BDBM40506 1-[2,5-dimethyl-1-(2-thenyl)pyrrol-3-yl]-2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]ethanone::1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)-3-pyrrolyl]-2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]ethanone::1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone::MLS000056077::SMR000067181::cid_3000148

SMILES COc1ccc(cc1)-c1nnc(SCC(=O)c2cc(C)n(Cc3cccs3)c2C)o1

InChI Key InChIKey=JGRUTEFDDMITEO-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 = 40506   

TargetEstrogen receptor(Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM40506(1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl...)
Affinity DataEC50:  7.51E+3nMAssay 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:
5/6/2011
Entry Details
PCBioAssay