Ligand name: (3S)-3-(3-chlorophenyl)-1-(isoquinolin-4-yl)pyrrolidin-2-one
PDB ligand accession: QC3
DrugBank: n/a
PubChem: 156906650
ChEMBL: n/a
InChI Key: RNKBROMGPBKNFK-KRWDZBQOSA-N
SMILES: c1ccc2c(c1)cncc2N3CCC(C3=O)c4cccc(c4)Cl
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrrolidines
      • Subclass: Phenylpyrrolidines

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
7GHO	Download	Experimental	e7ghoA1 e7ghoA2 e7ghoB1 e7ghoA2 e7ghoB1 e7ghoB2	Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain	LigPlot
7GK5	Download	Experimental	e7gk5A1 e7gk5A2 e7gk5B2 e7gk5A2 e7gk5B1 e7gk5B2	Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel cradle loop barrel cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel	LigPlot