube	1105.32	8	PubChem \| InChI \| Smiles	"2020081411461597405597" 14 Aug 2020
\|	Pr12BU[6]	Pr12BU[6]	1429.72	1	PubChem \| InChI \| Smiles	"2020082510381598351924" 25 Aug 2020
\|	undecane-1,11-dia...	undecane-1,11-dia...	259.26	1	PubChem \| InChI \| Smiles	"2024030610371709721440" 06 Mar 2024
\|	phenylpyruvic acid	phenylpyruvic acid	164.16	2	PubChem \| InChI \| Smiles	"2023072712161690460187" 27 Jul 2023
\|	Me10prCB[5]	Me10prCB[5]	1041.00	3	PubChem \| InChI \| Smiles	"2020110111061604228777" 01 Nov 2020
\|	acetylphenylalanine	acetylphenylalanine	207.23	2	PubChem \| InChI \| Smiles	"2023072712241690460665" 27 Jul 2023
\|	Me8prCB[5]	Me8prCB[5]	999.00	2	PubChem \| InChI \| Smiles	"2020110111061604228780" 01 Nov 2020
\|	L-Asp-L-Phe	L-Asp-L-Phe	280.28	2	PubChem \| InChI \| Smiles	"2020102817141603905256" 28 Oct 2020
\|	Cx4R-(CN)4	Cx4R-(CN)4	700.74	4	PubChem \| InChI \| Smiles	"2020102313051603458326" 23 Oct 2020
\|	GGKKGGY	GGKKGGY	665.74	1	PubChem \| InChI \| Smiles	"2024022216121708618360" 22 Feb 2024
\|	Sulfonate glycolu...	Sulfonate glycolu...	2075.87	1	PubChem \| InChI \| Smiles	"2020082514131598364821" 25 Aug 2020
\|	Benzoic acid	Benzoic acid	122.12	4	PubChem \| InChI \| Smiles	"2021100814231633703006" 08 Oct 2021
\|	styrylcoumarin-1	styrylcoumarin-1	462.32	1	PubChem \| InChI \| Smiles	"2022062411131656069237" 24 Jun 2022
\|	2,2-Dimethoxypropane	2,2-Dimethoxypropane	104.15	3	PubChem \| InChI \| Smiles	"2021101209431634031816" 12 Oct 2021
\|	cyclohex-3-ene-1-carboxylic acid	cyclohex-3-ene-1-carboxylic acid	126.15	2	PubChem \| InChI \| Smiles	"2023072712301690461007" 27 Jul 2023
\|	Nile Red	Nile Red	318.40	2	PubChem \| InChI \| Smiles	"2021102512241635164656" 25 Oct 2021
\|	Pinacolone	Pinacolone	100.16	1	PubChem \| InChI \| Smiles	"2022062307511655970699" 23 Jun 2022
\|	Hexanoate	Hexanoate	115.15	1	PubChem \| InChI \| Smiles	"2021100716391633624798" 07 Oct 2021
\|	N-Cbz-L-Serine	N-Cbz-L-Serine	239.23	1	PubChem \| InChI \| Smiles	"2021102420361635107792" 24 Oct 2021
\|	sCx8-mono(CH2CO2H)	sCx8-mono(CH2CO2H)	1539.00	4	PubChem \| InChI \| Smiles	"2020100114321601562741" 01 Oct 2020
\|	1-Heptylammonium	1-Heptylammonium	116.22	4	PubChem \| InChI \| Smiles	"2020102617011603731690" 26 Oct 2020
\|	3-methylphenylacetate	3-methylphenylacetate	149.17	1	PubChem \| InChI \| Smiles	"2021102213311634909509" 22 Oct 2021
\|	Hexylamine	Hexylamine	101.19	1	PubChem \| InChI \| Smiles	"2021093011451633002331" 30 Sep 2021
\|	CHLOROCYCLOHEXANE	CHLOROCYCLOHEXANE	118.60	1	PubChem \| InChI \| Smiles	"2021101910281634639330" 19 Oct 2021
\|	3,3'-[1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-7,16-diylbis(methylene)]bis[n-(2-hydroxyphenyl)-2-hydroxy-5-bromobenzenemethanimine]		870.60	2	PubChem \| InChI \| Smiles	"2020102912261603974393" 29 Oct 2020
\|	Diamantan-4-ol	Diamantan-4-ol	204.31	14	PubChem \| InChI \| Smiles	"2023073111231690802602" 31 Jul 2023
\|	TPS	TPS	307.36	1	PubChem \| InChI \| Smiles	"2022062413251656077155" 24 Jun 2022
\|	(1R,2R,5R)-2-Hydroxy-3-pinanone	(1R,2R,5R)-2-Hydroxy-3-pinanone	168.24	1	PubChem \| InChI \| Smiles	"2021093016161633018606" 30 Sep 2021
\|	CA	CA	430.55	3	PubChem \| InChI \| Smiles	"2021011503311610681472" 15 Jan 2021
\|	Europium(3+)	Europium(3+)	151.96	1	PubChem \| InChI \| Smiles	"2021093014091633010970" 30 Sep 2021
\|	L-Phe	L-Phe	165.19	43	PubChem \| InChI \| Smiles	"2021092209571632304621" 22 Sep 2021
\|	trans-3-hexenoate	trans-3-hexenoate	113.13	1	PubChem \| InChI \| Smiles	"2021102213341634909653" 22 Oct 2021
\|	(S)-Hexahydromandelic acid	(S)-Hexahydromandelic acid	158.20	1	PubChem \| InChI \| Smiles	"2021102420471635108464" 24 Oct 2021
\|	He	He	4.00	1	PubChem \| InChI \| Smiles	"2022070112191656677996" 01 Jul 2022
\|	CB7-HEG-BC	CB7-HEG-BC	1908.58	12	PubChem \| InChI \| Smiles	"2020101215241602516245" 12 Oct 2020
\|	1,1'-(oxybis(ethane-2,1-diyl))bispyridinium bromide		390.11	1	PubChem \| InChI \| Smiles	"2021101109351633944925" 11 Oct 2021
\|	N,N′-dimethyldipyridyliumethylene	N,N′-dimethyldipyridyliumethylene	212.29	2	PubChem \| InChI \| Smiles	"2022062313161655990203" 23 Jun 2022
\|	Gadolinium trichloride	Gadolinium trichloride	263.60	1	PubChem \| InChI \| Smiles	"2021100814551633704929" 08 Oct 2021
\|	TCA	TCA	553.68	3	PubChem \| InChI \| Smiles	"2021011503331610681606" 15 Jan 2021
\|	1-Hexanol	1-Hexanol	102.17	7	PubChem \| InChI \| Smiles	"2021100814301633703409" 08 Oct 2021
\|	butane-1,4-diamin...	butane-1,4-diamin...	161.07	1	PubChem \| InChI \| Smiles	"2024030610191709720355" 06 Mar 2024
\|	Butylamine	Butylamine	73.14	2	PubChem \| InChI \| Smiles	"2021093010051632996343" 30 Sep 2021
\|	N-benzyl-N,N-dimethylpentan-1-aminium	N-benzyl-N,N-dimethylpentan-1-aminium	206.35	1	PubChem \| InChI \| Smiles	"2024043013541714485269" 30 Apr 2024
\|	(+)-2,3-O-Benzylidene-D-threitol	(+)-2,3-O-Benzylidene-D-threitol	210.23	1	PubChem \| InChI \| Smiles	"2021092818241632853474" 28 Sep 2021
\|	Rhodamine 6G	Rhodamine 6G	479.02	25	PubChem \| InChI \| Smiles	"2021110119071635793659" 01 Nov 2021
\|	4,9-Dihydroxydiamantane	4,9-Dihydroxydiamantane	220.31	20	PubChem \| InChI \| Smiles	"2023073111231690802636" 31 Jul 2023
\|	(R)-(-)-Benzyl glycidyl ether	(R)-(-)-Benzyl glycidyl ether	164.20	1	PubChem \| InChI \| Smiles	"2021102420381635107895" 24 Oct 2021
\|	dl-Leu-Gly-dl-Phe	dl-Leu-Gly-dl-Phe	335.40	2	PubChem \| InChI \| Smiles	"2021101114161633961788" 11 Oct 2021
\|	Spermidine	Spermidine	148.27	6	PubChem \| InChI \| Smiles	"2022062307391655969940" 23 Jun 2022
\|	CB5a	CB5a	1197.06	33	PubChem \| InChI \| Smiles	"2024030609121709716379" 06 Mar 2024
\|	Aciridine	Aciridine	209.25	22	PubChem \| InChI \| Smiles	"2024030609261709717190" 06 Mar 2024
\|	CB7-TEG-BC	CB7-TEG-BC	1820.50	13	PubChem \| InChI \| Smiles	"2020101215271602516447" 12 Oct 2020
\|	Methyl-(S)-(+)-mandelate	Methyl-(S)-(+)-mandelate	166.18	2	PubChem \| InChI \| Smiles	"2021093007051632985547" 30 Sep 2021
\|	Acetophenone	Acetophenone	120.15	1	PubChem \| InChI \| Smiles	"2020081213341597239242" 12 Aug 2020
\|	(s)-(-)-citronellic acid	(s)-(-)-citronellic acid	170.25	4	PubChem \| InChI \| Smiles	"2021092907271632900423" 29 Sep 2021
\|	(-)-2,3-O-Benzylidene-l-threitol	(-)-2,3-O-Benzylidene-l-threitol	210.23	1	PubChem \| InChI \| Smiles	"2021102420311635107519" 24 Oct 2021
\|	Bis(5-carboxypenty) Viologen	Bis(5-carboxypenty) Viologen	546.29	1	PubChem \| InChI \| Smiles	"2020101120491602449384" 11 Oct 2020
\|	1-methylbutylammonium	1-methylbutylammonium	88.17	7	PubChem \| InChI \| Smiles	"2021102513591635170390" 25 Oct 2021
\|	Cisatracurium	Cisatracurium	929.16	7	PubChem \| InChI \| Smiles	"2020101211141602501249" 12 Oct 2020
\|	HMe-CB7	HMe-CB7	1261.00	5	PubChem \| InChI \| Smiles	"2020102820331603917218" 28 Oct 2020
\|	Ampicillin	Ampicillin	349.40	3	PubChem \| InChI \| Smiles	"2021092815051632841526" 28 Sep 2021
\|	1,1'-bis(4-bromophenyl)-[4,4'-bipyridine]-1,1'-diium		468.19	1	PubChem \| InChI \| Smiles	"2020110916131604938394" 09 Nov 2020
\|	phenylmethanaminium	phenylmethanaminium	108.16	2	PubChem \| InChI \| Smiles	"2023071406591689317964" 14 Jul 2023
\|	Dodecakis(2‐nitro...	Dodecakis(2‐nitro...	2546.20	1	PubChem \| InChI \| Smiles	"2021021910271613730421" 19 Feb 2021
\|	7,16-Bis[2-(2-methoxyethoxy)ethyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane		466.60	2	PubChem \| InChI \| Smiles	"2020102911011603969310" 29 Oct 2020
\|	H-Arg-OH	H-Arg-OH	210.66	2	PubChem \| InChI \| Smiles	"2022071207151657610159" 12 Jul 2022
\|	Strontium chloride hexahydrate	Strontium chloride hexahydrate	266.60	4	PubChem \| InChI \| Smiles	"2021092315071632409620" 23 Sep 2021
\|	9-Hydroxyphenylfluoron	9-Hydroxyphenylfluoron	336.30	6	PubChem \| InChI \| Smiles	"2021102512591635166781" 25 Oct 2021
\|	L-Leu-L-Val	L-Leu-L-Val	230.30	2	PubChem \| InChI \| Smiles	"2023102407231698132213" 24 Oct 2023
\|	1,1'-diphenyl-[4,4'-bipyridine]-1,1'-diium		310.40	2	PubChem \| InChI \| Smiles	"2022062312291655987391" 23 Jun 2022
\|	1-[5-(Butylcarbamoyl)-1H-pyrrole-2-ylcarbonyl]guanidinium		252.29	1	PubChem \| InChI \| Smiles	"2021102613081635253726" 26 Oct 2021
\|	(S)-(-)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetic acid		234.17	1	PubChem \| InChI \| Smiles	"2021093016251633019125" 30 Sep 2021
\|	2,6-Dihydroxynaphthalene	2,6-Dihydroxynaphthalene	160.17	20	PubChem \| InChI \| Smiles	"2021092210011632304918" 22 Sep 2021
\|	2-(benzyloxy)acetaldehyde	2-(benzyloxy)acetaldehyde	150.18	1	PubChem \| InChI \| Smiles	"2021102420411635108061" 24 Oct 2021
\|	L-lysyl-L-lysyl-L-lysyl-L-lysine	L-lysyl-L-lysyl-L-lysyl-L-lysine	530.70	1	PubChem \| InChI \| Smiles	"2023102415401698162011" 24 Oct 2023
\|	4,4'-Bipyridine dihydrochloride	4,4'-Bipyridine dihydrochloride	229.11	2	PubChem \| InChI \| Smiles	"2021102509381635154703" 25 Oct 2021
\|	Rhodamine 123	Rhodamine 123	380.83	2	PubChem \| InChI \| Smiles	"2020102721081603832888" 27 Oct 2020
\|	Testosterone	Testosterone	288.43	5	PubChem \| InChI \| Smiles	"2020102612231603715013" 26 Oct 2020
\|	6-O-alpha-D-glucosyl-β-CD	6-O-alpha-D-glucosyl-β-CD	1297.13	1	PubChem \| InChI \| Smiles	"2021102610001635242438" 26 Oct 2021
\|	Coralyne chloride	Coralyne chloride	399.87	2	PubChem \| InChI \| Smiles	"2020102816561603904191" 28 Oct 2020
\|	Tetrabutylammonium squaric acid	Tetrabutylammonium squaric acid	354.50	2	PubChem \| InChI \| Smiles	"2020103013361604064982" 30 Oct 2020
\|	Tetrabutylammonium hexafluorophosphate		387.43	4	PubChem \| InChI \| Smiles	"2021092208401632300050" 22 Sep 2021
\|	1,1'-bis(4-nitrophenyl)-[4,4'-bipyridine]-1,1'-diium		400.39	3	PubChem \| InChI \| Smiles	"2022062313151655990105" 23 Jun 2022
\|	Ferrocene	Ferrocene	186.03	1	PubChem \| InChI \| Smiles	"2020111814121605708728" 18 Nov 2020
\|	DBF-5kPEGOMe	DBF-5kPEGOMe	5293.26	9	PubChem \| InChI \| Smiles	"2022070113551656683728" 01 Jul 2022
\|	Tetrabutylammonium perchlorate	Tetrabutylammonium perchlorate	341.90	1	PubChem \| InChI \| Smiles	"2021100116171633105070" 01 Oct 2021
\|	tropylium cation	tropylium cation	91.13	1	PubChem \| InChI \| Smiles	"2021010713151610025319" 07 Jan 2021
\|	Nickel nitrate	Nickel nitrate	182.70	1	PubChem \| InChI \| Smiles	"2021101216201634055622" 12 Oct 2021
\|	10-Hydroxycamptothecin	10-Hydroxycamptothecin	364.40	1	PubChem \| InChI \| Smiles	"2023061415081686755333" 14 Jun 2023
\|	ARTK(me3)QTAY	ARTK(me3)QTAY	982.16	1	PubChem \| InChI \| Smiles	"2022062412441656074650" 24 Jun 2022
\|	1-(2-carboxyethyl)-3,5-dimethyl-Pyridinium		180.22	3	PubChem \| InChI \| Smiles	"2020101612281602851298" 16 Oct 2020
\|	1,1'-bis(4-(ethoxycarbonyl)phenyl)-[4,4'-bipyridine]-1,1'-diium		454.52	3	PubChem \| InChI \| Smiles	"2022062412161656072982" 24 Jun 2022
\|	2,2'-(cyclohexa-2,5-diene-1,4-diylidene)dimalononitrile		204.19	1	PubChem \| InChI \| Smiles	"2024042914271714400852" 29 Apr 2024
\|	Pinacolyl methylphosphonic acid	Pinacolyl methylphosphonic acid	180.18	2	PubChem \| InChI \| Smiles	"2021101116131633968824" 11 Oct 2021
\|	Diethyl methylphosphonate	Diethyl methylphosphonate	152.13	2	PubChem \| InChI \| Smiles	"2021101908111634631107" 19 Oct 2021
\|	ARTKQTAY	ARTKQTAY	940.08	1	PubChem \| InChI \| Smiles	"2022062407121656054764" 24 Jun 2022
\|	Iodobenzene	Iodobenzene	204.01	4	PubChem \| InChI \| Smiles	"2021101910281634639302" 19 Oct 2021
\|	Ad-Vio	Ad-Vio	348.48	2	PubChem \| InChI \| Smiles	"2020120303121606965136" 03 Dec 2020
\|	Arg-Lys	Arg-Lys	302.37	1	PubChem \| InChI \| Smiles	"2021101908131634631221" 19 Oct 2021
\|	Sodium nitrate	Sodium nitrate	85.00	4	PubChem \| InChI \| Smiles	"2021101215451634053552" 12 Oct 2021
