Glycyl-l-valine | SBID = 1394 | Compound |
Structure
Molecular Properties
| Interactions: | 4 | ||
| PubChem TPSA/Å2: | 92.4 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | -2.7 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 3.0 | ||
| Number of H-Bond Acceptors: | 4.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 1.0 | ||
| 3D Volume/Å3: | 134.9 | ||
| Sum Formula: | C7H14N2O3 | ||
| M / g/mol: | 174.2 | ||
| Complexity: | 180.0 | ||
| Number of Conformers: | 10.0 |
Identifiers
- Tags: peptide, typical guest
- Name: Glycyl-l-valine
- Preferred Abbreviation: Gly-L-Val
- IUPAC Name: (2S)-2-[(2-aminoacetyl)amino]-3-methylbutanoic acid
- CAS: 1963-21-9
- CID: 2724807
- InChiKey: STKYPAFSDFAEPH-LURJTMIESA-N
- InChi: InChI=1S/C7H14N2O3/c1-4(2)6(7(11)12)9-5(10)3-8/h4,6H,3,8H2,1-2H3,(H,9,10)(H,11,12)/t6-/m0/s1
- CanoSmiles: CC(C)C(C(=O)O)NC(=O)CN
- IsoSmiles: CC(C)[C@@H](C(=O)O)NC(=O)CN
