BDBM227114 US9328096, 802

SMILES CC(C)n1nc(-c2ccc(C(F)(F)F)nc2)nc1[C@@H]1CC[C@H](N2CCCOCC2)C1

InChI Key InChIKey=LHFILMURSIFVIH-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 = 227114   

Target7-dehydrocholesterol reductase(Human)
Broad Institute

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 227114BDBM227114(4-((1S,3R)-3-(1-isopropyl-3- (6-(trifluoromethyl)p...)
Affinity DataKi:  8.28nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/21/2026
Entry Details
US Patent