Molecule ID: 137553775

IUPAC Name: (2S)-2,6-bis(azaniumyl)-4-chlorohexanoate

Description: The molecule is an alpha-amino-acid cation that is the conjugate acid of 4-chloro-L-lysine zwitterion; major species at pH 7.3. It is a conjugate acid of a 4-chloro-L-lysine zwitterion.

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

SELFIES: [N][C@@H1][Branch1][=Branch2][C][C][Branch1][C][Cl][C][C][NH3+1][C][=Branch1][C][=O][O]

InChI: InChI=1S/C6H13ClN2O2/c7-4(1-2-8)3-5(9)6(10)11/h4-5H,1-3,8-9H2,(H,10,11)/p+1/t4?,5-/m0/s1

Molecular Properties:
- Polar Surface Area: 95.4 Ų
- LogP: -2.3