BDBM83452 (+)--alpha--Propoxyphene hydrochloride::MLS002320725::SMR001338871::[(3R)-4-(dimethylamino)-3-methyl-1,2-diphenyl-butan-2-yl] propanoate;hydrochloride::[(3R)-4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] propanoate;hydrochloride::cid_44246734::propanoic acid [(3R)-4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] ester;hydrochloride::propionic acid [(2R)-1-benzyl-3-(dimethylamino)-2-methyl-1-phenyl-propyl] ester;hydrochloride

SMILES O=C1Cc2ccc(OCCCN3c4ccccc4Sc4ccccc43)cc2N1

InChI Key InChIKey=XQCUTUBFEBDYFO-UHFFFAOYSA-N

Data  1 EC50

  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 = 83452   

TargetThiamine pyrophosphokinase 1(Human)
Shanghai Raising Pharmaceutical Co.

US Patent
LigandChemical structure of BindingDB Monomer ID 83452BDBM83452(US20250388584, Example 190)
Affinity DataEC50:  1.11E+3nMAssay 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