Ligand name: 2-fluoranyl-5-[2-[(4~{S})-4-[4-methyl-1,1-bis(oxidanylidene)thian-4-yl]-2-oxidanylidene-pyrrolidin-1-yl]ethoxy]benzenecarbonitrile
PDB ligand accession: 7BR
DrugBank: n/a
PubChem: 122707120
ChEMBL: CHEMBL3922315
InChI Key: SYEMWCXBADSSGE-OAHLLOKOSA-N
SMILES: CC1(CCS(=O)(=O)CC1)C2CC(=O)N(C2)CCOc3ccc(c(c3)C#N)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Phenol ethers
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q13093

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5LZ9	Download	Experimental	e5lz9A1	alpha/beta-Hydrolases	LigPlot