A linear quantitative structure–activity relationship (QSAR) study that encodes various aspects of physicochemical,topological and electronic descriptors has been developed for a series of 1,3,4-thiadiazole-2-thione derivatives (1a-r and 2a-c). The carbonic anhydrase IX inhibitory activity of the candidates under study (1a-r and 2a-c) were correlated to the selected parameters using stepwise linear regression analyses to achieve the best QSAR model. Promising results were obtained with the employed tetra-parametric model indicating that the information approach used in the present investigation is quite useful for modeling carbonic anhydrase IX inhibitors.
Research Department
Research Journal
Journal of Enzyme Inhibition and Medicinal Chemistry
Research Publisher
Taylor & Francis Group
Research Rank
1
Research Vol
vol. 24 - No. 3
Research Website
NULL
Research Year
2009
Research Member
Research Abstract