Ligand name: 2-benzyl-1-phenyl-3-(piperazin-1-ylcarbonyl)-1H-indole
PDB ligand accession: S51
DrugBank: n/a
PubChem: 46912134
ChEMBL: CHEMBL1235802
InChI Key: FYDPGAJRQXSCCK-UHFFFAOYSA-N
SMILES: c1ccc(cc1)Cc2c(c3ccccc3n2c4ccccc4)C(=O)N5CCNCC5
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Indoles and derivatives
      • Subclass: Indolecarboxylic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein P00797

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3OQF	Download	Experimental	e3oqfA2 e3oqfA3 e3oqfB2 e3oqfB3	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot