BDBM50149061 (2S,3R)-3-(4-Hydroxy-phenyl)-2-(4-piperazin-1-yl-phenyl)-2,3-dihydro-benzo[1,4]oxathiin-6-ol::CHEMBL332625

SMILES Oc1ccc(cc1)[C@H]1Sc2cc(O)ccc2O[C@H]1c1ccc(cc1)N1CCNCC1

InChI Key InChIKey=ODYADVKZTZANGH-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50149061   

TargetEstrogen receptor(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50149061((2S,3R)-3-(4-Hydroxy-phenyl)-2-(4-piperazin-1-yl-p...)
Affinity DataIC50: 4.40nMAssay Description:Binding affinity for human estrogen receptor alphaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetEstrogen receptor beta(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50149061((2S,3R)-3-(4-Hydroxy-phenyl)-2-(4-piperazin-1-yl-p...)
Affinity DataIC50: 186nMAssay Description:Binding affinity for human estrogen receptor betaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed