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BDBM50062854 8-Cyclopentyl-7-methyl-1-propyl-3,7-dihydro-purine-2,6-dione::CHEMBL356239

SMILES: CCCn1c(=O)[nH]c2nc(C3CCCC3)n(C)c2c1=O

InChI Key: InChIKey=NWNYVXAOYLYJOB-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50062854   
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 A1 receptor


(BOVINE)
BDBM50062854
PNG
(8-Cyclopentyl-7-methyl-1-propyl-3,7-dihydro-purine...)
Show SMILES CCCn1c(=O)[nH]c2nc(C3CCCC3)n(C)c2c1=O
Show InChI InChI=1S/C14H20N4O2/c1-3-8-18-13(19)10-11(16-14(18)20)15-12(17(10)2)9-6-4-5-7-9/h9H,3-8H2,1-2H3,(H,16,20)
PDB

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Similars

Article
PubMed
149n/an/an/an/an/an/an/an/a



Forschungszentrum Jülich GmbH

Curated by ChEMBL


Assay Description
Displacement of [3H]-CPX from Adenosine A1 receptor of bovine brain cerebral cortex membranes


J Med Chem 41: 555-63 (1998)


Article DOI: 10.1021/jm9705465
BindingDB Entry DOI: 10.7270/Q2RX9B60
More data for this
Ligand-Target Pair