Molecule ID: 44232490

IUPAC Name: (2S)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-4-methylpentanoic acid

Description: The molecule is a dipeptide obtained by formal condensation of the carboxy group of L-asparagine with the amino group of L-leucine. It derives from a L-asparagine and a L-leucine.

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

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

InChI: InChI=1S/C10H19N3O4/c1-5(2)3-7(10(16)17)13-9(15)6(11)4-8(12)14/h5-7H,3-4,11H2,1-2H3,(H2,12,14)(H,13,15)(H,16,17)/t6-,7-/m0/s1

Molecular Properties:
- Polar Surface Area: 136.0 Ų
- LogP: -4.3