Molecule ID: 129320266

IUPAC Name: (2R,5S)-2,5-bis(azaniumyl)hexanoate

Description: The molecule is an alpha-amino-acid cation obtained by deprotonation of the carboxy group and protonation of the amino groups of (2R,5S)-2,5-diaminohexanoic acid; major species at pH 7.3. It is a conjugate acid of a (2R,5S)-2,5-diaminohexanoic acid.

SMILES: C[C@H]([NH3+])CC[C@@H](N)C(=O)O

SELFIES: [C][C@H1][Branch1][C][NH3+1][C][C][C@@H1][Branch1][C][N][C][=Branch1][C][=O][O]

InChI: InChI=1S/C6H14N2O2/c1-4(7)2-3-5(8)6(9)10/h4-5H,2-3,7-8H2,1H3,(H,9,10)/p+1/t4-,5+/m0/s1

Molecular Properties:
- Polar Surface Area: 95.4 Ų
- LogP: -2.5