\|	phenylacetate	phenylacetate	135.14	1	PubChem \| InChI \| Smiles	"2021102213291634909381" 22 Oct 2021
\|	L-3,4-Dihydroxyphenylalanine	L-3,4-Dihydroxyphenylalanine	197.19	1	PubChem \| InChI \| Smiles	"2021100111311633087879" 01 Oct 2021
\|	pentane-1,5-diaminium chloride	pentane-1,5-diaminium chloride	175.10	1	PubChem \| InChI \| Smiles	"2021092207571632297475" 22 Sep 2021
\|	Benzoate	Benzoate	121.11	2	PubChem \| InChI \| Smiles	"2021092207361632296182" 22 Sep 2021
\|	p-tolylmethanaminium	p-tolylmethanaminium	122.19	1	PubChem \| InChI \| Smiles	"2023062709241687857886" 27 Jun 2023
\|	hexane diamine dihydrochloride	hexane diamine dihydrochloride	189.12	1	PubChem \| InChI \| Smiles	"2024031313441710337455" 13 Mar 2024
\|	4-methylphenylacetate	4-methylphenylacetate	149.17	1	PubChem \| InChI \| Smiles	"2021102512391635165541" 25 Oct 2021
\|	5-Methoxyindole	5-Methoxyindole	147.18	1	PubChem \| InChI \| Smiles	"2021092315021632409341" 23 Sep 2021
\|	2-Phenethylamine	2-Phenethylamine	121.18	6	PubChem \| InChI \| Smiles	"2021092816241632846252" 28 Sep 2021
\|	1,4-diammoniumbutane	1,4-diammoniumbutane	90.17	3	PubChem \| InChI \| Smiles	"2021092207501632297009" 22 Sep 2021
\|	Cyclohexaneacetic acid	Cyclohexaneacetic acid	142.20	1	PubChem \| InChI \| Smiles	"2021093016271633019249" 30 Sep 2021
\|	(R)-(-)-alpha-Methoxyphenylacetic acid		166.18	1	PubChem \| InChI \| Smiles	"2021093016141633018484" 30 Sep 2021
\|	Cyclobutanol	Cyclobutanol	72.11	2	PubChem \| InChI \| Smiles	"2021092915211632928892" 29 Sep 2021
\|	QACx4-12C	QACx4-12C	2042.92	6	PubChem \| InChI \| Smiles	"2021031203221615519327" 12 Mar 2021
\|	1,1'-(3-(methoxycarbonyl)pentane-1,5-diyl)bis(pyridin-1-ium)		286.37	1	PubChem \| InChI \| Smiles	"2021102607421635234167" 26 Oct 2021
\|	1,8-Diaminooctane	1,8-Diaminooctane	144.26	2	PubChem \| InChI \| Smiles	"2021102512251635164735" 25 Oct 2021
\|	(2R,5S,6S)-3,3-dimethyl-7-oxo-6-(2-phenylacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate		356.37	2	PubChem \| InChI \| Smiles	"2023080714191691417960" 07 Aug 2023
\|	1,3-Dimethylimidazolium	1,3-Dimethylimidazolium	97.14	6	PubChem \| InChI \| Smiles	"2021100814291633703343" 08 Oct 2021
\|	4-methoxyphenylacetate	4-methoxyphenylacetate	165.17	1	PubChem \| InChI \| Smiles	"2021102213391634909992" 22 Oct 2021
\|	N-Methyl codeine	N-Methyl codeine	314.18	1	PubChem \| InChI \| Smiles	"2022063014121656598324" 30 Jun 2022
\|	Trimethoxyflavylium ion	Trimethoxyflavylium ion	297.33	2	PubChem \| InChI \| Smiles	"2020103019311604086312" 30 Oct 2020
\|	LiTPFPB	LiTPFPB	760.10	1	PubChem \| InChI \| Smiles	"2022062308281655972916" 23 Jun 2022
\|	7-Methoxy-4-methylflavylium cation	7-Methoxy-4-methylflavylium cation	251.30	2	PubChem \| InChI \| Smiles	"2020103019331604086387" 30 Oct 2020
\|	Gly-L-Ala	Gly-L-Ala	146.14	4	PubChem \| InChI \| Smiles	"2020102521431603662224" 25 Oct 2020
\|	4-aminodiamantane	4-aminodiamantane	203.32	5	PubChem \| InChI \| Smiles	"2020102210001603360855" 22 Oct 2020
\|	DL-3-Phenyllactic acid	DL-3-Phenyllactic acid	166.17	2	PubChem \| InChI \| Smiles	"2023072712061690459616" 27 Jul 2023
\|	Formate	Formate	45.02	1	PubChem \| InChI \| Smiles	"2021093008271632990440" 30 Sep 2021
\|	(S)-10-Camphorsulfonic acid	(S)-10-Camphorsulfonic acid	232.29	1	PubChem \| InChI \| Smiles	"2021102420291635107374" 24 Oct 2021
\|	Brilliant cresyl blue	Brilliant cresyl blue	334.85	4	PubChem \| InChI \| Smiles	"2020102213501603374644" 22 Oct 2020
\|	Sodium fluoborate	Sodium fluoborate	109.80	3	PubChem \| InChI \| Smiles	"2021101215451634053507" 12 Oct 2021
\|	Borneol	Borneol	154.25	1	PubChem \| InChI \| Smiles	"2021092909401632908436" 29 Sep 2021
\|	trans-dimethyloxirane	trans-dimethyloxirane	72.11	2	PubChem \| InChI \| Smiles	"2021101209401634031637" 12 Oct 2021
\|	N-(3-methoxybenzyl)-1-(3-methoxyphenyl)-N,N-dimethylmethanaminium		286.39	1	PubChem \| InChI \| Smiles	"2023030815541678290842" 08 Mar 2023
\|	KAA	KAA	288.34	6	PubChem \| InChI \| Smiles	"2020101612191602850747" 16 Oct 2020
\|	N,N-dimethyl-N-(4-nitrobenzyl)-1-(4-nitrophenyl)methanaminium		316.33	2	PubChem \| InChI \| Smiles	"2023030614151678112106" 06 Mar 2023
\|	Ammonium chloride	Ammonium chloride	53.49	2	PubChem \| InChI \| Smiles	"2021093013491633009796" 30 Sep 2021
\|	2-hydroxyethylamide-BU	2-hydroxyethylamide-BU	2811.28	3	PubChem \| InChI \| Smiles	"2020082215571598111824" 22 Aug 2020
\|	O-acetyl mandelic acid	O-acetyl mandelic acid	194.18	2	PubChem \| InChI \| Smiles	"2023072709581690451920" 27 Jul 2023
\|	Methyl phenyl pyridinium	Methyl phenyl pyridinium	170.23	1	PubChem \| InChI \| Smiles	"2024042914381714401505" 29 Apr 2024
\|	N-(4-chlorobenzyl)-1-(4-chlorophenyl)-N,N-dimethylmethanaminium		295.23	2	PubChem \| InChI \| Smiles	"2023030614181678112303" 06 Mar 2023
\|	cadaverine dihydrochloride	cadaverine dihydrochloride	175.10	6	PubChem \| InChI \| Smiles	"2021102509461635155215" 25 Oct 2021
\|	tert-Butanol	tert-Butanol	74.12	1	PubChem \| InChI \| Smiles	"2021092907101632899428" 29 Sep 2021
\|	(1S,2S)-trans-1,2-Cyclohexanediol	(1S,2S)-trans-1,2-Cyclohexanediol	116.16	1	PubChem \| InChI \| Smiles	"2021093016201633018816" 30 Sep 2021
\|	Calcium chloride	Calcium chloride	110.98	6	PubChem \| InChI \| Smiles	"2020101610211602843706" 16 Oct 2020
\|	N,N-dimethyl-N-(4-(methylthio)benzyl)-1-(4-(methylthio)phenyl)methanaminium		318.52	2	PubChem \| InChI \| Smiles	"2023030616291678120199" 06 Mar 2023
\|	Sodium (E)-4-(4-(3-(4-(diethylamino)phenyl)acryloyl)phenoxy)butane-1-sulfonate		453.53	3	PubChem \| InChI \| Smiles	"2020102618361603737391" 26 Oct 2020
\|	Spermidine trihydrochloride	Spermidine trihydrochloride	254.60	2	PubChem \| InChI \| Smiles	"2024030612411709728891" 06 Mar 2024
\|	N,N'-(1,4-phenyle...	N,N'-(1,4-phenyle...	220.35	1	PubChem \| InChI \| Smiles	"2024030613051709730330" 06 Mar 2024
\|	Tetramethylammonium bromide	Tetramethylammonium bromide	154.05	8	PubChem \| InChI \| Smiles	"2022062412291656073791" 24 Jun 2022
\|	Pb2+	Pb2+	207.00	6	PubChem \| InChI \| Smiles	"2021110416071636042066" 04 Nov 2021
\|	N-benzyl-N,N-dimethylhexan-1-aminium	N-benzyl-N,N-dimethylhexan-1-aminium	220.37	1	PubChem \| InChI \| Smiles	"2024043013571714485460" 30 Apr 2024
\|	3-Chlorophenol	3-Chlorophenol	128.56	2	PubChem \| InChI \| Smiles	"2021093012581633006685" 30 Sep 2021
\|	D-alanine	D-alanine	89.09	1	PubChem \| InChI \| Smiles	"2022020720551644267315" 07 Feb 2022
\|	norfloxacin	norfloxacin	319.33	1	PubChem \| InChI \| Smiles	"2021101908151634631351" 19 Oct 2021
\|	P5A-(C3H6SO3)	P5A-(C3H6SO3)	2051.81	8	PubChem \| InChI \| Smiles	"2020093015371601480239" 30 Sep 2020
\|	sCx4-PhCH2NH2	sCx4-PhCH2NH2	766.00	2	PubChem \| InChI \| Smiles	"2020100115191601565566" 01 Oct 2020
\|	Hexyltrimethylammonium bromide	Hexyltrimethylammonium bromide	224.18	2	PubChem \| InChI \| Smiles	"2021093013011633006865" 30 Sep 2021
\|	(S)-α-Methoxyphenylacetate	(S)-α-Methoxyphenylacetate	165.17	4	PubChem \| InChI \| Smiles	"2020102211211603365705" 22 Oct 2020
\|	viologene-Ferrocenyl-dibromide	viologene-Ferrocenyl-dibromide	602.40	3	PubChem \| InChI \| Smiles	"2024030410511709549478" 04 Mar 2024
\|	lysophosphatidic acid	lysophosphatidic acid	482.50	1	PubChem \| InChI \| Smiles	"2022062413321656077542" 24 Jun 2022
\|	HBV4+	HBV4+	426.60	1	PubChem \| InChI \| Smiles	"2020121914171608387439" 19 Dec 2020
\|	Geraniol	Geraniol	154.25	1	PubChem \| InChI \| Smiles	"2021093013421633009320" 30 Sep 2021
\|	Pyrrole-2-carboxylate	Pyrrole-2-carboxylate	110.09	1	PubChem \| InChI \| Smiles	"2021101908061634630798" 19 Oct 2021
\|	1-[5-(ethylcarbamoyl)-1H-pyrrole-2-ylcarbonyl]guanidinium		224.24	1	PubChem \| InChI \| Smiles	"2021102613061635253579" 26 Oct 2021
\|	4-[2-[4-(dimethylamino)phenyl]ethenyl]-1-[2-(4-aminophenoxy)ethyl] pyridinium bromide		360.47	2	PubChem \| InChI \| Smiles	"2023100911461696851997" 09 Oct 2023
\|	(R)-α-Methoxyphenylacetate	(R)-α-Methoxyphenylacetate	165.17	4	PubChem \| InChI \| Smiles	"2020102211221603365779" 22 Oct 2020
\|	1-[5-(methoxycarbonyl)-1H-pyrrole-2-ylcarbonyl]guanidinium		211.20	1	PubChem \| InChI \| Smiles	"2021102613481635256127" 26 Oct 2021
\|	acetylphenylalaninate	acetylphenylalaninate	206.22	1	PubChem \| InChI \| Smiles	"2022111810441668768248" 18 Nov 2022
\|	1-pentyl-1,4-diazabicyclo[2.2.2]octan-1-ium		183.31	1	PubChem \| InChI \| Smiles	"2023042612311682512310" 26 Apr 2023
\|	1Pyr-5kPEGOMe	1Pyr-5kPEGOMe	5253.24	3	PubChem \| InChI \| Smiles	"2022070114511656687095" 01 Jul 2022
\|	PDI-bis(Bu-Me2N-EtOH).2Br	PDI-bis(Bu-Me2N-EtOH).2Br	838.62	1	PubChem \| InChI \| Smiles	"2022062910561656500163" 29 Jun 2022
\|	2AHF	2AHF	197.23	1	PubChem \| InChI \| Smiles	"2022062412321656073952" 24 Jun 2022
\|	sCx4-PhCO2H	sCx4-PhCO2H	781.00	2	PubChem \| InChI \| Smiles	"2020100115181601565492" 01 Oct 2020
\|	Sodium dichloroacetate	Sodium dichloroacetate	150.92	2	PubChem \| InChI \| Smiles	"2021101209411634031676" 12 Oct 2021
\|	Cholesterol	Cholesterol	386.66	4	PubChem \| InChI \| Smiles	"2020102717311603819909" 27 Oct 2020
\|	Melphalan	Melphalan	305.20	1	PubChem \| InChI \| Smiles	"2021093014151633011335" 30 Sep 2021
\|	1-[5-(carbamoylmethylcarbamoyl)-1h-pyrrole-2-ylcarbonyl]guanidinium		253.24	1	PubChem \| InChI \| Smiles	"2021101907571634630264" 19 Oct 2021
\|	Ag+	Ag+	107.87	2	PubChem \| InChI \| Smiles	"2021110416061636042015" 04 Nov 2021
\|	1,6-Dihydroxynaphthalene	1,6-Dihydroxynaphthalene	160.17	2	PubChem \| InChI \| Smiles	"2021093013161633007772" 30 Sep 2021
\|	Sodium trichloroacetate	Sodium trichloroacetate	185.36	3	PubChem \| InChI \| Smiles	"2021101215231634052193" 12 Oct 2021
\|	Dodecane-trimethylamine	Dodecane-trimethylamine	228.44	2	PubChem \| InChI \| Smiles	"2021092210371632307057" 22 Sep 2021
\|	N-Methylquinuclidinium iodide	N-Methylquinuclidinium iodide	253.12	2	PubChem \| InChI \| Smiles	"2020103017441604079884" 30 Oct 2020
\|	4-Ethylbenzoic acid	4-Ethylbenzoic acid	150.17	1	PubChem \| InChI \| Smiles	"2021100116161633105006" 01 Oct 2021
\|	Tetramethylhexane-1,6-diaminium chloride		245.23	6	PubChem \| InChI \| Smiles	"2020101612521602852765" 16 Oct 2020
\|	DMAE-PDI dication	DMAE-PDI dication	534.61	1	PubChem \| InChI \| Smiles	"2021090716081631030904" 07 Sep 2021
\|	Cesium nitrate	Cesium nitrate	194.91	1	PubChem \| InChI \| Smiles	"2021101216221634055748" 12 Oct 2021
\|	Ac-D-Phe anion	Ac-D-Phe anion	206.22	4	PubChem \| InChI \| Smiles	"2021090913291631194199" 09 Sep 2021
\|	Gadolinium ion	Gadolinium ion	157.20	1	PubChem \| InChI \| Smiles	"2021102812041635422697" 28 Oct 2021
\|	Perylene	Perylene	252.30	2	PubChem \| InChI \| Smiles	"2021102514161635171412" 25 Oct 2021
\|	octopamine	octopamine	153.18	2	PubChem \| InChI \| Smiles	"2022111815441668786240" 18 Nov 2022
\|	Trifluoroacetic acid	Trifluoroacetic acid	114.02	1	PubChem \| InChI \| Smiles	"2021100814591633705181" 08 Oct 2021
\|	zoledronate	zoledronate	268.06	1	PubChem \| InChI \| Smiles	"2021102613441635255875" 26 Oct 2021
\|	(+)-fenchone	(+)-fenchone	152.23	4	PubChem \| InChI \| Smiles	"2022101711321666006324" 17 Oct 2022
\|	4-METHYL-2-PENTANOL	4-METHYL-2-PENTANOL	102.17	2	PubChem \| InChI \| Smiles	"2024080809121723108376" 08 Aug 2024
\|	NO3-	NO3-	62.00	17	PubChem \| InChI \| Smiles	"2021092207411632296465" 22 Sep 2021
\|	2-Chloropyridine	2-Chloropyridine	113.54	2	PubChem \| InChI \| Smiles	"2021100116261633105595" 01 Oct 2021
\|	10-Carboxydecyl 3,4,5-tris-dodecyloxybenzoate		859.37	2	PubChem \| InChI \| Smiles	"2020103119321604172761" 31 Oct 2020
