Ligand id: 3388


Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 97.03
Molecular weight 292.08
XLogP 0.83
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Bonnefous C, Vernier JM, Hutchinson JH, Chung J, Reyes-Manalo G, Kamenecka T. (2005)
Dipyridyl amides: potent metabotropic glutamate subtype 5 (mGlu5) receptor antagonists.
Bioorg. Med. Chem. Lett., 15 (4): 1197-200. [PMID:15686941]