Molecule ID: 440638

IUPAC Name: (2S)-6-amino-2-(3-aminopropanoylamino)hexanoic acid

Description: The molecule is a dipeptide consisting of beta-alanine and L-lysine units joined by a peptide linkage. It is a tautomer of a beta-alanyl-L-lysine zwitterion.

SMILES: NCCCC[C@H](N=C(O)CCN)C(=O)O

SELFIES: [N][C][C][C][C][C@H1][Branch1][=Branch2][N][=C][Branch1][C][O][C][C][N][C][=Branch1][C][=O][O]

InChI: InChI=1S/C9H19N3O3/c10-5-2-1-3-7(9(14)15)12-8(13)4-6-11/h7H,1-6,10-11H2,(H,12,13)(H,14,15)/t7-/m0/s1

Molecular Properties:
- Polar Surface Area: 118.0 Ų
- LogP: -5.5