compound 11c [PMID: 17929793]

Ligand id: 6343

Name: compound 11c [PMID: 17929793]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 92.12
Molecular weight 352.1
XLogP 1.37
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Wu WL, Burnett DA, Domalski M, Greenlee WJ, Li C, Bertorelli R, Fredduzzi S, Lozza G, Veltri A, Reggiani A. (2007)
Discovery of orally efficacious tetracyclic metabotropic glutamate receptor 1 (mGluR1) antagonists for the treatment of chronic pain.
J. Med. Chem., 50 (23): 5550-3. [PMID:17929793]