Ligand name: 1-{4-[(4-fluorophenyl)methyl]piperazin-1-yl}propan-1-one
PDB ligand accession: KS0
DrugBank: n/a
PubChem: 19323503
ChEMBL: CHEMBL4204455
InChI Key: DFWHOCVEAQNIBM-UHFFFAOYSA-N
SMILES: CCC(=O)N1CCN(CC1)Cc2ccc(cc2)F
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 P0DTD1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7GBA	Download	Experimental	e7gbaA1 e7gbaA2	cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain	LigPlot