Phenylalanylglycine | SBID = 1640 | Compound |
Structure
Molecular Properties
| Interactions: | 3 | ||
| PubChem TPSA/Å2: | 92.4 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | -2.5 | ||
| 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: | 173.1 | ||
| Sum Formula: | C11H14N2O3 | ||
| M / g/mol: | 222.24 | ||
| Complexity: | 250.0 | ||
| Number of Conformers: | 10.0 |
Identifiers
- Tags: aromatic, typical guest, amino acid
- Name: Phenylalanylglycine
- Preferred Abbreviation: L-Phe-Gly
- IUPAC Name: 2-[(2-amino-3-phenylpropanoyl)amino]acetic acid
- CAS: 721-90-4
- CID: 98207
- InChiKey: GLUBLISJVJFHQS-UHFFFAOYSA-N
- InChi: InChI=1S/C11H14N2O3/c12-9(11(16)13-7-10(14)15)6-8-4-2-1-3-5-8/h1-5,9H,6-7,12H2,(H,13,16)(H,14,15)
- CanoSmiles: C1=CC=C(C=C1)CC(C(=O)NCC(=O)O)N
- IsoSmiles: C1=CC=C(C=C1)CC(C(=O)NCC(=O)O)N
