CoMFA Study on Novel Substitute Oxazolidine Derivatives
A series of novel Substitute oxazolidine derivatives with potential herbicide safener activity has been modeled using a 3D quantitative structure-activity relationships approach known comparative molecular field analysis (CoMFA). The cross-validated q2 of CoMFA was 0.612, non-cross-validated R2 was 0.986, and F-test value was 120.1, respectively, with the biological activity of the compounds was expressed by pRC30 (root length). The results are critically discussed using a variety of statistical parameters. The CoMFA model was satisfactory and would be useful for the future design of new N-dichloroacetyl oxazolidine herbicide safener.
Y. Fu et al., "CoMFA Study on Novel Substitute Oxazolidine Derivatives", Advanced Materials Research, Vol. 345, pp. 320-325, 2012