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SMILES: COc1cccc(c1)-n1c2nc(NC3CC3)ncc2n(C(C)c2ccccc2)c1=O

InChI Key: InChIKey=YVTRRGUYCMDLRM-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50248435   
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))		BDBM50248435
PNG
(2-(cyclopropylamino)-9-(3-methoxyphenyl)-7-(1-phen...)
Show SMILES COc1cccc(c1)-n1c2nc(NC3CC3)ncc2n(C(C)c2ccccc2)c1=O
Show InChI InChI=1S/C23H23N5O2/c1-15(16-7-4-3-5-8-16)27-20-14-24-22(25-17-11-12-17)26-21(20)28(23(27)29)18-9-6-10-19(13-18)30-2/h3-10,13-15,17H,11-12H2,1-2H3,(H,24,25,26)
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Article
PubMed
 359n/an/an/an/an/an/an/an/a



Pharmacopeia, Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]SCH-58261 from human recombinant adenosine A2A receptor expressed in HEK293 cells

Bioorg Med Chem Lett 19: 1399-402 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.042
BindingDB Entry DOI: 10.7270/Q26973F9
More data for this
Ligand-Target Pair