Ligand name: 4-ethoxybenzoic acid
PDB ligand accession: 81J
DrugBank: n/a
PubChem: 12093
ChEMBL: CHEMBL324769
InChI Key: SHSGDXCJYVZFTP-UHFFFAOYSA-N
SMILES: CCOc1ccc(cc1)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Benzoic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein Q2IU02

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5U6T	Download	Experimental	e5u6tA1	Cytochrome P450	LigPlot