Molecule ID: 160635

IUPAC Name: (2S)-2-amino-3-(diaminomethylideneamino)propanoic acid

Description: The molecule is a L-alanine derivative in which one of the methyl hydrogens of L-alanine has been replaced by a guanidino group. It has a role as a Brassica napus metabolite. It is a L-alanine derivative, a non-proteinogenic L-alpha-amino acid and a member of guanidines.

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

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

InChI: InChI=1S/C4H10N4O2/c5-2(3(9)10)1-8-4(6)7/h2H,1,5H2,(H,9,10)(H4,6,7,8)/t2-/m0/s1

Molecular Properties:
- Polar Surface Area: 128.0 Ų
- LogP: -4.9