Molecule ID: 2733505

IUPAC Name: (2S)-2-amino-6-(1-aminoethylideneamino)hexanoic acid;dihydrochloride

Description: The molecule is a hydrochloride salt prepared from N(6)-acetimidoyl-L-lysine and two equivalents of hydrogen chloride. A selective inhibitor of inducible nitric oxide synthase. It has a role as an EC 1.14.13.39 (nitric oxide synthase) inhibitor. It contains a N(6)-acetimidoyl-L-lysinium(2+).

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

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

InChI: InChI=1S/C8H17N3O2.2ClH/c1-6(9)11-5-3-2-4-7(10)8(12)13;;/h7H,2-5,10H2,1H3,(H2,9,11)(H,12,13);2*1H/t7-;;/m0../s1

Molecular Properties:
- Polar Surface Area: 102.0 Ų
- LogP: nan