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SMILES: COCCOc1ccc(cc1)N1CCN(CCOc2cc3nc(nn3c(N)n2)-c2ccc(Cl)o2)CC1

InChI Key: InChIKey=KJQHWCLBOHLQRT-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50256364   
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
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50256364
PNG
(2-(5-chlorofuran-2-yl)-7-(2-(4-(4-(2-methoxyethoxy...)
Show SMILES COCCOc1ccc(cc1)N1CCN(CCOc2cc3nc(nn3c(N)n2)-c2ccc(Cl)o2)CC1
Show InChI InChI=1S/C24H28ClN7O4/c1-33-14-15-34-18-4-2-17(3-5-18)31-10-8-30(9-11-31)12-13-35-22-16-21-27-23(19-6-7-20(25)36-19)29-32(21)24(26)28-22/h2-7,16H,8-15H2,1H3,(H2,26,28)
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Article
PubMed
 40n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Displacement of [3H]SCH58261 from human adenosine A2A receptor expressed in HEK293 cells

Bioorg Med Chem Lett 19: 967-71 (2009)


Article DOI: 10.1016/j.bmcl.2008.11.075
BindingDB Entry DOI: 10.7270/Q2CC10KT
More data for this
Ligand-Target Pair