\|	KLVFF	KLVFF	652.82	3	PubChem \| InChI \| Smiles	"2020102910581603969104" 29 Oct 2020
\|	Trans-2-methylcyclohexanol	Trans-2-methylcyclohexanol	114.19	1	PubChem \| InChI \| Smiles	"2021102213291634909342" 22 Oct 2021
\|	Spironolactone	Spironolactone	416.58	1	PubChem \| InChI \| Smiles	"2021092210161632305793" 22 Sep 2021
\|	(R)-3-hydroxy-1,1-dimethylpyrrolidin-1-ium		116.18	1	PubChem \| InChI \| Smiles	"2023011610371673865420" 16 Jan 2023
\|	EY	EY	647.89	1	PubChem \| InChI \| Smiles	"2022072007581658303904" 20 Jul 2022
\|	1-tetramethylammonium Ferrocene	1-tetramethylammonium Ferrocene	288.23	1	PubChem \| InChI \| Smiles	"2023011610341673865258" 16 Jan 2023
\|	Cadaverine	Cadaverine	102.18	14	PubChem \| InChI \| Smiles	"2021102415151635088518" 24 Oct 2021
\|	1,4-Diaminobutane	1,4-Diaminobutane	88.15	2	PubChem \| InChI \| Smiles	"2021100116121633104769" 01 Oct 2021
\|	2-(3-cyano-5,5-diethyl-4-(prop-1-en-1-yl)furan-2(5H)-ylidene)malononitrile		0.00	1	PubChem \| InChI \| Smiles	"2022112110031669025016" 21 Nov 2022
\|	H+Pyridine-bisurea-receptorTFA	H+Pyridine-bisurea-receptorTFA	833.89	1	PubChem \| InChI \| Smiles	"2022062800401656376853" 28 Jun 2022
\|	GGVKKPHY	GGVKKPHY	887.06	1	PubChem \| InChI \| Smiles	"2022062412491656074949" 24 Jun 2022
\|	Acetonitrile	Acetonitrile	41.05	5	PubChem \| InChI \| Smiles	"2021092816251632846326" 28 Sep 2021
\|	1,1'-bis(4-methoxyphenyl)-[4,4'-bipyridine]-1,1'-diium		370.45	3	PubChem \| InChI \| Smiles	"2022062313141655990043" 23 Jun 2022
\|	Histidinol	Histidinol	141.17	2	PubChem \| InChI \| Smiles	"2021100116111633104690" 01 Oct 2021
\|	D/L-Adrenaline	D/L-Adrenaline	183.20	12	PubChem \| InChI \| Smiles	"2020100520381601930283" 05 Oct 2020
\|	2,7-bis(2-(trimethyl-azaneyl)ethyl)pyrene-1,3,6,8(2H,7H)-tetraone		436.55	3	PubChem \| InChI \| Smiles	"2020102618481603738083" 26 Oct 2020
\|	daunorubicin	daunorubicin	527.50	1	PubChem \| InChI \| Smiles	"2021092915491632930559" 29 Sep 2021
\|	o-(Me)2-1.1.1	o-(Me)2-1.1.1	366.41	7	PubChem \| InChI \| Smiles	"2020101210451602499530" 12 Oct 2020
\|	Methylammonium	Methylammonium	32.06	5	PubChem \| InChI \| Smiles	"2021100116221633105330" 01 Oct 2021
\|	o-(Me)2-2.2.2	o-(Me)2-2.2.2	498.56	7	PubChem \| InChI \| Smiles	"2020101210491602499793" 12 Oct 2020
\|	3-Methoxyphenylacetate	3-Methoxyphenylacetate	165.17	1	PubChem \| InChI \| Smiles	"2021102213351634909725" 22 Oct 2021
\|	L-Arg	L-Arg	174.20	20	PubChem \| InChI \| Smiles	"2021092820401632861656" 28 Sep 2021
\|	Idarubicin	Idarubicin	497.50	1	PubChem \| InChI \| Smiles	"2021092915401632930054" 29 Sep 2021
\|	L-alanyl-L-tyrosyl-L-leucine	L-alanyl-L-tyrosyl-L-leucine	365.42	1	PubChem \| InChI \| Smiles	"2022062313211655990487" 23 Jun 2022
\|	Cyclooctanol	Cyclooctanol	128.21	2	PubChem \| InChI \| Smiles	"2021101109281633944529" 11 Oct 2021
\|	naproxen	naproxen	230.26	1	PubChem \| InChI \| Smiles	"2022070507391657006742" 05 Jul 2022
\|	L-Ornithine	L-Ornithine	132.16	2	PubChem \| InChI \| Smiles	"2020103016501604076611" 30 Oct 2020
\|	acetylalaninate	acetylalaninate	130.12	1	PubChem \| InChI \| Smiles	"2023041813171681823861" 18 Apr 2023
\|	Thr-Gly-Ala-Phe-Met-NH2	Thr-Gly-Ala-Phe-Met-NH2	524.63	1	PubChem \| InChI \| Smiles	"2022062411151656069359" 24 Jun 2022
\|	Adenosine triphosphate	Adenosine triphosphate	507.18	1	PubChem \| InChI \| Smiles	"2022062413311656077504" 24 Jun 2022
\|	Zeolite Y2.55	Zeolite Y2.55	0.00	5	PubChem \| InChI \| Smiles	"2022032312561648040186" 23 Mar 2022
\|	GGVK(me3)KPHY	GGVK(me3)KPHY	929.14	1	PubChem \| InChI \| Smiles	"2022062407161656054999" 24 Jun 2022
\|	N-benzyl-N,N-diethylethanaminium	N-benzyl-N,N-diethylethanaminium	192.32	3	PubChem \| InChI \| Smiles	"2024043011391714477143" 30 Apr 2024
\|	docetaxel	docetaxel	807.90	1	PubChem \| InChI \| Smiles	"2021102612111635250285" 26 Oct 2021
\|	1,12-Diaminododecane	1,12-Diaminododecane	200.36	1	PubChem \| InChI \| Smiles	"2021102510121635156756" 25 Oct 2021
\|	Ytterbium nitrate	Ytterbium nitrate	359.06	1	PubChem \| InChI \| Smiles	"2021101216211634055716" 12 Oct 2021
\|	sodium 1-octanesulfonate	sodium 1-octanesulfonate	216.28	2	PubChem \| InChI \| Smiles	"2024081508061723709186" 15 Aug 2024
\|	Drospirenone	Drospirenone	366.50	1	PubChem \| InChI \| Smiles	"2021093013221633008133" 30 Sep 2021
\|	1-[5-(Carbamoylmethyl-isopropyl-carbamoyl)-1H-pyrrole-2-ylcarbonyl]guanidinium		296.30	9	PubChem \| InChI \| Smiles	"2020100717081602090521" 07 Oct 2020
\|	Ferric ion	Ferric ion	55.84	5	PubChem \| InChI \| Smiles	"2022111715381668699508" 17 Nov 2022
\|	2-Acetamidopropanoate	2-Acetamidopropanoate	130.12	8	PubChem \| InChI \| Smiles	"2020101120301602448244" 11 Oct 2020
\|	Acetate	Acetate	59.04	13	PubChem \| InChI \| Smiles	"2021092208241632299050" 22 Sep 2021
\|	Tl+	Tl+	204.38	1	PubChem \| InChI \| Smiles	"2021110416071636042075" 04 Nov 2021
\|	Tb3+	Tb3+	158.93	1	PubChem \| InChI \| Smiles	"2021110416071636042055" 04 Nov 2021
\|	Heroin	Heroin	369.40	1	PubChem \| InChI \| Smiles	"2021101116091633968567" 11 Oct 2021
\|	Cyclooctane	Cyclooctane	112.21	1	PubChem \| InChI \| Smiles	"2021101209411634031701" 12 Oct 2021
\|	sP6A	sP6A	1959.00	24	PubChem \| InChI \| Smiles	"2022062108231655799825" 21 Jun 2022
\|	L-tyrosyl-L-tyrosyl-L-alanine	L-tyrosyl-L-tyrosyl-L-alanine	415.44	1	PubChem \| InChI \| Smiles	"2022062308501655974225" 23 Jun 2022
\|	3,9-Dihydroxytriamantane	3,9-Dihydroxytriamantane	272.38	7	PubChem \| InChI \| Smiles	"2022032317451648057559" 23 Mar 2022
\|	trans-4-methylcyclohexyl(trimethyl)ammonium		156.29	2	PubChem \| InChI \| Smiles	"2020102616451603730703" 26 Oct 2020
\|	1,1'-bis(4-fluorophenyl)-[4,4'-bipyridine]-1,1'-diium		346.38	2	PubChem \| InChI \| Smiles	"2020110915511604937101" 09 Nov 2020
\|	Dibutyl Bipyridinium	Dibutyl Bipyridinium	270.41	1	PubChem \| InChI \| Smiles	"2024042914421714401743" 29 Apr 2024
\|	gly-l-asn	gly-l-asn	189.17	2	PubChem \| InChI \| Smiles	"2023102407321698132720" 24 Oct 2023
\|	1,1'-bis(4-chlorophenyl)-[4,4'-bipyridine]-1,1'-diium		379.28	2	PubChem \| InChI \| Smiles	"2020110916081604938131" 09 Nov 2020
\|	putrescine (fully protonated form)	putrescine (fully protonated form)	90.17	8	PubChem \| InChI \| Smiles	"2020101211031602500623" 12 Oct 2020
\|	Cupric chloride	Cupric chloride	134.45	4	PubChem \| InChI \| Smiles	"2021092815581632844704" 28 Sep 2021
\|	crystal violet	crystal violet	407.98	1	PubChem \| InChI \| Smiles	"2022072008141658304889" 20 Jul 2022
\|	Leu-Met-Gly-Gly-Tyr	Leu-Met-Gly-Gly-Tyr	539.64	1	PubChem \| InChI \| Smiles	"2022062308511655974318" 23 Jun 2022
\|	Iron(III) nitrate nonahydrate	Iron(III) nitrate nonahydrate	404.00	1	PubChem \| InChI \| Smiles	"2021101209381634031500" 12 Oct 2021
\|	Methylpyridinium cation	Methylpyridinium cation	94.13	1	PubChem \| InChI \| Smiles	"2023011610031673863436" 16 Jan 2023
\|	N,N-dimethyl-1-(naphthalen-1-yl)-N-(naphthalen-1-ylmethyl)methanaminium		326.45	1	PubChem \| InChI \| Smiles	"2023030816531678294430" 08 Mar 2023
\|	7-Dehydrocholesterol	7-Dehydrocholesterol	384.65	1	PubChem \| InChI \| Smiles	"2021092816161632845781" 28 Sep 2021
\|	1,2,3-benzotriazole	1,2,3-benzotriazole	0.00	2	PubChem \| InChI \| Smiles	"2023111613201700140812" 16 Nov 2023
\|	bis(Trimethylamminomethyl)ferrocene	bis(Trimethylamminomethyl)ferrocene	330.30	3	PubChem \| InChI \| Smiles	"2021112411091637752145" 24 Nov 2021
\|	N,N'-(1,4-phenylenebis(methylene))bis(prop-2-yn-1-aminium) chloride		285.21	1	PubChem \| InChI \| Smiles	"2024031412511710420678" 14 Mar 2024
\|	cyclohexane-1,4-diaminium chloride	cyclohexane-1,4-diaminium chloride	187.11	4	PubChem \| InChI \| Smiles	"2020102616511603731074" 26 Oct 2020
\|	TMAX-Cl	TMAX-Cl	1079.07	15	PubChem \| InChI \| Smiles	"2022042219171650655024" 22 Apr 2022
\|	cRGDfV	cRGDfV	574.60	1	PubChem \| InChI \| Smiles	"2021101214531634050439" 12 Oct 2021
\|	Erythrosin B	Erythrosin B	879.86	2	PubChem \| InChI \| Smiles	"2020110915401604936408" 09 Nov 2020
\|	Procainamide	Procainamide	235.33	2	PubChem \| InChI \| Smiles	"2021100116081633104537" 01 Oct 2021
\|	GEMCITABINE HYDROCHLORIDE	GEMCITABINE HYDROCHLORIDE	299.66	17	PubChem \| InChI \| Smiles	"2024031414341710426845" 14 Mar 2024
\|	Cadmium ion	Cadmium ion	112.41	1	PubChem \| InChI \| Smiles	"2022030214241646231094" 02 Mar 2022
\|	Hyperoside	Hyperoside	464.40	2	PubChem \| InChI \| Smiles	"2024032616101711469411" 26 Mar 2024
\|	Estradiol benzoate	Estradiol benzoate	376.50	1	PubChem \| InChI \| Smiles	"2021092210101632305449" 22 Sep 2021
\|	periodate ion	periodate ion	190.90	1	PubChem \| InChI \| Smiles	"2021082614521629989556" 26 Aug 2021
\|	p-Xylylendiamine 2+	p-Xylylendiamine 2+	138.21	3	PubChem \| InChI \| Smiles	"2021102510011635156092" 25 Oct 2021
\|	(E)-4,4'-(ethene-1,2-diyl)bis(1-butylpyridin-1-ium)		296.45	1	PubChem \| InChI \| Smiles	"2024042914451714401942" 29 Apr 2024
\|	Cyclohexane	Cyclohexane	84.16	4	PubChem \| InChI \| Smiles	"2021092907121632899552" 29 Sep 2021
\|	L-Phe-Gly	L-Phe-Gly	222.24	3	PubChem \| InChI \| Smiles	"2020102521481603662504" 25 Oct 2020
\|	F-	F-	19.00	13	PubChem \| InChI \| Smiles	"2021110416101636042204" 04 Nov 2021
\|	N-Boc-L-serine	N-Boc-L-serine	205.21	1	PubChem \| InChI \| Smiles	"2021093015321633015927" 30 Sep 2021
\|	1,4-phenylenedimethanaminium chloride	1,4-phenylenedimethanaminium chloride	209.12	8	PubChem \| InChI \| Smiles	"2020101211271602502045" 12 Oct 2020
\|	Lidocaine	Lidocaine	234.34	2	PubChem \| InChI \| Smiles	"2021101209401634031603" 12 Oct 2021
\|	Estriol	Estriol	288.39	1	PubChem \| InChI \| Smiles	"2021092314571632409078" 23 Sep 2021
\|	Ni 2+	Ni 2+	58.69	2	PubChem \| InChI \| Smiles	"2021101116121633968743" 11 Oct 2021
\|	N-methyl pyridinium	N-methyl pyridinium	94.13	3	PubChem \| InChI \| Smiles	"2020102612141603714482" 26 Oct 2020
\|	Heptane	Heptane	100.20	2	PubChem \| InChI \| Smiles	"2021101113041633957446" 11 Oct 2021
\|	DiCh	DiCh	346.51	1	PubChem \| InChI \| Smiles	"2022072612231658838197" 26 Jul 2022
\|	(S)-3-Bromo-2-methyl-propionic acid methyl ester		181.03	1	PubChem \| InChI \| Smiles	"2021093015021633014128" 30 Sep 2021
\|	N-Boc-D-Ala	N-Boc-D-Ala	189.21	1	PubChem \| InChI \| Smiles	"2021100716401633624831" 07 Oct 2021
\|	(R)-2-Phenylpropanoic acid	(R)-2-Phenylpropanoic acid	150.18	1	PubChem \| InChI \| Smiles	"2021102420371635107840" 24 Oct 2021
\|	SF6	SF6	146.06	1	PubChem \| InChI \| Smiles	"2021010411331609759985" 04 Jan 2021
\|	Ethylammonium	Ethylammonium	46.09	1	PubChem \| InChI \| Smiles	"2021100814581633705129" 08 Oct 2021
\|	1,1'-bis(3-aminopropyl)-4,4'-bipyridinium		272.39	2	PubChem \| InChI \| Smiles	"2020102820161603916163" 28 Oct 2020
\|	(1S)-(-)-Camphanic acid	(1S)-(-)-Camphanic acid	198.22	1	PubChem \| InChI \| Smiles	"2021102420401635108017" 24 Oct 2021
\|	N,N'-dimethyl-1,4-diazabicyclo[2.2.2]octane		142.24	3	PubChem \| InChI \| Smiles	"2020102620421603744952" 26 Oct 2020
\|	N-Cbz-D-alanine	N-Cbz-D-alanine	223.23	1	PubChem \| InChI \| Smiles	"2021093016131633018429" 30 Sep 2021
\|	CHZ	CHZ	169.56	2	PubChem \| InChI \| Smiles	"2024080812291723120185" 08 Aug 2024
\|	Glycoluril dimer clip	Glycoluril dimer clip	512.52	1	PubChem \| InChI \| Smiles	"2020102320381603485534" 23 Oct 2020
\|	4-Phenylbutylamine	4-Phenylbutylamine	149.24	1	PubChem \| InChI \| Smiles	"2021102420201635106827" 24 Oct 2021
\|	somatostatin	somatostatin	1637.90	1	PubChem \| InChI \| Smiles	"2021093011521633002731" 30 Sep 2021
\|	chlorambucil	chlorambucil	304.20	1	PubChem \| InChI \| Smiles	"2021101109311633944694" 11 Oct 2021
