Ligand name: 1-[(3S)-4-[(3-chlorophenyl)methyl]-3-(2-methylpropyl)piperazin-1-yl]ethan-1-one
PDB ligand accession: KSI
DrugBank: n/a
PubChem: 169452750
ChEMBL: n/a
InChI Key: NQWZHKWPOKKPNU-KRWDZBQOSA-N
SMILES: CC(C)CC1CN(CCN1Cc2cccc(c2)Cl)C(=O)C
Drug action: n/a

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
7GBB	Download	Experimental	e7gbbA1 e7gbbA2	cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain	LigPlot