BW-A1433

Ligand id: 443

Name: BW-A1433

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 106.6
Molecular weight 382.16
XLogP 3.99
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Linden J, Thai T, Figler H, Jin X, Robeva AS. (1999)
Characterization of human A(2B) adenosine receptors: radioligand binding, western blotting, and coupling to G(q) in human embryonic kidney 293 cells and HMC-1 mast cells.
Mol. Pharmacol.56: 705-713. [PMID:10496952]
2. Olah ME, Jacobson KA, Stiles GL. (1994)
Role of the second extracellular loop of adenosine receptors in agonist and antagonist binding. Analysis of chimeric A1/A3 adenosine receptors.
J Biol Chem269: 24692-24698. [PMID:7929142]
3. Salvatore CA, Jacobson MA, Taylor HE, Linden J, Johnson RG. (1993)
Molecular cloning and characterization of the human A3 adenosine receptor.
Proc. Natl. Acad. Sci. U.S.A.90: 10365-10369. [PMID:8234299]