\|	DX	DX	302.36	2	PubChem \| InChI \| Smiles	"2022032316331648053180" 23 Mar 2022
\|	4-((4-(benzo[d]thiazol-2-yl)piperazin-1-yl)methyl)-7-methoxy-2H-chromen-2-one		407.49	1	PubChem \| InChI \| Smiles	"2022062411251656069941" 24 Jun 2022
\|	GAFKAGY	GAFKAGY	712.79	1	PubChem \| InChI \| Smiles	"2024022216001708617609" 22 Feb 2024
\|	Pentanoate	Pentanoate	101.12	1	PubChem \| InChI \| Smiles	"2021101215191634051993" 12 Oct 2021
\|	Gly-Trp-Gly	Gly-Trp-Gly	318.33	3	PubChem \| InChI \| Smiles	"2020102521451603662335" 25 Oct 2020
\|	L-phenylalanine amide	L-phenylalanine amide	164.21	1	PubChem \| InChI \| Smiles	"2021093009241632993896" 30 Sep 2021
\|	benzocaine	benzocaine	165.19	1	PubChem \| InChI \| Smiles	"2024042313331713879193" 23 Apr 2024
\|	[C5mim]Br	[C5mim]Br	233.15	1	PubChem \| InChI \| Smiles	"2022062923011656543680" 29 Jun 2022
\|	Sodium sulfide	Sodium sulfide	78.04	2	PubChem \| InChI \| Smiles	"2020102912381603975135" 29 Oct 2020
\|	cis-azobenzene-TEG	cis-azobenzene-TEG	330.38	1	PubChem \| InChI \| Smiles	"2022062908021656489744" 29 Jun 2022
\|	Gly-D-Phe	Gly-D-Phe	222.24	1	PubChem \| InChI \| Smiles	"2021100815031633705401" 08 Oct 2021
\|	triclosan	triclosan	289.50	1	PubChem \| InChI \| Smiles	"2022062808281656404933" 28 Jun 2022
\|	N,N',N''-triallylcyanuric acid	N,N',N''-triallylcyanuric acid	249.27	1	PubChem \| InChI \| Smiles	"2020121810281608287339" 18 Dec 2020
\|	sCx4-NHCO(4-Br)Ph	sCx4-NHCO(4-Br)Ph	859.00	2	PubChem \| InChI \| Smiles	"2020100115051601564730" 01 Oct 2020
\|	Propranolol	Propranolol	259.34	4	PubChem \| InChI \| Smiles	"2020102617001603731611" 26 Oct 2020
\|	3-V2+	3-V2+	3440.19	2	PubChem \| InChI \| Smiles	"2024031116421710175372" 11 Mar 2024
\|	N-Acetyl-D-phenylalanine	N-Acetyl-D-phenylalanine	207.23	1	PubChem \| InChI \| Smiles	"2021093015281633015707" 30 Sep 2021
\|	N-methyl-1-phenylmethanaminium	N-methyl-1-phenylmethanaminium	122.19	3	PubChem \| InChI \| Smiles	"2024043012231714479837" 30 Apr 2024
\|	phenylbutazone	phenylbutazone	308.40	2	PubChem \| InChI \| Smiles	"2021093013171633007857" 30 Sep 2021
\|	warfarin	warfarin	308.30	3	PubChem \| InChI \| Smiles	"2021102612361635251782" 26 Oct 2021
\|	Oxazole	Oxazole	69.06	2	PubChem \| InChI \| Smiles	"2021100116131633104825" 01 Oct 2021
\|	1,4-Phenylenediamine dihydrochloride	1,4-Phenylenediamine dihydrochloride	181.06	5	PubChem \| InChI \| Smiles	"2021102509451635155133" 25 Oct 2021
\|	Cyclohexanol	Cyclohexanol	100.16	1	PubChem \| InChI \| Smiles	"2021093016271633019224" 30 Sep 2021
\|	Heptanoate	Heptanoate	129.18	2	PubChem \| InChI \| Smiles	"2021100815031633705430" 08 Oct 2021
\|	Estradiol	Estradiol	272.39	10	PubChem \| InChI \| Smiles	"2020101119191602443944" 11 Oct 2020
\|	Megestrol acetate	Megestrol acetate	384.52	1	PubChem \| InChI \| Smiles	"2021092816151632845706" 28 Sep 2021
\|	Picric acid	Picric acid	229.10	1	PubChem \| InChI \| Smiles	"2021101209441634031895" 12 Oct 2021
\|	[C8mim]Cl	[C8mim]Cl	230.78	1	PubChem \| InChI \| Smiles	"2022062923011656543718" 29 Jun 2022
\|	1Np-5kPEGOMe	1Np-5kPEGOMe	245.27	3	PubChem \| InChI \| Smiles	"2022070113551656683706" 01 Jul 2022
\|	WGGGQTARK(me3)STGGR	WGGGQTARK(me3)STGGR	1504.67	1	PubChem \| InChI \| Smiles	"2020081213341597239257" 12 Aug 2020
\|	n-Butane	n-Butane	58.12	2	PubChem \| InChI \| Smiles	"2021093010111632996675" 30 Sep 2021
\|	AzobPy	AzobPy	366.46	1	PubChem \| InChI \| Smiles	"2023061415011686754870" 14 Jun 2023
\|	chloramphenicol	chloramphenicol	323.13	1	PubChem \| InChI \| Smiles	"2022070507371657006622" 05 Jul 2022
\|	methionylphenylalanylalanine	methionylphenylalanylalanine	367.50	1	PubChem \| InChI \| Smiles	"2023102416151698164126" 24 Oct 2023
\|	Cx4R-C11	Cx4R-C11	1105.68	2	PubChem \| InChI \| Smiles	"2020100115091601564998" 01 Oct 2020
\|	octan-2-aminium	octan-2-aminium	130.25	1	PubChem \| InChI \| Smiles	"2020110420551604523300" 04 Nov 2020
\|	3-Ethoxypropylamine	3-Ethoxypropylamine	103.16	1	PubChem \| InChI \| Smiles	"2021100515581633449480" 05 Oct 2021
\|	1,4-Dimethoxybenzene	1,4-Dimethoxybenzene	138.16	1	PubChem \| InChI \| Smiles	"2023112216111700669492" 22 Nov 2023
\|	p-xylylenediamine dihydrochloride	p-xylylenediamine dihydrochloride	209.12	2	PubChem \| InChI \| Smiles	"2021102510111635156681" 25 Oct 2021
\|	3,5-Dimethyladamantan-1-aminium	3,5-Dimethyladamantan-1-aminium	180.31	1	PubChem \| InChI \| Smiles	"2020111014291605018579" 10 Nov 2020
\|	Tetramethylphosphonium	Tetramethylphosphonium	218.02	2	PubChem \| InChI \| Smiles	"2023030809221678267347" 08 Mar 2023
\|	water	water	18.02	3	PubChem \| InChI \| Smiles	"2021102409391635068341" 24 Oct 2021
\|	2,6-diammoniumhexanoate	2,6-diammoniumhexanoate	147.20	1	PubChem \| InChI \| Smiles	"2021102715141635347666" 27 Oct 2021
\|	(R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid		234.17	1	PubChem \| InChI \| Smiles	"2021093016151633018518" 30 Sep 2021
\|	Met-Tyr-Gly-Gly-Tyr	Met-Tyr-Gly-Gly-Tyr	589.66	1	PubChem \| InChI \| Smiles	"2022062412181656073110" 24 Jun 2022
\|	MV.+	MV.+	186.25	4	PubChem \| InChI \| Smiles	"2024032712091711541366" 27 Mar 2024
\|	Hg2(2+)	Hg2(2+)	401.18	1	PubChem \| InChI \| Smiles	"2020121816031608307383" 18 Dec 2020
\|	PARAQUAT	PARAQUAT	186.25	3	PubChem \| InChI \| Smiles	"2021102512221635164526" 25 Oct 2021
\|	N-Methylisoquinolinium	N-Methylisoquinolinium	144.19	3	PubChem \| InChI \| Smiles	"2022062413111656076313" 24 Jun 2022
\|	N-(furanylmethyl)propanamine	N-(furanylmethyl)propanamine	139.20	2	PubChem \| InChI \| Smiles	"2022062411351656070527" 24 Jun 2022
\|	6-bromo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole		216.08	2	PubChem \| InChI \| Smiles	"2022062411291656070186" 24 Jun 2022
\|	Ethinyl-estradiol	Ethinyl-estradiol	296.41	1	PubChem \| InChI \| Smiles	"2021102613111635253914" 26 Oct 2021
\|	dicyclomine	dicyclomine	309.50	2	PubChem \| InChI \| Smiles	"2021102612361635251760" 26 Oct 2021
\|	Prednisolone	Prednisolone	360.45	5	PubChem \| InChI \| Smiles	"2020102717351603820104" 27 Oct 2020
\|	PMA	PMA	232.30	1	PubChem \| InChI \| Smiles	"2022063008321656577975" 30 Jun 2022
\|	Penicillin G	Penicillin G	334.40	1	PubChem \| InChI \| Smiles	"2021092815061632841610" 28 Sep 2021
\|	Lys-met-ala	Lys-met-ala	348.46	1	PubChem \| InChI \| Smiles	"2023102415531698162784" 24 Oct 2023
\|	Potassium iodide	Potassium iodide	166.00	1	PubChem \| InChI \| Smiles	"2021102712461635338813" 27 Oct 2021
\|	N,N-dimethyl-1-(naphthalen-2-yl)-N-(naphthalen-2-ylmethyl)methanaminium		326.45	1	PubChem \| InChI \| Smiles	"2023030816581678294684" 08 Mar 2023
\|	(D)-Phenylglycine	(D)-Phenylglycine	151.16	1	PubChem \| InChI \| Smiles	"2022021413161644844591" 14 Feb 2022
\|	Homogentisic acid	Homogentisic acid	168.15	1	PubChem \| InChI \| Smiles	"2022070507371657006672" 05 Jul 2022
\|	1,12-DODECANEDIAMINE, DIHYDROCHLORIDE	1,12-DODECANEDIAMINE, DIHYDROCHLORIDE	273.28	1	PubChem \| InChI \| Smiles	"2024030610411709721700" 06 Mar 2024
\|	naphthalene	naphthalene	128.17	2	PubChem \| InChI \| Smiles	"2022070507381657006709" 05 Jul 2022
\|	Sugammadex	Sugammadex	2002.12	1	PubChem \| InChI \| Smiles	"2020081213341597239243" 12 Aug 2020
\|	N1,N1'-(bicyclo[2.2.2]octane-1,4-diylbis(methylene))bis(N3,N3-dimethylpropane-1,3-diamine)		338.58	1	PubChem \| InChI \| Smiles	"2021093014161633011413" 30 Sep 2021
\|	[C7mim]Br	[C7mim]Br	261.20	1	PubChem \| InChI \| Smiles	"2022062923051656543907" 29 Jun 2022
\|	N,N-dibenzyl-N-methylethanaminium	N,N-dibenzyl-N-methylethanaminium	240.36	2	PubChem \| InChI \| Smiles	"2023030910441678358684" 09 Mar 2023
\|	N-(2,6-difluorobenzyl)-1-(2,6-difluorophenyl)-N,N-dimethylmethanaminium		298.30	1	PubChem \| InChI \| Smiles	"2023030911031678359791" 09 Mar 2023
\|	Ethylamine	Ethylamine	46.09	2	PubChem \| InChI \| Smiles	"2020102820481603918102" 28 Oct 2020
\|	Cortisol	Cortisol	362.47	1	PubChem \| InChI \| Smiles	"2021092210131632305606" 22 Sep 2021
\|	(R)-(+)-3-Bromoisobutyric acid methyl ester		181.03	1	PubChem \| InChI \| Smiles	"2021093015381633016312" 30 Sep 2021
\|	1,3-Dimethyluracil	1,3-Dimethyluracil	140.14	1	PubChem \| InChI \| Smiles	"2021102115421634830953" 21 Oct 2021
\|	H-Lys-OH	H-Lys-OH	182.65	7	PubChem \| InChI \| Smiles	"2021092909071632906438" 29 Sep 2021
\|	4-Ethoxyphenol	4-Ethoxyphenol	138.17	3	PubChem \| InChI \| Smiles	"2021092816241632846288" 28 Sep 2021
\|	bis(aminoethyl)-1,6-hexane-diammonium	bis(aminoethyl)-1,6-hexane-diammonium	206.38	6	PubChem \| InChI \| Smiles	"2020102820181603916309" 28 Oct 2020
\|	propylamine hydrochloride	propylamine hydrochloride	95.57	2	PubChem \| InChI \| Smiles	"2021102708521635324774" 27 Oct 2021
\|	1,1'-(pentane-1,5-diyl)bis(1,4-diazabicyclo[2.2.2]octan-1-ium)		294.48	1	PubChem \| InChI \| Smiles	"2023042515091682435399" 25 Apr 2023
\|	sodium 1-hexanesulfonate	sodium 1-hexanesulfonate	188.22	1	PubChem \| InChI \| Smiles	"2024081508041723709087" 15 Aug 2024
\|	Sanguinarine	Sanguinarine	332.34	10	PubChem \| InChI \| Smiles	"2020101616081602864532" 16 Oct 2020
\|	(+/-)-2-methylbutanoate	(+/-)-2-methylbutanoate	101.12	1	PubChem \| InChI \| Smiles	"2021102512271635164832" 25 Oct 2021
\|	Proflavine	Proflavine	209.25	2	PubChem \| InChI \| Smiles	"2021092210241632306259" 22 Sep 2021
\|	(S)-2-Phenylbutanoic acid	(S)-2-Phenylbutanoic acid	164.20	1	PubChem \| InChI \| Smiles	"2021093016281633019280" 30 Sep 2021
\|	Tartrate	Tartrate	148.07	1	PubChem \| InChI \| Smiles	"2021102712401635338449" 27 Oct 2021
\|	Bis Paraquat	Bis Paraquat	412.57	3	PubChem \| InChI \| Smiles	"2020102216421603384941" 22 Oct 2020
\|	Pyridine-bisurea-receptor	Pyridine-bisurea-receptor	719.90	1	PubChem \| InChI \| Smiles	"2022062800371656376662" 28 Jun 2022
\|	trans-Merocyanine (protonated)	trans-Merocyanine (protonated)	353.40	3	PubChem \| InChI \| Smiles	"2020102916191603988356" 29 Oct 2020
\|	doxorubicin	doxorubicin	543.50	2	PubChem \| InChI \| Smiles	"2021093009221632993773" 30 Sep 2021
\|	6-heptenoate	6-heptenoate	127.16	1	PubChem \| InChI \| Smiles	"2021102213321634909574" 22 Oct 2021
\|	Trimethylamine N-oxide	Trimethylamine N-oxide	75.11	2	PubChem \| InChI \| Smiles	"2020102913361603978589" 29 Oct 2020
\|	Sodium acetate	Sodium acetate	82.03	1	PubChem \| InChI \| Smiles	"2021102512401635165659" 25 Oct 2021
\|	H-Trp-Lys-Arg-pThr-Leu-Arg-Arg-Leu-OH	H-Trp-Lys-Arg-pThr-Leu-Arg-Arg-Leu-OH	1208.35	2	PubChem \| InChI \| Smiles	"2020103108501604134257" 31 Oct 2020
\|	1,3,5-Trioxane	1,3,5-Trioxane	90.08	2	PubChem \| InChI \| Smiles	"2021101214561634050610" 12 Oct 2021
\|	Bromocycloheptane	Bromocycloheptane	177.08	4	PubChem \| InChI \| Smiles	"2021101209421634031765" 12 Oct 2021
\|	Tropicamide	Tropicamide	284.35	1	PubChem \| InChI \| Smiles	"2021092815161632842202" 28 Sep 2021
\|	Tropicamide (protonated)	Tropicamide (protonated)	285.37	3	PubChem \| InChI \| Smiles	"2020102820441603917862" 28 Oct 2020
\|	cylopenthylmethanaminium	cylopenthylmethanaminium	100.18	1	PubChem \| InChI \| Smiles	"2023062709051687856700" 27 Jun 2023
\|	Tetrapropylammonium bromide	Tetrapropylammonium bromide	266.26	1	PubChem \| InChI \| Smiles	"2021102607401635234033" 26 Oct 2021
\|	Cetrimonium bromide	Cetrimonium bromide	364.40	4	PubChem \| InChI \| Smiles	"2021092820421632861721" 28 Sep 2021
\|	methotrexate	methotrexate	454.40	1	PubChem \| InChI \| Smiles	"2021092907211632900078" 29 Sep 2021
\|	Disodium phenyl phosphate	Disodium phenyl phosphate	218.05	1	PubChem \| InChI \| Smiles	"2021102613051635253548" 26 Oct 2021
\|	N-methyl-N-(4-(2-(1-methylpyridin-4(1H)-ylidene)ethylidene)cyclohexa-2,5-dien-1-ylidene)methanaminium		239.34	1	PubChem \| InChI \| Smiles	"2020122109231608542599" 21 Dec 2020
