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SMILES: Cc1c(-c2ccccc2)n(Cc2ccc(OCCN3CCCCC3)cc2)c2ccc(O)cc12

InChI Key: InChIKey=BQYMNRMHTXRMGR-UHFFFAOYSA-N

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 129618   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Estrogen receptor


(Homo sapiens (Human))		BDBM129618
PNG
(US8815934, No. 87)
Show SMILES Cc1c(-c2ccccc2)n(Cc2ccc(OCCN3CCCCC3)cc2)c2ccc(O)cc12
Show InChI InChI=1S/C29H32N2O2/c1-22-27-20-25(32)12-15-28(27)31(29(22)24-8-4-2-5-9-24)21-23-10-13-26(14-11-23)33-19-18-30-16-6-3-7-17-30/h2,4-5,8-15,20,32H,3,6-7,16-19,21H2,1H3
PDB

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antibodypedia
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Similars
US Patent
n/an/a 30n/an/an/an/an/a4



Wyeth LLC

US Patent


Assay Description
The competition assay was performed in a 96-well plate (polystyrene*) which binds <2.0% of the total input [3H]-17beta-estradiol and each data point ...

US Patent US8815934 (2014)


BindingDB Entry DOI: 10.7270/Q2PZ57H0
More data for this
Ligand-Target Pair