Ligand name: N~2~-acetyl-N-[(2S,3R)-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}-1-phenylbutan-2-yl]-L-isoleucinamide
PDB ligand accession: A68
DrugBank: n/a
PubChem: 56973521
ChEMBL: n/a
InChI Key: SMFNBADPJMISMS-PSRPIYIESA-N
SMILES: CCC(C)C(C(=O)NC(Cc1ccccc1)C(CN(CC(C)C)S(=O)(=O)c2ccc(cc2)OC)O)NC(=O)C

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of proteins that are targets for A68

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	O38732_A68	O38732	n/a