\|	Tris[2,3-quinoxalinediylbis(oxyethyleneoxyethyleneoxyethyleneoxy)]triphenylene + 2 Dibenzylammonium guests		1892.14	1	PubChem \| InChI \| Smiles	"2020081213331597239235" 12 Aug 2020
\|	3-Bromo-d-camphor	3-Bromo-d-camphor	231.13	3	PubChem \| InChI \| Smiles	"2020102617181603732699" 26 Oct 2020
\|	2,3-Dimethylbutane	2,3-Dimethylbutane	86.18	2	PubChem \| InChI \| Smiles	"2021092910071632910077" 29 Sep 2021
\|	Pyronine b	Pyronine b	358.91	2	PubChem \| InChI \| Smiles	"2020102817371603906673" 28 Oct 2020
\|	Phenylenebis[oxy(3,6-dioxaoctane-1,8-diyl)oxy]]quinoxaline and one benzene-triyltris(oxy))tris(benzenediyl))tris(N-benzylmethanaminium) host		1215.45	1	PubChem \| InChI \| Smiles	"2020081213341597239248" 12 Aug 2020
\|	(S)-3-hydroxy-1,1-dimethylpyrrolidin-1-ium		116.18	1	PubChem \| InChI \| Smiles	"2023011610311673865101" 16 Jan 2023
\|	Imidazole	Imidazole	68.08	2	PubChem \| InChI \| Smiles	"2021101214561634050588" 12 Oct 2021
\|	thiophen-2-ylmethanaminium	thiophen-2-ylmethanaminium	114.19	1	PubChem \| InChI \| Smiles	"2023062709381687858718" 27 Jun 2023
\|	1,1'-(heptane-1,7-diyl)bis(1,4-diazabicyclo[2.2.2]octan-1-ium)		322.53	1	PubChem \| InChI \| Smiles	"2023042612171682511423" 26 Apr 2023
\|	N-methylbutan-1-aminium	N-methylbutan-1-aminium	88.17	1	PubChem \| InChI \| Smiles	"2020081213341597239261" 12 Aug 2020
\|	oxycodone	oxycodone	315.40	1	PubChem \| InChI \| Smiles	"2024081613281723814920" 16 Aug 2024
\|	1,1'-(hexane-1,6-diyl)bis(1,4-diazabicyclo[2.2.2]octan-1-ium)		308.51	1	PubChem \| InChI \| Smiles	"2023042515421682437376" 25 Apr 2023
\|	1,1'-(1,4-phenylene)bis(N-benzylmethanaminium) chloride		389.36	1	PubChem \| InChI \| Smiles	"2024031412371710419879" 14 Mar 2024
\|	1,1'-(tridecane-1,13-diyl)bis(1,4-diazabicyclo[2.2.2]octan-1-ium)		406.69	1	PubChem \| InChI \| Smiles	"2023042613241682515484" 26 Apr 2023
\|	1,1'-bis(10-carbo...	1,1'-bis(10-carbo...	526.75	2	PubChem \| InChI \| Smiles	"2024030411001709550017" 04 Mar 2024
\|	Eucalyptol	Eucalyptol	154.25	3	PubChem \| InChI \| Smiles	"2020102618331603737186" 26 Oct 2020
\|	4-Phenylbutanoate	4-Phenylbutanoate	163.19	1	PubChem \| InChI \| Smiles	"2021102213341634909693" 22 Oct 2021
\|	1,11-Diaminoundecane	1,11-Diaminoundecane	186.34	1	PubChem \| InChI \| Smiles	"2021093013181633007903" 30 Sep 2021
\|	tetraethylammonium hexafluorophosphate(V)		275.22	1	PubChem \| InChI \| Smiles	"2023030616331678120382" 06 Mar 2023
\|	3-phenylbutanoate	3-phenylbutanoate	163.19	1	PubChem \| InChI \| Smiles	"2021102213301634909409" 22 Oct 2021
\|	sCx4-TEG-N3	sCx4-TEG-N3	981.00	1	PubChem \| InChI \| Smiles	"2020100215261601652362" 02 Oct 2020
\|	1-Adamantylammonium	1-Adamantylammonium	152.26	8	PubChem \| InChI \| Smiles	"2020101212531602507218" 12 Oct 2020
\|	hexamethylpentane-1,5-diaminium iodide		442.16	12	PubChem \| InChI \| Smiles	"2020100319551601754950" 03 Oct 2020
\|	1,4-Phenylenediamine	1,4-Phenylenediamine	108.14	3	PubChem \| InChI \| Smiles	"2021092915151632928530" 29 Sep 2021
\|	Brilliant green	Brilliant green	482.60	2	PubChem \| InChI \| Smiles	"2020102817171603905470" 28 Oct 2020
\|	2-Hydroxynaphthalene-polyethylene-glycol		2082.51	2	PubChem \| InChI \| Smiles	"2020110111131604229206" 01 Nov 2020
\|	glycylglycyl-L-tryptophylglycylglycine		432.44	1	PubChem \| InChI \| Smiles	"2022062308371655973426" 23 Jun 2022
\|	Rhodamine B benzyl ester	Rhodamine B benzyl ester	533.69	1	PubChem \| InChI \| Smiles	"2022062413381656077911" 24 Jun 2022
\|	cyclohexane diamine dihydrochloride	cyclohexane diamine dihydrochloride	187.11	2	PubChem \| InChI \| Smiles	"2024031313461710337564" 13 Mar 2024
\|	4-Hydroxy-7-methoxycoumarin	4-Hydroxy-7-methoxycoumarin	192.17	1	PubChem \| InChI \| Smiles	"2021102509441635155094" 25 Oct 2021
\|	1,10-Decanediammonium	1,10-Decanediammonium	174.33	2	PubChem \| InChI \| Smiles	"2020102515381603640292" 25 Oct 2020
\|	acridine orange H+	acridine orange H+	266.36	1	PubChem \| InChI \| Smiles	"2022070809211657272089" 08 Jul 2022
\|	L-carnitine	L-carnitine	161.20	3	PubChem \| InChI \| Smiles	"2021101216311634056305" 12 Oct 2021
\|	asymmetric Acyclic di-(sodium(3-((4-(2-azidoethoxy)naphthalen-1-yl)oxy)propane-1-sulfonate) Cucurbituril		1491.41	1	PubChem \| InChI \| Smiles	"2020101213161602508618" 12 Oct 2020
\|	N-(4-fluorobenzyl)-1-(4-fluorophenyl)-N,N-dimethylmethanaminium		262.32	2	PubChem \| InChI \| Smiles	"2023030616281678120109" 06 Mar 2023
\|	N-(4-bromobenzyl)-1-(4-bromophenyl)-N,N-dimethylmethanaminium		384.13	2	PubChem \| InChI \| Smiles	"2023030614171678112263" 06 Mar 2023
\|	2-Hydroxynaphthalene-triethylene-glycol		276.33	3	PubChem \| InChI \| Smiles	"2020102618511603738263" 26 Oct 2020
\|	D-Fructose	D-Fructose	180.16	1	PubChem \| InChI \| Smiles	"2021101109341633944877" 11 Oct 2021
\|	trans-4-Methylcyclohexane carboxylic acid		142.20	2	PubChem \| InChI \| Smiles	"2020102616461603730807" 26 Oct 2020
\|	[5,10,15,20-tetrakis- (4-sulfonatophenyl)porphinato]zinc(II) (2)		1086.28	2	PubChem \| InChI \| Smiles	"2021093009301632994202" 30 Sep 2021
\|	3-carboxy-1-methylpyridin-1-ium	3-carboxy-1-methylpyridin-1-ium	138.14	1	PubChem \| InChI \| Smiles	"2024042914341714401291" 29 Apr 2024
\|	Geranylamine	Geranylamine	153.27	4	PubChem \| InChI \| Smiles	"2021093013031633007029" 30 Sep 2021
\|	Phenanthrene	Phenanthrene	178.23	1	PubChem \| InChI \| Smiles	"2021100814571633705061" 08 Oct 2021
\|	sodium 3,3'-(1,3,6,8-tetraoxo-1,3,6,8-tetrahydrobenzo[lmn][3,8]phenanthroline-2,7-diyl)dipropionate		454.30	1	PubChem \| InChI \| Smiles	"2022063014091656598170" 30 Jun 2022
\|	2Np-5kPEGOMe	2Np-5kPEGOMe	5179.16	3	PubChem \| InChI \| Smiles	"2022070113551656683746" 01 Jul 2022
\|	[C2mim]Cl	[C2mim]Cl	146.62	1	PubChem \| InChI \| Smiles	"2022062922541656543295" 29 Jun 2022
\|	N-Methylquinolinium iodide	N-Methylquinolinium iodide	271.10	1	PubChem \| InChI \| Smiles	"2022070809191657271985" 08 Jul 2022
\|	6-(dimethylamino)acridin-3(10H)-one	6-(dimethylamino)acridin-3(10H)-one	238.28	1	PubChem \| InChI \| Smiles	"2021092111411632224506" 21 Sep 2021
\|	Cyclopentane	Cyclopentane	70.14	2	PubChem \| InChI \| Smiles	"2021101113101633957801" 11 Oct 2021
\|	sodium 1-butanesulfonate	sodium 1-butanesulfonate	160.17	1	PubChem \| InChI \| Smiles	"2024081508121723709570" 15 Aug 2024
\|	sCx6-C5	sCx6-C5	1531.85	1	PubChem \| InChI \| Smiles	"2020100115151601565331" 01 Oct 2020
\|	Uracil	Uracil	112.09	1	PubChem \| InChI \| Smiles	"2021102512261635164775" 25 Oct 2021
\|	2-Chlorophenol	2-Chlorophenol	128.56	2	PubChem \| InChI \| Smiles	"2021093013191633007984" 30 Sep 2021
\|	Fuberidazole	Fuberidazole	184.19	1	PubChem \| InChI \| Smiles	"2020081213341597239248" 12 Aug 2020
\|	1,1'-Bis(trimethylammoniomethyl)ferrocene iodide		584.12	2	PubChem \| InChI \| Smiles	"2020102816271603902440" 28 Oct 2020
\|	2-Butanone	2-Butanone	72.11	1	PubChem \| InChI \| Smiles	"2021093013281633008529" 30 Sep 2021
\|	1,9-Diaminononane	1,9-Diaminononane	158.28	2	PubChem \| InChI \| Smiles	"2021101209361634031402" 12 Oct 2021
\|	((Dimethylamino)methyl)ferrocene	((Dimethylamino)methyl)ferrocene	243.13	3	PubChem \| InChI \| Smiles	"2021112414371637764633" 24 Nov 2021
\|	tiludronate	tiludronate	314.58	1	PubChem \| InChI \| Smiles	"2021101215161634051767" 12 Oct 2021
\|	alendronate	alendronate	249.10	1	PubChem \| InChI \| Smiles	"2022062413301656077437" 24 Jun 2022
\|	Carbendazim	Carbendazim	191.19	1	PubChem \| InChI \| Smiles	"2020121712361608208613" 17 Dec 2020
\|	1,1'-(dodecane-1,12-diyl)bis(1,4-diazabicyclo[2.2.2]octan-1-ium)		392.66	1	PubChem \| InChI \| Smiles	"2023042613181682515127" 26 Apr 2023
\|	Azure A	Azure A	291.80	1	PubChem \| InChI \| Smiles	"2020102817471603907256" 28 Oct 2020
\|	1,4-diaminobenzene	1,4-diaminobenzene	108.14	1	PubChem \| InChI \| Smiles	"2022072009411658310117" 20 Jul 2022
\|	L-serine	L-serine	105.09	1	PubChem \| InChI \| Smiles	"2022070507321657006373" 05 Jul 2022
\|	cobaltocene	cobaltocene	219.19	1	PubChem \| InChI \| Smiles	"2022113015401669822810" 30 Nov 2022
\|	1,1'-bis(4-aminophenyl)-[4,4'-bipyridine]-1,1'-diium		340.43	2	PubChem \| InChI \| Smiles	"2022062313271655990843" 23 Jun 2022
\|	1-(Phenoxathiin-3-yl)ethan-1-one	1-(Phenoxathiin-3-yl)ethan-1-one	242.29	1	PubChem \| InChI \| Smiles	"2022062412391656074340" 24 Jun 2022
\|	2-Amino-1-(4-nitrophenyl)-1,3-propanediol hydrochloride		248.66	1	PubChem \| InChI \| Smiles	"2021101908021634630540" 19 Oct 2021
\|	clodronate	clodronate	240.86	1	PubChem \| InChI \| Smiles	"2021102613471635256071" 26 Oct 2021
\|	quinoxaline	quinoxaline	130.15	1	PubChem \| InChI \| Smiles	"2021010412041609761890" 04 Jan 2021
\|	Albendazole	Albendazole	265.33	1	PubChem \| InChI \| Smiles	"2020121710411608201697" 17 Dec 2020
\|	1,1'-di-p-tolyl-[4,4'-bipyridine]-1,1'-diium		338.45	2	PubChem \| InChI \| Smiles	"2022062313151655990136" 23 Jun 2022
\|	Trimebutine maleate	Trimebutine maleate	387.50	3	PubChem \| InChI \| Smiles	"2021100815011633705296" 08 Oct 2021
\|	6-phenylpyridin-3-amine	6-phenylpyridin-3-amine	170.21	1	PubChem \| InChI \| Smiles	"2022062412281656073727" 24 Jun 2022
\|	Phenethylammonium	Phenethylammonium	122.19	1	PubChem \| InChI \| Smiles	"2021101822121634595120" 18 Oct 2021
\|	D-Cellobiose	D-Cellobiose	342.30	1	PubChem \| InChI \| Smiles	"2021101822041634594661" 18 Oct 2021
\|	Aspartame	Aspartame	294.30	3	PubChem \| InChI \| Smiles	"2021092815111632841860" 28 Sep 2021
\|	Trimethylhexan-1-aminium bromide	Trimethylhexan-1-aminium bromide	224.18	8	PubChem \| InChI \| Smiles	"2020101120241602447872" 11 Oct 2020
\|	beta-Estradiol-17-acetate	beta-Estradiol-17-acetate	314.42	1	PubChem \| InChI \| Smiles	"2021092210181632305911" 22 Sep 2021
\|	[2,2'-bipyridin]-5-amine	[2,2'-bipyridin]-5-amine	171.20	2	PubChem \| InChI \| Smiles	"2021093010031632996208" 30 Sep 2021
\|	N,N-dimethyl-N-(4-methylbenzyl)-1-(p-tolyl)methanaminium		254.39	2	PubChem \| InChI \| Smiles	"2023030616301678120240" 06 Mar 2023
\|	2-Methylpropanoate	2-Methylpropanoate	87.10	1	PubChem \| InChI \| Smiles	"2021092907061632899218" 29 Sep 2021
\|	Hoechst Dye 33258	Hoechst Dye 33258	533.90	2	PubChem \| InChI \| Smiles	"2020103016131604074400" 30 Oct 2020
\|	2,7-di(2,5,8,11-tetraoxatridecan-13-yl)benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetraone		646.68	1	PubChem \| InChI \| Smiles	"2021092207331632295990" 22 Sep 2021
\|	N,N-dimethyl-N-(3-methylbenzyl)-1-(m-tolyl)methanaminium		254.39	1	PubChem \| InChI \| Smiles	"2023030815411678290094" 08 Mar 2023
\|	(1,4-phenylene)bis(trimethylmethanaminium) bromide		382.18	4	PubChem \| InChI \| Smiles	"2020102217451603388719" 22 Oct 2020
\|	Auramine O	Auramine O	303.83	4	PubChem \| InChI \| Smiles	"2020102613291603718989" 26 Oct 2020
\|	Coumarin 6	Coumarin 6	350.40	1	PubChem \| InChI \| Smiles	"2022062308411655973705" 23 Jun 2022
\|	Acridine (protonated)	Acridine (protonated)	180.23	3	PubChem \| InChI \| Smiles	"2020102612121603714361" 26 Oct 2020
\|	Biphenyl-polyethylene-glycol 2	Biphenyl-polyethylene-glycol 2	2165.60	2	PubChem \| InChI \| Smiles	"2022062307571655971049" 23 Jun 2022
\|	(S)-1,1,2,4,4-pentamethylpiperazine-1,4-diium		158.28	1	PubChem \| InChI \| Smiles	"2023011610371673865459" 16 Jan 2023
\|	Tetrabutylammonium periodate	Tetrabutylammonium periodate	433.37	1	PubChem \| InChI \| Smiles	"2022063014081656598111" 30 Jun 2022
\|	Trifluoromethanesulfonate	Trifluoromethanesulfonate	149.07	2	PubChem \| InChI \| Smiles	"2021092208381632299930" 22 Sep 2021
