Ligand id: 5618

Name: KF26777

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 67.97
Molecular weight 373.05
XLogP 4.65
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Saki M, Tsumuki H, Nonaka H, Shimada J, Ichimura M. (2002)
KF26777 (2-(4-bromophenyl)-7,8-dihydro-4-propyl-1H-imidazo[2,1-i]purin-5(4H)-one dihydrochloride), a new potent and selective adenosine A3 receptor antagonist.
Eur. J. Pharmacol., 444 (3): 133-41. [PMID:12063073]