Ligand name: 1-{4-[(thiophen-3-yl)methyl]piperazin-1-yl}ethan-1-one
PDB ligand accession: T84
DrugBank: n/a
PubChem: 40004840
ChEMBL: n/a
InChI Key: GHWOPOKXTBUQPP-UHFFFAOYSA-N
SMILES: CC(=O)N1CCN(CC1)Cc2ccsc2
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic nitrogen compounds
    • Class: Organonitrogen compounds
      • Subclass: Amines

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
5RFS	Download	Experimental	e5rfsA1 e5rfsA2	cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain	LigPlot