MGS0039

Ligand id: 1397

Name: MGS0039

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 5
Topological polar surface area 109.85
Molecular weight 377.02
XLogP -0.9
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Chaki S, Yoshikawa R, Hirota S, Shimazaki T, Maeda M, Kawashima N, Yoshimizu T, Yasuhara A, Sakagami K, Okuyama S et al.. (2004)
MGS0039: a potent and selective group II metabotropic glutamate receptor antagonist with antidepressant-like activity.
Neuropharmacology, 46 (4): 457-67. [PMID:14975669]
2. Nakazato A, Sakagami K, Yasuhara A, Ohta H, Yoshikawa R, Itoh M, Nakamura M, Chaki S. (2004)
Synthesis, in vitro pharmacology, structure-activity relationships, and pharmacokinetics of 3-alkoxy-2-amino-6-fluorobicyclo[3.1.0]hexane-2,6-dicarboxylic acid derivatives as potent and selective group II metabotropic glutamate receptor antagonists.
J. Med. Chem., 47 (18): 4570-87. [PMID:15317467]