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Medicinal Chemistry

Editor-in-Chief

ISSN (Print): 1573-4064
ISSN (Online): 1875-6638

QSAR of the Anticonvulsant Enaminones; Molecular Modeling Aspects and other Assessments

Author(s): T. L. Wilson, P. L. Jackson, C. D. Hanson, Z. Xue, N. D. Eddington and K. R. Scott

Volume 1, Issue 4, 2005

Page: [371 - 381] Pages: 11

DOI: 10.2174/1573406054368710

Price: $65

Abstract

The enaminones represent potentially useful agents for the clinical treatment in generalized tonic-clonic seizures (Epilepsia, 1993, 34(6), 1141-1145, Biopharm. Drug Disp. 2003, 397-407). A regression analysis was performed to provide a quantitative structure-activity relationship (QSAR) correlation model for prediction of activity for the anticonvulsant enaminones. Molecular modeling was performed to determine the molecular confluence of the Unverferth model (J. Med. Chem. 1998, 41, 63-73) to the enaminones. Conclusions related to the sodium channel model were assessed.

Keywords: epilepsy, sodium channel, anticonvulsants, molecular modeling, regression analysis


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