Ligand name: (3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-[(1,3-BENZODIOXOL-5-YLSULFONYL)(ISOBUTYL)AMINO]-2-HYDROXY-1-{4-[(2-METHYL-1,3-THIAZOL-4-YL)METHOXY]BENZYL}PROPYL]CARBAMATE
PDB ligand accession: 385
DrugBank: DB04887
PubChem: 5743186
ChEMBL: CHEMBL206031
InChI Key: JORVRJNILJXMMG-OLNQLETPSA-N
SMILES: Cc1nc(cs1)COc2ccc(cc2)CC(C(CN(CC(C)C)S(=O)(=O)c3ccc4c(c3)OCO4)O)NC(=O)OC5COC6C5CCO6
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 P03368

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2FDE	Download	Experimental	e2fdeB1 e2fdeA1	cradle loop barrel cradle loop barrel	LigPlot
2FDD	Download	Experimental	e2fddA1 e2fddB1	cradle loop barrel cradle loop barrel	LigPlot