Ligand name: (2S)-(4-chlorophenyl)(6-chloropyridin-2-yl)ethanenitrile
PDB ligand accession: A08
DrugBank: n/a
PubChem: 1488448
ChEMBL: n/a
InChI Key: KFUYTJBERFHHIL-NSHDSACASA-N
SMILES: c1cc(nc(c1)Cl)C(C#N)c2ccc(cc2)Cl
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
4K2F	Download	Experimental	e4k2fA1 e4k2fB1	Ntn/PP2C Ntn/PP2C	LigPlot