Ligand name: 1-[(5S)-5-(3,4-dimethoxyphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
PDB ligand accession: SRU
DrugBank: n/a
PubChem: 93117866
ChEMBL: n/a
InChI Key: FOIXJKJVLPARQZ-KRWDZBQOSA-N
SMILES: CC(=O)N1C(CC(=N1)c2ccccc2)c3ccc(c(c3)OC)OC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Methoxybenzenes

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
8DLB	Download	Experimental	e8dlbA1 e8dlbA2	cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain	LigPlot