IBC 293

Ligand id: 1597

Name: IBC 293

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 68.01
Molecular weight 205.09
XLogP 1.5
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Semple G, Skinner PJ, Cherrier MC, Webb PJ, Sage CR, Tamura SY, Chen R, Richman JG, Connolly DT. (2006)
1-Alkyl-benzotriazole-5-carboxylic acids are highly selective agonists of the human orphan G-protein-coupled receptor GPR109b.
J. Med. Chem., 49 (4): 1227-30. [PMID:16480258]