Molecule ID: 95174

IUPAC Name: 2-amino-3-(4-aminophenyl)propanoic acid

Description: The molecule is a phenylalanine derivative that is phenylalanine carrying an amino group at position 4 on the benzene ring. It is a non-proteinogenic alpha-amino acid, a phenylalanine derivative and a substituted aniline.

SMILES: Nc1ccc(CC(N)C(=O)O)cc1

SELFIES: [N][C][=C][C][=C][Branch1][O][C][C][Branch1][C][N][C][=Branch1][C][=O][O][C][=C][Ring1][N]

InChI: InChI=1S/C9H12N2O2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,10-11H2,(H,12,13)

Molecular Properties:
- Polar Surface Area: 89.3 Ų
- LogP: -2.2