BDBM42006 3-[4-[4-(3-chlorophenyl)-1-piperazinyl]-4-oxobutyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylic acid methyl ester::3-[4-[4-(3-chlorophenyl)piperazino]-4-keto-butyl]-4-keto-2-thioxo-1H-quinazoline-7-carboxylic acid methyl ester::AS-927-43a::cid_24178254::methyl 3-[4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxylate::methyl 3-[4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxobutyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylate

SMILES COC(=O)c1ccc2c(c1)[nH]c(=S)n(CCCC(=O)N1CCN(CC1)c1cccc(Cl)c1)c2=O

InChI Key InChIKey=KHNZWCZAOIPXTH-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 = 42006   

TargetEstrogen receptor(Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM42006(methyl 3-[4-[4-(3-chlorophenyl)piperazin-1-yl]-4-o...)
Affinity DataIC50: 1.88E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2011
Entry Details
PCBioAssay