Molecule ID: 439918

IUPAC Name: (2S)-2-(diaminomethylideneamino)butanedioic acid

Description: The molecule is an aspartic acid derivative comprising L-aspartic acid carrying an N-amidino substituent. It is a L-aspartic acid derivative and a N-amidinoaspartic acid. It is a conjugate acid of a N-amidino-L-aspartate(1-) and a N-amidino-L-aspartate(2-).

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

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

InChI: InChI=1S/C5H9N3O4/c6-5(7)8-2(4(11)12)1-3(9)10/h2H,1H2,(H,9,10)(H,11,12)(H4,6,7,8)/t2-/m0/s1

Molecular Properties:
- Polar Surface Area: 139.0 Ų
- LogP: -2.0