Ligand name: 1-[4-(3-phenylpropyl)piperazin-1-yl]ethan-1-one
PDB ligand accession: O3J
DrugBank: n/a
PubChem: 21993825
ChEMBL: CHEMBL5439703
InChI Key: XQYKCRQRBYLELO-UHFFFAOYSA-N
SMILES: CC(=O)N1CCN(CC1)CCCc2ccccc2
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein A0A3L6KZJ1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5S9Z	Download	Experimental	e5s9zA1 e5s9zB3 e5s9zA2 e5s9zB2	FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like	LigPlot