Ligand name: 2-((4H-1,2,4-triazol-3-yl)thio)-1-(4-(3-chlorophenyl)piperazin-1-yl)ethan-1-one
PDB ligand accession: I2W
DrugBank: n/a
PubChem: 9290078
ChEMBL: n/a
InChI Key: RMTODJAENUIFJI-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)Cl)N2CCN(CC2)C(=O)CSc3nc[nH]n3
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazinanes
      • Subclass: Piperazines

List of PDB structures and/or AlphaFold models with target protein Q9UJM8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7R4O	Download	Experimental	e7r4oA1	TIM beta/alpha-barrel	LigPlot