BDBM19970 (2S)-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-6-ol::Benzopyran derivative., 4a(racemate)::racemic mixture

SMILES Oc1ccc(cc1)[C@@H]1CCc2cc(O)ccc2O1

InChI Key InChIKey=PULOCCRMJJNDDU-UHFFFAOYSA-N

Data  2 KI

  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 2 hits for monomerid = 19970   

TargetEstrogen receptor beta(Human)
Eli Lilly

LigandPNGBDBM19970(racemic mixture | (2S)-2-(4-hydroxyphenyl)-3,4-dih...)
Affinity DataKi:  20.8nM ΔG°:  -10.4kcal/molepH: 7.5 T: 2°CAssay Description:The binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer. The Kd for 3H-estradiol was determin...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/6/2008
Entry Details Article
PubMed
TargetEstrogen receptor(Human)
Eli Lilly

LigandPNGBDBM19970(racemic mixture | (2S)-2-(4-hydroxyphenyl)-3,4-dih...)
Affinity DataKi:  126nM ΔG°:  -9.31kcal/molepH: 7.5 T: 2°CAssay Description:The binding affinities were determined by a competitive radiometric binding assay using [3H]estradiol as tracer. The Kd for 3H-estradiol was determin...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/6/2008
Entry Details Article
PubMed