\|	5-HTP	5-HTP	220.23	4	PubChem \| InChI \| Smiles	"2021092816181632845910" 28 Sep 2021
\|	bis-MV4+	bis-MV4+	370.49	1	PubChem \| InChI \| Smiles	"2021010713201610025656" 07 Jan 2021
\|	BO	BO	321.33	1	PubChem \| InChI \| Smiles	"2023072412141690200868" 24 Jul 2023
\|	5-Bromo-2-adamantanone	5-Bromo-2-adamantanone	229.11	1	PubChem \| InChI \| Smiles	"2022101712461666010776" 17 Oct 2022
\|	Hydroxypropyl-β-Cyclodextrin	Hydroxypropyl-β-Cyclodextrin	2353.00	1	PubChem \| InChI \| Smiles	"2021032313221616505745" 23 Mar 2021
\|	Thiocyanate	Thiocyanate	58.08	8	PubChem \| InChI \| Smiles	"2020102820291603916968" 28 Oct 2020
\|	D/L-Tyrosine	D/L-Tyrosine	181.19	1	PubChem \| InChI \| Smiles	"2022062411201656069636" 24 Jun 2022
\|	Cyanide	Cyanide	26.02	3	PubChem \| InChI \| Smiles	"2020102912461603975563" 29 Oct 2020
\|	Tetradecyltrimethylammonium bromide	Tetradecyltrimethylammonium bromide	336.40	3	PubChem \| InChI \| Smiles	"2021092210251632306328" 22 Sep 2021
\|	Octanoic acid	Octanoic acid	144.21	2	PubChem \| InChI \| Smiles	"2020102912281603974485" 29 Oct 2020
\|	1,4-phenylenedimethanol	1,4-phenylenedimethanol	138.16	1	PubChem \| InChI \| Smiles	"2022072008161658304966" 20 Jul 2022
\|	IODOMETHANE	IODOMETHANE	141.94	1	PubChem \| InChI \| Smiles	"2022061416041655222654" 14 Jun 2022
\|	Cyclic sulfenamide-2a	Cyclic sulfenamide-2a	352.35	1	PubChem \| InChI \| Smiles	"2022062411161656069389" 24 Jun 2022
\|	ethylene viologen	ethylene viologen	212.29	1	PubChem \| InChI \| Smiles	"2022063008371656578255" 30 Jun 2022
\|	N-Phenylsuccinimide	N-Phenylsuccinimide	175.18	1	PubChem \| InChI \| Smiles	"2022070507391657006767" 05 Jul 2022
\|	propanil	propanil	218.08	1	PubChem \| InChI \| Smiles	"2022070507401657006824" 05 Jul 2022
\|	rotenone	rotenone	394.40	1	PubChem \| InChI \| Smiles	"2022070507401657006854" 05 Jul 2022
\|	tri-methyl viologen scaffold	tri-methyl viologen scaffold	1722.86	3	PubChem \| InChI \| Smiles	"2020102320101603483847" 23 Oct 2020
\|	Tyr-Phe-Ala	Tyr-Phe-Ala	399.44	1	PubChem \| InChI \| Smiles	"2022062411541656071691" 24 Jun 2022
\|	2-Hydroxy-3-(1,4,7,10-tetraoxa-13-azacyclopentadecan-13-ylmethyl)-5-bromobenzaldehyde oxime		447.30	2	PubChem \| InChI \| Smiles	"2020103019431604087017" 30 Oct 2020
\|	Tryptophol	Tryptophol	161.20	1	PubChem \| InChI \| Smiles	"2021093011491633002553" 30 Sep 2021
\|	2-anthracenecar- boxylate sodium salt	2-anthracenecar- boxylate sodium salt	244.22	1	PubChem \| InChI \| Smiles	"2021010714061610028382" 07 Jan 2021
\|	(2S,3S)-2-(Benzyloxy)butane-1,3,4-triol		212.24	1	PubChem \| InChI \| Smiles	"2021100716411633624879" 07 Oct 2021
\|	AM Phe	AM Phe	194.23	1	PubChem \| InChI \| Smiles	"2021093013451633009522" 30 Sep 2021
\|	BPTA-PBI	BPTA-PBI	590.71	2	PubChem \| InChI \| Smiles	"2021010213401609594815" 02 Jan 2021
\|	2,7-Dimethyldiazaphenanthrenium	2,7-Dimethyldiazaphenanthrenium	210.11	5	PubChem \| InChI \| Smiles	"2020101614391602859178" 16 Oct 2020
\|	Estrone	Estrone	270.37	1	PubChem \| InChI \| Smiles	"2021092816211632846071" 28 Sep 2021
\|	Gly-AM Phe-Gly	Gly-AM Phe-Gly	308.33	1	PubChem \| InChI \| Smiles	"2022062411341656070483" 24 Jun 2022
\|	Benzyltrimethylammonium	Benzyltrimethylammonium	150.24	4	PubChem \| InChI \| Smiles	"2021092907191632899991" 29 Sep 2021
\|	Cx4-CH2COOH	Cx4-CH2COOH	656.63	6	PubChem \| InChI \| Smiles	"2020093016101601482239" 30 Sep 2020
\|	sCx6-C4	sCx6-C4	1585.62	1	PubChem \| InChI \| Smiles	"2020100115421601566949" 01 Oct 2020
\|	AM Phe-Gly-Gly	AM Phe-Gly-Gly	308.33	1	PubChem \| InChI \| Smiles	"2022062307381655969889" 23 Jun 2022
\|	N-retinylidine-N-ethanolamine	N-retinylidine-N-ethanolamine	592.92	2	PubChem \| InChI \| Smiles	"2021031616191615911552" 16 Mar 2021
\|	N,N'-(1,4-phenylenebis(methylene))bis(2-azidoethan-1-aminium) chloride		347.25	1	PubChem \| InChI \| Smiles	"2024031410581710413882" 14 Mar 2024
\|	[C4mim]Cl	[C4mim]Cl	174.67	1	PubChem \| InChI \| Smiles	"2022062922511656543099" 29 Jun 2022
\|	Cryptophane-A acid	Cryptophane-A acid	895.00	2	PubChem \| InChI \| Smiles	"2020102920531604004817" 29 Oct 2020
\|	Methyl carboxy pyridinium cation	Methyl carboxy pyridinium cation	138.14	1	PubChem \| InChI \| Smiles	"2024042914321714401160" 29 Apr 2024
\|	1-phenyl-2,3-diazabicyclo[2.2.2]oct-2-ene		186.25	1	PubChem \| InChI \| Smiles	"2020120113441606830298" 01 Dec 2020
\|	N1,N6-di(prop-2-yn-1-yl)hexane-1,6-diaminium chloride		265.22	1	PubChem \| InChI \| Smiles	"2024031410111710411114" 14 Mar 2024
\|	4,7-Dimethyl-1,10-phenanthroline	4,7-Dimethyl-1,10-phenanthroline	208.26	4	PubChem \| InChI \| Smiles	"2020120414021607090534" 04 Dec 2020
\|	Phenoxathiine-3-carboxylic acid	Phenoxathiine-3-carboxylic acid	244.26	2	PubChem \| InChI \| Smiles	"2022062412401656074433" 24 Jun 2022
\|	Cx4R-C5	Cx4R-C5	769.02	1	PubChem \| InChI \| Smiles	"2020100207261601623582" 02 Oct 2020
\|	N1,N1'-(1,4-pheny...	N1,N1'-(1,4-pheny...	368.17	1	PubChem \| InChI \| Smiles	"2024030612491709729364" 06 Mar 2024
\|	Ethyl acetate	Ethyl acetate	88.11	2	PubChem \| InChI \| Smiles	"2021101214581634050689" 12 Oct 2021
\|	tamoxifen	tamoxifen	371.50	1	PubChem \| InChI \| Smiles	"2021100116191633105151" 01 Oct 2021
\|	Cx4R-C2	Cx4R-C2	544.59	1	PubChem \| InChI \| Smiles	"2020100207301601623852" 02 Oct 2020
\|	irinotecan	irinotecan	586.70	1	PubChem \| InChI \| Smiles	"2021102612121635250369" 26 Oct 2021
\|	Acetylene	Acetylene	26.04	2	PubChem \| InChI \| Smiles	"2020102717411603820484" 27 Oct 2020
\|	Memantine	Memantine	179.31	13	PubChem \| InChI \| Smiles	"2021092816051632845103" 28 Sep 2021
\|	Thioflavin T	Thioflavin T	318.86	1	PubChem \| InChI \| Smiles	"2020103017501604080237" 30 Oct 2020
\|	2Ant-5kPEGOMe	2Ant-5kPEGOMe	5229.22	2	PubChem \| InChI \| Smiles	"2022070113581656683928" 01 Jul 2022
\|	Lidocaine hydrochloride	Lidocaine hydrochloride	270.80	2	PubChem \| InChI \| Smiles	"2021100116231633105439" 01 Oct 2021
\|	D-Aspartic acid	D-Aspartic acid	133.10	1	PubChem \| InChI \| Smiles	"2022021413211644844890" 14 Feb 2022
\|	Cobaltocenium	Cobaltocenium	189.12	1	PubChem \| InChI \| Smiles	"2020081213341597239259" 12 Aug 2020
\|	Hexane	Hexane	86.18	2	PubChem \| InChI \| Smiles	"2021092908221632903729" 29 Sep 2021
\|	Isobutene	Isobutene	56.11	2	PubChem \| InChI \| Smiles	"2021100817551633715759" 08 Oct 2021
\|	Tetrachlorotetraiodofluorescein	Tetrachlorotetraiodofluorescein	973.66	1	PubChem \| InChI \| Smiles	"2021093009331632994393" 30 Sep 2021
\|	2Fl-5kPEGOMe	2Fl-5kPEGOMe	5217.21	3	PubChem \| InChI \| Smiles	"2022070114091656684542" 01 Jul 2022
\|	1,3-dimethyl-1H-imidazol-3-ium	1,3-dimethyl-1H-imidazol-3-ium	97.14	1	PubChem \| InChI \| Smiles	"2023063014161688134598" 30 Jun 2023
\|	P-TPE	P-TPE	524.40	1	PubChem \| InChI \| Smiles	"2022062411061656068787" 24 Jun 2022
\|	(E)-4,4'-(ethene-1,2-diyl)bis(1-methylpyridin-1-ium)		212.29	1	PubChem \| InChI \| Smiles	"2023063014251688135159" 30 Jun 2023
\|	Pyronin G	Pyronin G	302.80	4	PubChem \| InChI \| Smiles	"2020102817391603906752" 28 Oct 2020
\|	1,1'-bis(4-cyanophenyl)-[4,4'-bipyridine]-1,1'-diium		360.42	3	PubChem \| InChI \| Smiles	"2022062309111655975514" 23 Jun 2022
\|	PLP	PLP	245.13	1	PubChem \| InChI \| Smiles	"2022062413271656077249" 24 Jun 2022
\|	(R)-N,N-Dimethyl-1-ferrocenylethylamine		257.16	1	PubChem \| InChI \| Smiles	"2020111110501605091859" 11 Nov 2020
\|	3-Hydroxyadamantan-1-aminium	3-Hydroxyadamantan-1-aminium	168.26	1	PubChem \| InChI \| Smiles	"2020111014381605019093" 10 Nov 2020
\|	Cx4-(N2-Ph-COOH)	Cx4-(N2-Ph-COOH)	1016.96	1	PubChem \| InChI \| Smiles	"2020100215191601651951" 02 Oct 2020
\|	biphenyl-polyethylene glycol monomethyl ether polymer		5249.31	2	PubChem \| InChI \| Smiles	"2022062313241655990686" 23 Jun 2022
\|	N-Methylacridinium iodide	N-Methylacridinium iodide	321.16	1	PubChem \| InChI \| Smiles	"2021092209061632301581" 22 Sep 2021
\|	dibenzofuran polyethylene glycol monomethyl ether polymer		5293.31	2	PubChem \| InChI \| Smiles	"2022062313261655990767" 23 Jun 2022
\|	Propane-d8	Propane-d8	52.15	1	PubChem \| InChI \| Smiles	"2021101114201633962040" 11 Oct 2021
\|	propylammonium	propylammonium	60.12	1	PubChem \| InChI \| Smiles	"2021102709061635325595" 27 Oct 2021
\|	1-methylcyclohexanol	1-methylcyclohexanol	114.19	1	PubChem \| InChI \| Smiles	"2021092820511632862302" 28 Sep 2021
\|	(R)-1-(2-naphthyl)ethylammonium	(R)-1-(2-naphthyl)ethylammonium	172.25	3	PubChem \| InChI \| Smiles	"2021093013281633008500" 30 Sep 2021
\|	2-Methyloxirane	2-Methyloxirane	58.08	4	PubChem \| InChI \| Smiles	"2021101214561634050561" 12 Oct 2021
\|	Ethene	Ethene	28.05	3	PubChem \| InChI \| Smiles	"2020102717351603820159" 27 Oct 2020
\|	Isobutane	Isobutane	58.12	2	PubChem \| InChI \| Smiles	"2021100814301633703435" 08 Oct 2021
\|	sP7A	sP7A	2283.00	19	PubChem \| InChI \| Smiles	"2020093015501601481031" 30 Sep 2020
\|	2-Aminoanthracenium cation	2-Aminoanthracenium cation	194.25	1	PubChem \| InChI \| Smiles	"2020081213341597239250" 12 Aug 2020
\|	2-Acetylguanidinium	2-Acetylguanidinium	102.12	1	PubChem \| InChI \| Smiles	"2021101816391634575181" 18 Oct 2021
\|	Phenylephrine	Phenylephrine	167.21	2	PubChem \| InChI \| Smiles	"2021101908391634632786" 19 Oct 2021
\|	5-Chloro-2-adamantanone	5-Chloro-2-adamantanone	184.66	1	PubChem \| InChI \| Smiles	"2022101712451666010745" 17 Oct 2022
\|	(+)-Pseudoephedrine	(+)-Pseudoephedrine	165.24	2	PubChem \| InChI \| Smiles	"2020103013271604064449" 30 Oct 2020
\|	Pentane-1,5-diammonium	Pentane-1,5-diammonium	104.19	10	PubChem \| InChI \| Smiles	"2022062308341655973281" 23 Jun 2022
\|	Cyclopentanone	Cyclopentanone	84.12	7	PubChem \| InChI \| Smiles	"2021092816081632845299" 28 Sep 2021
\|	Doxylamine	Doxylamine	270.38	2	PubChem \| InChI \| Smiles	"2021101908391634632748" 19 Oct 2021
\|	bis-sCx4	bis-sCx4	1507.45	4	PubChem \| InChI \| Smiles	"2020120303061606964812" 03 Dec 2020
\|	Methylcyclohexane	Methylcyclohexane	98.19	1	PubChem \| InChI \| Smiles	"2021101308241634113488" 13 Oct 2021
\|	Lys-lys	Lys-lys	274.36	2	PubChem \| InChI \| Smiles	"2020102918421603996952" 29 Oct 2020
\|	GGYYGGY Heptapeptide	GGYYGGY Heptapeptide	0.00	1	PubChem \| InChI \| Smiles	"2024022816481709138881" 28 Feb 2024
\|	trans-2-Butene	trans-2-Butene	56.11	2	PubChem \| InChI \| Smiles	"2021101109361633944985" 11 Oct 2021
\|	(3s,5s,7s)-N,N,N-trimethyladamantan-1-aminium		194.34	1	PubChem \| InChI \| Smiles	"2023011610351673865340" 16 Jan 2023
\|	1,5-PENTANEDIOL	1,5-PENTANEDIOL	104.15	1	PubChem \| InChI \| Smiles	"2021100814291633703378" 08 Oct 2021
\|	N-Butyladamantan-1-aminium	N-Butyladamantan-1-aminium	208.36	3	PubChem \| InChI \| Smiles	"2022063008341656578087" 30 Jun 2022
\|	Ranitidine	Ranitidine	314.40	4	PubChem \| InChI \| Smiles	"2020102515361603640180" 25 Oct 2020
\|	Hexamethylhexane-1,6-diaminium chloride		273.29	7	PubChem \| InChI \| Smiles	"2020101612481602852523" 16 Oct 2020
\|	1,1'-(butane-1,4-diyl)bis(1,4-diazabicyclo[2.2.2]octan-1-ium)		280.45	1	PubChem \| InChI \| Smiles	"2023052414491684939746" 24 May 2023
\|	4,4'-(ethane-1,2-diyl)bis(1-(tert-butyl)pyridin-1-ium)		298.47	1	PubChem \| InChI \| Smiles	"2024042914151714400112" 29 Apr 2024
\|	1,1'-(octane-1,8-diyl)bis(1,4-diazabicyclo[2.2.2]octan-1-ium)		336.56	1	PubChem \| InChI \| Smiles	"2023042612241682511873" 26 Apr 2023
\|	viologene-Ferrocenyl-dibromide	viologene-Ferrocenyl-dibromide	518.24	2	PubChem \| InChI \| Smiles	"2024030410571709549836" 04 Mar 2024
\|	hexamethyladamantane-1,3-diaminium	hexamethyladamantane-1,3-diaminium	252.44	1	PubChem \| InChI \| Smiles	"2023011610351673865304" 16 Jan 2023
