Ligand name: (6S)-6-(4-cyano-2-methylsulfonyl-phenyl)-4-methyl-2-oxidanylidene-3-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carbonitrile
PDB ligand accession: JJV
DrugBank: n/a
PubChem: 42642360
ChEMBL: CHEMBL3617972
InChI Key: WQASVWJQEKONLG-LJQANCHMSA-N
SMILES: CC1=C(C(NC(=O)N1c2cccc(c2)C(F)(F)F)c3ccc(cc3S(=O)(=O)C)C#N)C#N
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P08246

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5A0C	Download	Experimental	e5a0cA1 e5a0cB1	cradle loop barrel cradle loop barrel	LigPlot