Ligand name: 4-(3-chloro-5-cyanophenoxy)-3-[2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)ethoxy]phenyl sulfurofluoridate
PDB ligand accession: X2S
DrugBank: n/a
PubChem: 155804596
ChEMBL: CHEMBL4749553
InChI Key: RUICQBSNQUGNNJ-UHFFFAOYSA-N
SMILES: c1cc(c(cc1OS(=O)(=O)F)OCCN2C=CC(=O)NC2=O)Oc3cc(cc(c3)Cl)C#N
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P03366

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7KRD	Download	Experimental	e7krdA3 e7krdA4 e7krdB3	Alpha-beta plaits Ribonuclease H-like Alpha-beta plaits	LigPlot