\|	L-Trp-NH2	L-Trp-NH2	203.24	5	PubChem \| InChI \| Smiles	"2021092816221632846177" 28 Sep 2021
\|	viologene-Ferrocenyl-dibromide	viologene-Ferrocenyl-dibromide	574.34	3	PubChem \| InChI \| Smiles	"2024030410501709549451" 04 Mar 2024
\|	TMP	TMP	290.32	1	PubChem \| InChI \| Smiles	"2024080814071723126040" 08 Aug 2024
\|	O,O′-Di-p-toluoyl-D-tartaric acid	O,O′-Di-p-toluoyl-D-tartaric acid	386.36	1	PubChem \| InChI \| Smiles	"2021093016181633018691" 30 Sep 2021
\|	Tryptamine	Tryptamine	160.22	14	PubChem \| InChI \| Smiles	"2020101209411602495700" 12 Oct 2020
\|	Zeolite Y15	Zeolite Y15	0.00	6	PubChem \| InChI \| Smiles	"2022032312361648038993" 23 Mar 2022
\|	1,10-Phenanthroline	1,10-Phenanthroline	180.21	7	PubChem \| InChI \| Smiles	"2020101609461602841619" 16 Oct 2020
\|	Adamatanyl trymethylmethanaminium	Adamatanyl trymethylmethanaminium	208.36	1	PubChem \| InChI \| Smiles	"2023011610361673865375" 16 Jan 2023
\|	Harmane	Harmane	182.22	3	PubChem \| InChI \| Smiles	"2024032715081711552103" 27 Mar 2024
\|	N-(3,5-dimethylbenzyl)-1-(3,5-dimethylphenyl)-N,N-dimethylmethanaminium		282.44	1	PubChem \| InChI \| Smiles	"2023030815571678291049" 08 Mar 2023
\|	Octyltrimethylammonium bromide	Octyltrimethylammonium bromide	252.23	2	PubChem \| InChI \| Smiles	"2021092816121632845564" 28 Sep 2021
\|	L-Adrenaline	L-Adrenaline	183.20	7	PubChem \| InChI \| Smiles	"2020101212491602506970" 12 Oct 2020
\|	N,N-dimethyl-N-(2-methylbenzyl)-1-(o-tolyl)methanaminium		254.39	1	PubChem \| InChI \| Smiles	"2023030815361678289787" 08 Mar 2023
\|	Acyclic di-(sodium(3-((4-(2-azidoethoxy)naphthalen-1-yl)oxy)propane-1-sulfonate)-functionalizedCucurbiturils		1491.41	1	PubChem \| InChI \| Smiles	"2020081213331597239235" 12 Aug 2020
\|	(S)-(+)-1-Cyclohexylethylamine	(S)-(+)-1-Cyclohexylethylamine	127.23	1	PubChem \| InChI \| Smiles	"2021102420321635107566" 24 Oct 2021
\|	Atenolol	Atenolol	266.34	2	PubChem \| InChI \| Smiles	"2021100816031633709032" 08 Oct 2021
\|	methyl 2-amino-3-(4-methoxyphenyl)propanoate		209.24	1	PubChem \| InChI \| Smiles	"2021101215491634053793" 12 Oct 2021
\|	4,9-Diaminodiamantane	4,9-Diaminodiamantane	218.34	4	PubChem \| InChI \| Smiles	"2024081409271723627654" 14 Aug 2024
\|	Dopamine	Dopamine	153.18	19	PubChem \| InChI \| Smiles	"2022062411471656071230" 24 Jun 2022
\|	Alprenolol	Alprenolol	249.35	2	PubChem \| InChI \| Smiles	"2021093008271632990472" 30 Sep 2021
\|	Hexafluorophosphate	Hexafluorophosphate	144.96	2	PubChem \| InChI \| Smiles	"2021092207461632296819" 22 Sep 2021
\|	Acetylthiocholine	Acetylthiocholine	162.28	2	PubChem \| InChI \| Smiles	"2021100716421633624959" 07 Oct 2021
\|	Coumarin 7	Coumarin 7	333.40	2	PubChem \| InChI \| Smiles	"2020102913501603979458" 29 Oct 2020
\|	acetyl-L-leucinate	acetyl-L-leucinate	172.20	1	PubChem \| InChI \| Smiles	"2021102712471635338861" 27 Oct 2021
\|	dimethyladamantan HCl	dimethyladamantan HCl	215.76	1	PubChem \| InChI \| Smiles	"2024031313491710337795" 13 Mar 2024
\|	pyrene-modified calix[4]arene derivative		1283.42	1	PubChem \| InChI \| Smiles	"2021021910521613731943" 19 Feb 2021
\|	(R)-Hexahydromandelic acid	(R)-Hexahydromandelic acid	158.20	1	PubChem \| InChI \| Smiles	"2021093015011633014099" 30 Sep 2021
\|	(1R)-(+)-Camphanic acid	(1R)-(+)-Camphanic acid	198.22	1	PubChem \| InChI \| Smiles	"2021093016111633018260" 30 Sep 2021
\|	Coumarin-30-neutral	Coumarin-30-neutral	347.41	3	PubChem \| InChI \| Smiles	"2021021717231613582606" 17 Feb 2021
\|	Tyr-met	Tyr-met	312.39	1	PubChem \| InChI \| Smiles	"2023102416001698163229" 24 Oct 2023
\|	cyclopropylmethanaminium	cyclopropylmethanaminium	72.13	1	PubChem \| InChI \| Smiles	"2023062708591687856391" 27 Jun 2023
\|	beta-Pinene	beta-Pinene	136.23	1	PubChem \| InChI \| Smiles	"2021093014111633011070" 30 Sep 2021
\|	Dansylcholine	Dansylcholine	336.47	1	PubChem \| InChI \| Smiles	"2021110812311636374719" 08 Nov 2021
\|	cyclobutylmethanaminium	cyclobutylmethanaminium	86.16	1	PubChem \| InChI \| Smiles	"2023062707401687851632" 27 Jun 2023
\|	TMGU	TMGU	198.22	1	PubChem \| InChI \| Smiles	"2021082316461629737166" 23 Aug 2021
\|	Ac-L-Phe anion	Ac-L-Phe anion	206.22	4	PubChem \| InChI \| Smiles	"2021090912481631191718" 09 Sep 2021
\|	P6A-(CH2COOH)	P6A-(CH2COOH)	1431.00	22	PubChem \| InChI \| Smiles	"2020093015071601478425" 30 Sep 2020
\|	PFOS	PFOS	502.24	1	PubChem \| InChI \| Smiles	"2022062413301656077405" 24 Jun 2022
\|	perfluorooctanoic acid	perfluorooctanoic acid	414.07	1	PubChem \| InChI \| Smiles	"2022062413281656077303" 24 Jun 2022
\|	1-aminodiamantane	1-aminodiamantane	203.32	4	PubChem \| InChI \| Smiles	"2024081409251723627544" 14 Aug 2024
\|	Methylene Blue	Methylene Blue	319.85	9	PubChem \| InChI \| Smiles	"2020100716131602087239" 07 Oct 2020
\|	8-Methoxycaffeine	8-Methoxycaffeine	224.22	1	PubChem \| InChI \| Smiles	"2021102113301634823032" 21 Oct 2021
\|	Triphenylenoltris([1,3]dioxole)-trisbicyclo[3.3.1]nonanyl)carbamate		1132.30	1	PubChem \| InChI \| Smiles	"2020102313561603461404" 23 Oct 2020
\|	2-Phenoxathiin-2-ylquinoxaline	2-Phenoxathiin-2-ylquinoxaline	328.39	1	PubChem \| InChI \| Smiles	"2021100814591633705158" 08 Oct 2021
\|	Thiophene	Thiophene	84.14	2	PubChem \| InChI \| Smiles	"2021092908081632902894" 29 Sep 2021
\|	N,N'-(1,4-phenylenebis(methylene))bis(butan-1-aminium) chloride		321.33	1	PubChem \| InChI \| Smiles	"2024031413041710421476" 14 Mar 2024
\|	1,6-Hexandiammonium	1,6-Hexandiammonium	118.22	7	PubChem \| InChI \| Smiles	"2022062411221656069778" 24 Jun 2022
\|	N,N'-(1,4-phenylenebis(methylene))bis(prop-2-en-1-aminium) chloride		289.24	1	PubChem \| InChI \| Smiles	"2024031412441710420290" 14 Mar 2024
\|	Butanoate	Butanoate	87.10	1	PubChem \| InChI \| Smiles	"2021102213331634909625" 22 Oct 2021
\|	o-(H)2-2.2.2	o-(H)2-2.2.2	470.51	1	PubChem \| InChI \| Smiles	"2020101212121602504722" 12 Oct 2020
\|	trans-4-methylcyclohexanol	trans-4-methylcyclohexanol	114.19	1	PubChem \| InChI \| Smiles	"2022071207171657610244" 12 Jul 2022
\|	N-Methylhexylammonium	N-Methylhexylammonium	116.22	1	PubChem \| InChI \| Smiles	"2020081213341597239261" 12 Aug 2020
\|	Leu-met-ala	Leu-met-ala	333.45	1	PubChem \| InChI \| Smiles	"2022062308461655974008" 23 Jun 2022
\|	rimantadine	rimantadine	179.30	1	PubChem \| InChI \| Smiles	"2021102708541635324853" 27 Oct 2021
\|	Cimetidine	Cimetidine	252.34	1	PubChem \| InChI \| Smiles	"2021093009191632993558" 30 Sep 2021
\|	[(trimethylammonio)methyl]ferrocene	[(trimethylammonio)methyl]ferrocene	258.16	6	PubChem \| InChI \| Smiles	"2021112412051637755515" 24 Nov 2021
\|	octanoate	octanoate	143.20	1	PubChem \| InChI \| Smiles	"2021093009201632993643" 30 Sep 2021
\|	cis-2-Methylcyclohexanol	cis-2-Methylcyclohexanol	114.19	1	PubChem \| InChI \| Smiles	"2021102213321634909540" 22 Oct 2021
\|	L-Tyr	L-Tyr	181.19	11	PubChem \| InChI \| Smiles	"2021092208581632301090" 22 Sep 2021
\|	1-Butylamine (protonated)	1-Butylamine (protonated)	74.14	3	PubChem \| InChI \| Smiles	"2020102913371603978668" 29 Oct 2020
\|	Fluconazole	Fluconazole	306.27	2	PubChem \| InChI \| Smiles	"2021100116281633105683" 01 Oct 2021
\|	Phenoxathiine-3-carbaldehyde	Phenoxathiine-3-carbaldehyde	228.27	1	PubChem \| InChI \| Smiles	"2022062409511656064301" 24 Jun 2022
\|	Acridine hydrochloride	Acridine hydrochloride	215.68	1	PubChem \| InChI \| Smiles	"2021092209581632304700" 22 Sep 2021
\|	Toluidine Blue	Toluidine Blue	305.82	2	PubChem \| InChI \| Smiles	"2020102817201603905643" 28 Oct 2020
\|	Bisphenol A	Bisphenol A	228.29	2	PubChem \| InChI \| Smiles	"2021093014331633012388" 30 Sep 2021
\|	Bisphenol AF	Bisphenol AF	336.23	2	PubChem \| InChI \| Smiles	"2021102612251635251136" 26 Oct 2021
\|	[C6mim]Br	[C6mim]Br	247.18	2	PubChem \| InChI \| Smiles	"2022062922501656543000" 29 Jun 2022
\|	L-methionyl-L-lysylglycylglycyl-L-tyrosine		554.66	1	PubChem \| InChI \| Smiles	"2022062309181655975909" 23 Jun 2022
\|	[C8mim]Br	[C8mim]Br	275.23	2	PubChem \| InChI \| Smiles	"2022062922581656543481" 29 Jun 2022
\|	L-methionyl-L-lysyl-L-alanylglycyl-L-tyrosine		568.69	1	PubChem \| InChI \| Smiles	"2022062308441655973894" 23 Jun 2022
\|	Osthole	Osthole	244.29	1	PubChem \| InChI \| Smiles	"2021092915221632928961" 29 Sep 2021
\|	1,1'-(nonane-1,9-diyl)bis(1,4-diazabicyclo[2.2.2]octan-1-ium)		350.58	1	PubChem \| InChI \| Smiles	"2023042612411682512890" 26 Apr 2023
\|	Decanoic acid	Decanoic acid	172.26	1	PubChem \| InChI \| Smiles	"2021101215221634052144" 12 Oct 2021
\|	methionyltyrosylalanine	methionyltyrosylalanine	383.50	1	PubChem \| InChI \| Smiles	"2023102416171698164227" 24 Oct 2023
\|	Lys-arg	Lys-arg	302.37	1	PubChem \| InChI \| Smiles	"2021101908331634632387" 19 Oct 2021
\|	Dimethyllysine	Dimethyllysine	174.24	5	PubChem \| InChI \| Smiles	"2020101616461602866817" 16 Oct 2020
\|	3,5-bis(phenylmethoxy)-Benzoate anion		333.36	1	PubChem \| InChI \| Smiles	"2022071310381657708705" 13 Jul 2022
\|	1,1'-(decane-1,10-diyl)bis(1,4-diazabicyclo[2.2.2]octan-1-ium)		364.61	1	PubChem \| InChI \| Smiles	"2023042612551682513748" 26 Apr 2023
\|	benzene	benzene	78.11	7	PubChem \| InChI \| Smiles	"2022011323571642118225" 13 Jan 2022
\|	methionylleucylalanine	methionylleucylalanine	333.45	1	PubChem \| InChI \| Smiles	"2023102416061698163577" 24 Oct 2023
\|	L-methionyl-L-leucylglycylglycyl-L-tyrosine		539.64	1	PubChem \| InChI \| Smiles	"2022062310541655981648" 23 Jun 2022
\|	Methyl acetate	Methyl acetate	74.08	1	PubChem \| InChI \| Smiles	"2022062411191656069597" 24 Jun 2022
\|	2-nitrobenzylmethylethercholine	2-nitrobenzylmethylethercholine	253.32	3	PubChem \| InChI \| Smiles	"2020102618371603737468" 26 Oct 2020
\|	Prodan	Prodan	227.31	1	PubChem \| InChI \| Smiles	"2021093014591633013967" 30 Sep 2021
\|	Dimethyl carbonate	Dimethyl carbonate	90.08	2	PubChem \| InChI \| Smiles	"2020102720111603829491" 27 Oct 2020
\|	procainamide hydrochloride	procainamide hydrochloride	271.78	3	PubChem \| InChI \| Smiles	"2021100116241633105484" 01 Oct 2021
\|	1-methoxy-2,3,4,5,6-pentafluorocyclohexane		204.14	1	PubChem \| InChI \| Smiles	"2022071310331657708429" 13 Jul 2022
\|	ethylguanidinium	ethylguanidinium	88.13	1	PubChem \| InChI \| Smiles	"2021102711521635335523" 27 Oct 2021
\|	1,3-Dioxolane	1,3-Dioxolane	74.08	4	PubChem \| InChI \| Smiles	"2021093009171632993474" 30 Sep 2021
\|	Potassium trifluoromethanesulfonate	Potassium trifluoromethanesulfonate	188.17	1	PubChem \| InChI \| Smiles	"2022101712461666010809" 17 Oct 2022
\|	ibandronate	ibandronate	319.23	1	PubChem \| InChI \| Smiles	"2022062413251656077110" 24 Jun 2022
\|	neridronate	neridronate	277.15	1	PubChem \| InChI \| Smiles	"2021102612431635252211" 26 Oct 2021
\|	risedronate	risedronate	283.11	1	PubChem \| InChI \| Smiles	"2021101215151634051716" 12 Oct 2021
\|	2-Butanol	2-Butanol	74.12	2	PubChem \| InChI \| Smiles	"2024072913331722260001" 29 Jul 2024
\|	Diammonium salt b	Diammonium salt b	758.56	1	PubChem \| InChI \| Smiles	"2024072914071722262059" 29 Jul 2024
\|	Valeric acid	Valeric acid	102.13	1	PubChem \| InChI \| Smiles	"2022062412241656073474" 24 Jun 2022
\|	4-(2-pyridyl)aniline	4-(2-pyridyl)aniline	170.21	1	PubChem \| InChI \| Smiles	"2021093010021632996138" 30 Sep 2021
\|	1-Phenylethanol	1-Phenylethanol	122.16	2	PubChem \| InChI \| Smiles	"2024072914031722261801" 29 Jul 2024
\|	Nitromethane	Nitromethane	61.04	2	PubChem \| InChI \| Smiles	"2021101214581634050730" 12 Oct 2021
\|	1-Hexylammonium	1-Hexylammonium	102.00	1	PubChem \| InChI \| Smiles	"2020081213341597239262" 12 Aug 2020
