Molecule ID: 25245433

IUPAC Name: (3R)-3,6-bis(azaniumyl)hexanoate

Description: The molecule is an amino-acid cation that is the conjugate acid of 3,6-diaminohexanoic acid resulting from protonation of both amino groups and deprotonation of the carboxy group; major species at pH 7.3. It is a conjugate acid of a (3R)-3,6-diaminohexanoic acid.

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

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

InChI: InChI=1S/C6H14N2O2/c7-3-1-2-5(8)4-6(9)10/h5H,1-4,7-8H2,(H,9,10)/p+1/t5-/m1/s1

Molecular Properties:
- Polar Surface Area: 95.4 Ų
- LogP: -3.0