Phenylalanine; (±)-form, Amide
AlkaPlorer ID: AK309976
Synonym: None
IUPAC Name: 2-amino-3-phenylpropanamide
Structure
SMILES: NC(=O)C(N)CC1=CC=CC=C1
InChI: InChI=1S/C9H12N2O/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H2,11,12)
InChIKey: OBSIQMZKFXFYLV-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Trifolium repens | Trifolium | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 164.208
TPSA？: 69.11
MolLogP？: 0.0417
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| None | ADMET | Binding energy | 6.1 | kCal mol-1 | 10.1021/jm00378a021 |
| None | Unchecked | Ki | 14100000.0 | nM | 10.1021/jm00151a018 |
| None | Unchecked | Ki | 14800000.0 | nM | 10.1021/jm00151a018 |