Ligand name: (3aS,4S,7aR)-hexahydro-4H-furo[2,3-b]pyran-4-yl {(2S,3R)-1-(3,5-difluorophenyl)-3-hydroxy-4-[(2-methylpropyl)({2-[(propan-2-yl)amino]-1,3-benzothiazol-6-yl}sulfonyl)amino]butan-2-yl}carbamate
PDB ligand accession: QJY
DrugBank: n/a
PubChem: 154815593
ChEMBL: n/a
InChI Key: QXYZQWZEXVYYJE-JMLJTDODSA-N
SMILES: CC(C)CN(CC(C(Cc1cc(cc(c1)F)F)NC(=O)OC2CCOC3C2CCO3)O)S(=O)(=O)c4ccc5c(c4)sc(n5)NC(C)C
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein C8B467

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6UWB	Download	Experimental	e6uwbA1 e6uwbB1	cradle loop barrel cradle loop barrel	LigPlot