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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50104996   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Endothelin-1 receptor


(Sus scrofa)		BDBM50104996
PNG
(4-Bromo-N-{6-[2-(5-bromo-pyrimidin-2-yloxy)-ethoxy...)
Show SMILES Cc1ccc(cc1)-c1c(NS(=O)(=O)c2ccc(Br)cc2)ncnc1OCCOc1ncc(Br)cn1
Show InChI InChI=1S/C23H19Br2N5O4S/c1-15-2-4-16(5-3-15)20-21(30-35(31,32)19-8-6-17(24)7-9-19)28-14-29-22(20)33-10-11-34-23-26-12-18(25)13-27-23/h2-9,12-14H,10-11H2,1H3,(H,28,29,30)
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PubMed
n/an/a 2.80n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of [125I]-ET-1 binding to Endothelin A receptor in porcine aortic membrane from endothelial cells

J Med Chem 44: 3355-68 (2001)


BindingDB Entry DOI: 10.7270/Q2QN662B
More data for this
Ligand-Target Pair