Ligand name: 1-ISOBUTOXY-2-PYRROLIDINO-3[N-BENZYLANILINO] PROPANE
PDB ligand accession: BEP
DrugBank: DB01244
PubChem: 445143
ChEMBL: CHEMBL251075
InChI Key: UIEATEWHFDRYRU-DEOSSOPVSA-N
SMILES: CC(C)COCC(CN(Cc1ccccc1)c2ccccc2)N3CCCC3
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q6P988

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7BLI	Download	Experimental	e7bliA1	alpha/beta-Hydrolases	LigPlot