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SMILES: CCN(CC)C(=O)C1CCCN(C1)C(=O)c1cc(N)c2nc(nn2c1)-c1ccc(Br)o1

InChI Key: InChIKey=BQRGSPQJKCXBSD-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50147667   
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))		BDBM50147667
PNG
(1-[8-Amino-2-(5-bromo-furan-2-yl)-[1,2,4]triazolo[...)
Show SMILES CCN(CC)C(=O)C1CCCN(C1)C(=O)c1cc(N)c2nc(nn2c1)-c1ccc(Br)o1
Show InChI InChI=1S/C21H25BrN6O3/c1-3-26(4-2)20(29)13-6-5-9-27(11-13)21(30)14-10-15(23)19-24-18(25-28(19)12-14)16-7-8-17(22)31-16/h7-8,10,12-13H,3-6,9,11,23H2,1-2H3
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Article
PubMed
 40n/an/an/an/an/an/an/an/a



F. Hoffmann-LaRoche Ltd

Curated by ChEMBL


Assay Description
Binding affinity against human Adenosine A2a receptor (hA2a)

Bioorg Med Chem Lett 14: 3307-12 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.104
BindingDB Entry DOI: 10.7270/Q2VD6XWM
More data for this
Ligand-Target Pair