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SMILES: CS(O)(=O)=O.COc1ccc(cc1)C1=C(C(=O)c2ccc(OCCN3CCCC3)cc2)c2ccccc2CC1

InChI Key: InChIKey=RAHJASYQAFJPFD-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50009716   
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


(RAT)		BDBM50009716
PNG
(Compound 133314 | TRIOXIFENE MESYLATE)
Show SMILES CS(O)(=O)=O.COc1ccc(cc1)C1=C(C(=O)c2ccc(OCCN3CCCC3)cc2)c2ccccc2CC1 |c:13|
Show InChI InChI=1S/C30H31NO3.CH4O3S/c1-33-25-13-8-23(9-14-25)28-17-12-22-6-2-3-7-27(22)29(28)30(32)24-10-15-26(16-11-24)34-21-20-31-18-4-5-19-31;1-5(2,3)4/h2-3,6-11,13-16H,4-5,12,17-21H2,1H3;1H3,(H,2,3,4)
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PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 1.70n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [2,4,6,7-3H]-estradiol from estrogen receptor in immature rat uterine cytosol by dextran-coated charcoal-adsorption assay

J Med Chem 22: 962-6 (1979)


BindingDB Entry DOI: 10.7270/Q24B32T1
More data for this
Ligand-Target Pair