dl-leucylglycyl-dl-phenylalanine | SBID = 1634 | Compound |
Structure
Molecular Properties
| Interactions: | 2 | ||
| PubChem TPSA/Å2: | 122.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | -1.5 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 4.0 | ||
| Number of H-Bond Acceptors: | 5.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 2.0 | ||
| 3D Volume/Å3: | 265.8 | ||
| Sum Formula: | C17H25N3O4 | ||
| M / g/mol: | 335.4 | ||
| Complexity: | 434.0 | ||
| Number of Conformers: | 10.0 |
Identifiers
- Tags:
- Name: dl-leucylglycyl-dl-phenylalanine
- Preferred Abbreviation: dl-Leu-Gly-dl-Phe
- IUPAC Name: 2-[[2-[(2-amino-4-methylpentanoyl)amino]acetyl]amino]-3-phenylpropanoic acid
- CAS: 4294-25-1
- CID: 274161
- InChiKey: KEVYYIMVELOXCT-UHFFFAOYSA-N
- InChi: InChI=1S/C17H25N3O4/c1-11(2)8-13(18)16(22)19-10-15(21)20-14(17(23)24)9-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10,18H2,1-2H3,(H,19,22)(H,20,21)(H,23,24)
- CanoSmiles: CC(C)CC(C(=O)NCC(=O)NC(CC1=CC=CC=C1)C(=O)O)N
- IsoSmiles: CC(C)CC(C(=O)NCC(=O)NC(CC1=CC=CC=C1)C(=O)O)N
