BDBM83403 MLS001172165::N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-2-(2-methylphenyl)sulfanyl-ethanamide::N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-2-(2-methylphenyl)sulfanylacetamide::N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-2-(o-tolylthio)acetamide::N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-2-[(2-methylphenyl)thio]acetamide::SMR000591785::cid_4883447

SMILES Cc1ccc2[nH]c3c(=O)n(CCCC(=O)N4CCN(c5cccc(Cl)c5Cl)CC4)cnc3c2c1

InChI Key InChIKey=LZTIBBXIOUQBGU-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 = 83403   

TargetThiamine pyrophosphokinase 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 83403BDBM83403(3-(4-(4-(2,3-dichlorophenyl)piperazin-1-yl)-4-oxob...)
Affinity DataEC50:  463nMAssay 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