Ligand name: (2S)-(4-fluorophenyl)[6-(trifluoromethyl)pyridin-2-yl]ethanenitrile
PDB ligand accession: 1OQ
DrugBank: n/a
PubChem: 74627698
ChEMBL: n/a
InChI Key: DXQNDKQUHKVTTC-NSHDSACASA-N
SMILES: c1cc(nc(c1)C(F)(F)F)C(C#N)c2ccc(cc2)F
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q9I194

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4K2G	Download	Experimental	e4k2gA1 e4k2gB1	Ntn/PP2C Ntn/PP2C	LigPlot