compound 34 [PMID: 20409708]

Ligand id: 6321

Name: compound 34 [PMID: 20409708]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 5
Topological polar surface area 62.56
Molecular weight 350.16
XLogP 5.89
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Brnardic EJ, Fraley ME, Garbaccio RM, Layton ME, Sanders JM, Culberson C, Jacobson MA, Magliaro BC, Hutson PH, O'Brien JA et al.. (2010)
3-Aryl-5-phenoxymethyl-1,3-oxazolidin-2-ones as positive allosteric modulators of mGluR2 for the treatment of schizophrenia: Hit-to-lead efforts.
Bioorg. Med. Chem. Lett., 20 (10): 3129-33. [PMID:20409708]