CYM5181

Ligand id: 2927

Name: CYM5181

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 6
Topological polar surface area 70.27
Molecular weight 311.13
XLogP 3.44
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Gonzalez-Cabrera PJ, Jo E, Sanna MG, Brown S, Leaf N, Marsolais D, Schaeffer MT, Chapman J, Cameron M, Guerrero M et al.. (2008)
Full pharmacological efficacy of a novel S1P1 agonist that does not require S1P-like headgroup interactions.
Mol. Pharmacol.74 (5): 1308-18. [PMID:18708635]