compound 24d [PMID: 23357634]

Ligand id: 6366

Name: compound 24d [PMID: 23357634]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 50.69
Molecular weight 306.11
XLogP 3.24
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Zhou H, Topiol SW, Grenon M, Jimenez HN, Uberti MA, Smith DG, Brodbeck RM, Chandrasena G, Pedersen H, Madsen JC et al.. (2013)
Discovery and structure-activity relationship of 1,3-cyclohexyl amide derivatives as novel mGluR5 negative allosteric modulators.
Bioorg. Med. Chem. Lett., 23 (5): 1398-406. [PMID:23357634]