Ligand name: S-[5-(TRIFLUOROMETHYL)-4H-1,2,4-TRIAZOL-3-YL] 5-(PHENYLETHYNYL)FURAN-2-CARBOTHIOATE
PDB ligand accession: F3F
DrugBank: DB07743
PubChem: 2822496
ChEMBL: CHEMBL379642
InChI Key: VNGWUVBXUIDQTK-UHFFFAOYSA-N
SMILES: c1ccc(cc1)C#Cc2ccc(o2)C(=O)Sc3[nH]c(nn3)C(F)(F)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Furans
      • Subclass: Furoic acid and derivatives

List of PDB structures and/or AlphaFold models with target protein P59641

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2GZ8	Download	Experimental	e2gz8A1 e2gz8A2	cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain	LigPlot