\|	Isodoxa	Isodoxa	479.44	1	PubChem \| InChI \| Smiles	"2020081213341597239243" 12 Aug 2020
\|	Methyltrioctylammonium chloride	Methyltrioctylammonium chloride	404.20	2	PubChem \| InChI \| Smiles	"2021092821061632863167" 28 Sep 2021
\|	Co 2+	Co 2+	58.93	1	PubChem \| InChI \| Smiles	"2021101116111633968717" 11 Oct 2021
\|	Tetramethyl-4-(methylamino)cyclohexanone		183.30	2	PubChem \| InChI \| Smiles	"2020102615481603727296" 26 Oct 2020
\|	2,6-ANS	2,6-ANS	298.34	6	PubChem \| InChI \| Smiles	"2021093008251632990330" 30 Sep 2021
\|	Octa-(6-O-(1-ethoxypropan-2-ol))-γ-CD		1761.77	3	PubChem \| InChI \| Smiles	"2020102522031603663414" 25 Oct 2020
\|	Morphine methiodide	Morphine methiodide	427.30	3	PubChem \| InChI \| Smiles	"2020102616401603730409" 26 Oct 2020
\|	2-Amino-2-phenylacetic acid	2-Amino-2-phenylacetic acid	151.16	2	PubChem \| InChI \| Smiles	"2023072511471690285663" 25 Jul 2023
\|	MANDELIC ACID	MANDELIC ACID	152.15	2	PubChem \| InChI \| Smiles	"2023072709551690451702" 27 Jul 2023
\|	Dimethoxymethane	Dimethoxymethane	76.09	2	PubChem \| InChI \| Smiles	"2021100515551633449305" 05 Oct 2021
\|	N-((5-bromofuran-2-yl)methyl)prop-2-en-1-amine		216.08	2	PubChem \| InChI \| Smiles	"2022062411361656070611" 24 Jun 2022
\|	7-(diethylamino)-N-(1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl)-2-oxo-2H-chromene-3-carboxamide		364.40	2	PubChem \| InChI \| Smiles	"2021100116081633104493" 01 Oct 2021
\|	Safranine T	Safranine T	350.85	4	PubChem \| InChI \| Smiles	"2020102613351603719308" 26 Oct 2020
\|	Tetrabutylammonium trifluoroacetate	Tetrabutylammonium trifluoroacetate	355.50	1	PubChem \| InChI \| Smiles	"2021102507581635148699" 25 Oct 2021
\|	Nonanoic acid	Nonanoic acid	158.24	1	PubChem \| InChI \| Smiles	"2022062412231656073397" 24 Jun 2022
\|	Trimethylsulfonium	Trimethylsulfonium	77.17	2	PubChem \| InChI \| Smiles	"2023030809231678267436" 08 Mar 2023
\|	3-Indolepropionic acid	3-Indolepropionic acid	189.21	1	PubChem \| InChI \| Smiles	"2021093013031633006985" 30 Sep 2021
\|	Prochloraz	Prochloraz	376.70	1	PubChem \| InChI \| Smiles	"2022070507391657006795" 05 Jul 2022
\|	1-(1H-pyrrole-2-ylcarbonyl)guanidinium		153.16	1	PubChem \| InChI \| Smiles	"2021102712451635338732" 27 Oct 2021
\|	HSA	HSA	133330.00	3	PubChem \| InChI \| Smiles	"2021040807511617868286" 08 Apr 2021
\|	1-adamantyltrimethylammonium	1-adamantyltrimethylammonium	194.34	3	PubChem \| InChI \| Smiles	"2020081213341597239261" 12 Aug 2020
\|	L-His	L-His	155.15	5	PubChem \| InChI \| Smiles	"2020101616321602865931" 16 Oct 2020
\|	2-Acetamido-3-Phenylpropanoate	2-Acetamido-3-Phenylpropanoate	206.22	1	PubChem \| InChI \| Smiles	"2021093012531633006402" 30 Sep 2021
\|	3-Hydroxy-2-naphthoic acid	3-Hydroxy-2-naphthoic acid	188.18	2	PubChem \| InChI \| Smiles	"2020123119121609441947" 31 Dec 2020
\|	piperonylic acid	piperonylic acid	166.13	2	PubChem \| InChI \| Smiles	"2020123119141609442075" 31 Dec 2020
\|	Methylguanidinium	Methylguanidinium	74.11	1	PubChem \| InChI \| Smiles	"2021100814271633703277" 08 Oct 2021
\|	1,4-dioxene	1,4-dioxene	86.09	2	PubChem \| InChI \| Smiles	"2020102820201603916446" 28 Oct 2020
\|	4-ammoniumbutanoate	4-ammoniumbutanoate	103.12	1	PubChem \| InChI \| Smiles	"2021102711581635335884" 27 Oct 2021
\|	CYCLOHEXANECARBOXYLIC ACID	CYCLOHEXANECARBOXYLIC ACID	128.17	1	PubChem \| InChI \| Smiles	"2021102515151635174920" 25 Oct 2021
\|	[C2mim]Br	[C2mim]Br	191.07	2	PubChem \| InChI \| Smiles	"2022062922311656541914" 29 Jun 2022
\|	Anthracene	Anthracene	178.23	2	PubChem \| InChI \| Smiles	"2021102514151635171347" 25 Oct 2021
\|	sCX4-(C2O-C2)	sCX4-(C2O-C2)	1033.16	1	PubChem \| InChI \| Smiles	"2020100215041601651063" 02 Oct 2020
\|	GLYCIDOL	GLYCIDOL	74.08	2	PubChem \| InChI \| Smiles	"2024072913561722261373" 29 Jul 2024
\|	Dibenzoyl-L-tartaric acid	Dibenzoyl-L-tartaric acid	358.30	1	PubChem \| InChI \| Smiles	"2021102420241635107090" 24 Oct 2021
\|	N-Acetyl-L-Trp	N-Acetyl-L-Trp	246.27	6	PubChem \| InChI \| Smiles	"2021092815151632842146" 28 Sep 2021
\|	Glycyltyrosine	Glycyltyrosine	238.24	1	PubChem \| InChI \| Smiles	"2021102214171634912256" 22 Oct 2021
\|	Gly-Trp	Gly-Trp	261.28	1	PubChem \| InChI \| Smiles	"2022062411121656069142" 24 Jun 2022
\|	2AF	2AF	181.23	1	PubChem \| InChI \| Smiles	"2022062412331656074003" 24 Jun 2022
\|	N-Acetyl-L-tyrosine	N-Acetyl-L-tyrosine	223.23	1	PubChem \| InChI \| Smiles	"2021100716411633624909" 07 Oct 2021
\|	Rocuronium	Rocuronium	529.79	9	PubChem \| InChI \| Smiles	"2020100716361602088588" 07 Oct 2020
\|	N-Acetyl-L-Phenylalanine	N-Acetyl-L-Phenylalanine	207.23	1	PubChem \| InChI \| Smiles	"2021100716441633625053" 07 Oct 2021
\|	1-adamantylethanol	1-adamantylethanol	180.29	1	PubChem \| InChI \| Smiles	"2021010710411610016107" 07 Jan 2021
\|	N-Cbz-L-alanine	N-Cbz-L-alanine	223.23	1	PubChem \| InChI \| Smiles	"2021093016201633018854" 30 Sep 2021
\|	3-Pentanone	3-Pentanone	86.13	1	PubChem \| InChI \| Smiles	"2021093013511633009896" 30 Sep 2021
\|	Bromobenzene	Bromobenzene	157.01	4	PubChem \| InChI \| Smiles	"2021092907071632899267" 29 Sep 2021
\|	N-((5-methylfuran-2-yl)methyl)prop-2-en-1-amine		151.21	2	PubChem \| InChI \| Smiles	"2022062411311656070265" 24 Jun 2022
\|	1-adamantylmethanol	1-adamantylmethanol	166.26	1	PubChem \| InChI \| Smiles	"2020081213341597239255" 12 Aug 2020
\|	6-chloro-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole		171.62	2	PubChem \| InChI \| Smiles	"2022062407081656054482" 24 Jun 2022
\|	1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole		137.18	2	PubChem \| InChI \| Smiles	"2022062411311656070307" 24 Jun 2022
\|	2-ethyloxirane	2-ethyloxirane	72.11	2	PubChem \| InChI \| Smiles	"2024072913591722261568" 29 Jul 2024
\|	EPICHLOROHYDRIN	EPICHLOROHYDRIN	92.52	2	PubChem \| InChI \| Smiles	"2024072913581722261530" 29 Jul 2024
\|	propylene glycol	propylene glycol	76.09	2	PubChem \| InChI \| Smiles	"2023081414471692024468" 14 Aug 2023
\|	3-Chloro-1,2-propanediol	3-Chloro-1,2-propanediol	110.54	2	PubChem \| InChI \| Smiles	"2024072913321722259920" 29 Jul 2024
\|	Solketal	Solketal	132.16	2	PubChem \| InChI \| Smiles	"2024072913301722259808" 29 Jul 2024
\|	Gallium cation	Gallium cation	69.72	1	PubChem \| InChI \| Smiles	"2021100814551633704910" 08 Oct 2021
\|	1,7-Diaminoheptane	1,7-Diaminoheptane	130.23	2	PubChem \| InChI \| Smiles	"2021101209351634031304" 12 Oct 2021
\|	Benzyl glycidyl ether	Benzyl glycidyl ether	164.20	2	PubChem \| InChI \| Smiles	"2024072914011722261708" 29 Jul 2024
\|	1-Phenylethanamine	1-Phenylethanamine	121.18	2	PubChem \| InChI \| Smiles	"2024072914031722261836" 29 Jul 2024
\|	2-Amino-2-phenylethanol	2-Amino-2-phenylethanol	137.18	2	PubChem \| InChI \| Smiles	"2024072913581722261488" 29 Jul 2024
\|	2-Amino-1-phenylethanol	2-Amino-1-phenylethanol	137.18	2	PubChem \| InChI \| Smiles	"2024072914001722261634" 29 Jul 2024
\|	(Methylsulfonimidoyl)benzene	(Methylsulfonimidoyl)benzene	155.22	2	PubChem \| InChI \| Smiles	"2024072914001722261606" 29 Jul 2024
\|	(1-METHOXYETHYL)BENZENE	(1-METHOXYETHYL)BENZENE	136.19	2	PubChem \| InChI \| Smiles	"2024072913531722261219" 29 Jul 2024
\|	METHYL LACTATE	METHYL LACTATE	104.10	2	PubChem \| InChI \| Smiles	"2024072913541722261251" 29 Jul 2024
\|	Morin	Morin	302.23	1	PubChem \| InChI \| Smiles	"2021101214511634050295" 12 Oct 2021
\|	HPTS	HPTS	749.00	1	PubChem \| InChI \| Smiles	"2023090513311693920669" 05 Sep 2023
\|	Lanthanum(III) nitrate hexahydrate	Lanthanum(III) nitrate hexahydrate	433.01	2	PubChem \| InChI \| Smiles	"2021101216211634055683" 12 Oct 2021
\|	N-CBZ-glycine	N-CBZ-glycine	209.20	1	PubChem \| InChI \| Smiles	"2021101113011633957273" 11 Oct 2021
\|	Strontium nitrate	Strontium nitrate	211.60	1	PubChem \| InChI \| Smiles	"2021100515571633449455" 05 Oct 2021
\|	HOMATROPINE	HOMATROPINE	275.34	2	PubChem \| InChI \| Smiles	"2024081610471723805276" 16 Aug 2024
\|	Ammonium nitrate	Ammonium nitrate	80.04	1	PubChem \| InChI \| Smiles	"2021101216241634055841" 12 Oct 2021
\|	Magnesium nitrate	Magnesium nitrate	148.32	1	PubChem \| InChI \| Smiles	"2021100515561633449396" 05 Oct 2021
\|	3-methylcyclohexanol	3-methylcyclohexanol	114.19	1	PubChem \| InChI \| Smiles	"2021101109291633944587" 11 Oct 2021
\|	L-Leu-L-Trp	L-Leu-L-Trp	303.36	2	PubChem \| InChI \| Smiles	"2023102315111698073873" 23 Oct 2023
\|	Glutathione	Glutathione	307.33	2	PubChem \| InChI \| Smiles	"2023102407181698131920" 24 Oct 2023
\|	DBNH+	DBNH+	125.19	1	PubChem \| InChI \| Smiles	"2020081213341597239242" 12 Aug 2020
\|	Ne	Ne	20.18	1	PubChem \| InChI \| Smiles	"2022070112201656678018" 01 Jul 2022
\|	Protonated 1-isopropyl-4-methyl-DBO	Protonated 1-isopropyl-4-methyl-DBO	167.27	1	PubChem \| InChI \| Smiles	"2020081213341597239242" 12 Aug 2020
\|	Kr	Kr	83.80	1	PubChem \| InChI \| Smiles	"2022070112211656678081" 01 Jul 2022
\|	2,3-diazabicyclo[2.2.2]oct-2-en-2-ium	2,3-diazabicyclo[2.2.2]oct-2-en-2-ium	111.16	1	PubChem \| InChI \| Smiles	"2020120114451606833930" 01 Dec 2020
\|	4-AAB	4-AAB	197.24	2	PubChem \| InChI \| Smiles	"2022062412361656074189" 24 Jun 2022
\|	1-isopropyl-4-methyl-diazabicyclooctaene		166.26	3	PubChem \| InChI \| Smiles	"2020102617211603732918" 26 Oct 2020
\|	Calcium nitrate	Calcium nitrate	164.09	1	PubChem \| InChI \| Smiles	"2021093013171633007821" 30 Sep 2021
\|	Nile Blue chloride	Nile Blue chloride	353.85	3	PubChem \| InChI \| Smiles	"2020102620511603745468" 26 Oct 2020
\|	GRGG	GRGG	345.35	1	PubChem \| InChI \| Smiles	"2022072008041658304242" 20 Jul 2022
\|	1,2,4-Triazole	1,2,4-Triazole	69.07	2	PubChem \| InChI \| Smiles	"2021101214571634050658" 12 Oct 2021
\|	ChCx4-12C	ChCx4-12C	1618.00	1	PubChem \| InChI \| Smiles	"2020100115501601567435" 01 Oct 2020
\|	3-methylbutan-1-aminium	3-methylbutan-1-aminium	88.17	1	PubChem \| InChI \| Smiles	"2023062708231687854235" 27 Jun 2023
\|	1,8-Octanediammonium	1,8-Octanediammonium	146.27	4	PubChem \| InChI \| Smiles	"2020102913311603978310" 29 Oct 2020
\|	ChCx5-12C	ChCx5-12C	2023.03	1	PubChem \| InChI \| Smiles	"2020100115461601567186" 01 Oct 2020
\|	hexamethylbutane-1,4-diaminium iodide	hexamethylbutane-1,4-diaminium iodide	428.14	5	PubChem \| InChI \| Smiles	"2020101617031602867831" 16 Oct 2020
\|	New Methylene blue	New Methylene blue	347.90	2	PubChem \| InChI \| Smiles	"2021092820531632862401" 28 Sep 2021
\|	butylammonium	butylammonium	74.14	2	PubChem \| InChI \| Smiles	"2022071207181657610330" 12 Jul 2022
\|	Acetic acid	Acetic acid	60.05	1	PubChem \| InChI \| Smiles	"2022062412251656073510" 24 Jun 2022
\|	o-tolylmethanaminium	o-tolylmethanaminium	122.19	1	PubChem \| InChI \| Smiles	"2023062709311687858287" 27 Jun 2023
\|	3-Methylbenzylaminium	3-Methylbenzylaminium	122.19	1	PubChem \| InChI \| Smiles	"2023071407021689318154" 14 Jul 2023
\|	6-Methoxy-1-methylquinolinium	6-Methoxy-1-methylquinolinium	174.22	3	PubChem \| InChI \| Smiles	"2021092907201632900026" 29 Sep 2021
\|	Naphthalene-receptor 2	Naphthalene-receptor 2	667.88	1	PubChem \| InChI \| Smiles	"2022021413311644845518" 14 Feb 2022
\|	L-aspartic acid	L-aspartic acid	133.10	2	PubChem \| InChI \| Smiles	"2022030214231646231001" 02 Mar 2022
\|	Thionin	Thionin	263.74	4	PubChem \| InChI \| Smiles	"2021093016261633019199" 30 Sep 2021
\|	Pyronine	Pyronine	211.24	2	PubChem \| InChI \| Smiles	"2020102817361603906586" 28 Oct 2020
\|	1-Naphthyl-polyethylene-glycol-polymer		2139.56	1	PubChem \| InChI \| Smiles	"2022062411461656071164" 24 Jun 2022
\|	2-Naphthyl-polyethylene-glycol	2-Naphthyl-polyethylene-glycol	2139.53	1	PubChem \| InChI \| Smiles	"2022062412061656072370" 24 Jun 2022