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SMILES: CCOc1cccc(OCCSc2nc3ccccc3n2CCOc2ccc(C)cc2)c1

InChI Key: InChIKey=YPKXOUWDTKDPOW-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50425775   
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
Androgen receptor


(Homo sapiens (Human))		BDBM50425775
PNG
(CHEMBL2316563)
Show SMILES CCOc1cccc(OCCSc2nc3ccccc3n2CCOc2ccc(C)cc2)c1
Show InChI InChI=1S/C26H28N2O3S/c1-3-29-22-7-6-8-23(19-22)31-17-18-32-26-27-24-9-4-5-10-25(24)28(26)15-16-30-21-13-11-20(2)12-14-21/h4-14,19H,3,15-18H2,1-2H3
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Article
PubMed
n/an/a 2.28E+4n/an/an/an/an/an/a



University of British Columbia

Curated by ChEMBL


Assay Description
Inhibition of BF3 site of androgen receptor in human LNCAP cells expressing ARR2PB after 3 days by eGFP transcriptional assay

J Med Chem 56: 1136-48 (2013)


Article DOI: 10.1021/jm3015712
BindingDB Entry DOI: 10.7270/Q2ZW1N7N
More data for this
Ligand-Target Pair