BDBM77604 3-hydroxy-2-[5-[4-(trifluoromethyl)phenyl]-2-furanyl]-1,2-dihydroquinazolin-4-one::3-hydroxy-2-[5-[4-(trifluoromethyl)phenyl]-2-furyl]-1,2-dihydroquinazolin-4-one::3-hydroxy-2-[5-[4-(trifluoromethyl)phenyl]furan-2-yl]-1,2-dihydroquinazolin-4-one::3-oxidanyl-2-[5-[4-(trifluoromethyl)phenyl]furan-2-yl]-1,2-dihydroquinazolin-4-one::MLS002276542::SMR001318080::cid_44142081

SMILES O=C(C1CN(CCCF)C1)N1CCC2CC1c1cc(-c3ccc(C(F)(F)F)cc3)ccc12

InChI Key InChIKey=OGKSELHIGPDNEA-UHFFFAOYSA-N

Data  1 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 = 77604   

TargetSigma intracellular receptor 2(Human)
University of Texas System

US Patent
LigandChemical structure of BindingDB Monomer ID 77604BDBM77604(US20250387403, Example Table1.19)
Affinity DataKi:  14.7nMAssay Description:Keywords: apoptosis, BH3 domain, Bcl2-A1, BIM, caspase, cancer Primary Collaborator: Todd Golub, Broad Institute, golub@broadinstitute.org Assay Over...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2026
Entry Details
US Patent