Ligand name: (R)-2-(3-(3-((2,4-DIFLUOROPENYL)ETHYNYL)BENZOYL)-3-PROPYLUREIDO)-3-(ISOBUTYLTHIO) PROPANOIC ACID
PDB ligand accession: X0D
DrugBank: n/a
PubChem: 72715983
ChEMBL: CHEMBL3125475
InChI Key: KBNODIQMRDIBMX-QHCPKHFHSA-N
SMILES: CCCN(C(=O)c1cccc(c1)C#Cc2ccc(cc2F)F)C(=O)NC(CSCC(C)C)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q07817

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4C52	Download	Experimental	e4c52A1 e4c52B1	Toxins' membrane translocation domains Toxins' membrane translocation domains	LigPlot