arginyllysine | SBID = 1367 | Compound |
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | 183.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | -4.7 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 6.0 | ||
| Number of H-Bond Acceptors: | 6.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 2.0 | ||
| 3D Volume/Å3: | 232.9 | ||
| Sum Formula: | C12H26N6O3 | ||
| M / g/mol: | 302.37 | ||
| Complexity: | 357.0 | ||
| Number of Conformers: | 10.0 |
Identifiers
- Tags:
- Name: arginyllysine
- Preferred Abbreviation: Arg-Lys
- IUPAC Name: (2S)-6-amino-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]hexanoic acid
- CAS: 40968-46-5
- CID: 6427006
- InChiKey: JQFZHHSQMKZLRU-IUCAKERBSA-N
- InChi: InChI=1S/C12H26N6O3/c13-6-2-1-5-9(11(20)21)18-10(19)8(14)4-3-7-17-12(15)16/h8-9H,1-7,13-14H2,(H,18,19)(H,20,21)(H4,15,16,17)/t8-,9-/m0/s1
- CanoSmiles: C(CCN)CC(C(=O)O)NC(=O)C(CCCN=C(N)N)N
- IsoSmiles: C(CCN)C[C@@H](C(=O)O)NC(=O)[C@H](CCCN=C(N)N)N
