BDBM100216 (3aS,5S,9aS)-5-(1-benzofuran-2-yl)-2-phenyl-3a,4,5,7,8,9-hexahydro-3H-pyrrolo[3,4-h]pyrrolizin-1-one::(3aS,5S,9aS)-5-(1-benzofuran-2-yl)-2-phenylhexahydro-7H-pyrrolo[3,4-g]pyrrolizin-1(2H)-one::(3aS,5S,9aS)-5-(2-benzofuranyl)-2-phenyl-3a,4,5,7,8,9-hexahydro-3H-pyrrolo[3,4-h]pyrrolizin-1-one::(3aS,5S,9aS)-5-(benzofuran-2-yl)-2-phenyl-3a,4,5,7,8,9-hexahydro-3H-pyrrolo[3,4-h]pyrrolizin-1-one::MLS000734694::SMR000317954::cid_16188788

SMILES CNCc1cc(-c2ccc(OC(C)c3cc(F)cc(F)c3)cc2F)n(S(=O)(=O)c2cccc(OCCCOC)c2)c1

InChI Key InChIKey=JEEXQVRJRBVNDW-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 100216   

LigandChemical structure of BindingDB Monomer ID 100216BDBM100216(US20260001864, Compound 89)
Affinity DataIC50: 1.33E+3nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/13/2026
Entry Details
US Patent