Molecule ID: 2733506

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

Description: The molecule is an L-lysine derivative that is L-lysine in which one of the hydrogens attached to N(6) is substituted by an acetimidoyl group It is a L-lysine derivative and a non-proteinogenic L-alpha-amino acid. It is a conjugate acid of a N(6)-acetimidoyl-L-lysinium(2+).

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

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

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

Molecular Properties:
- Polar Surface Area: 102.0 Ų
- LogP: -3.1