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QSAR Studies on Some of Dichloroacetyl Oxazolidine Herbicide Safeners
In order to find activity of herbicide safener, The MM+ and Polak-Ribiere algorithm were employed to calculate the properties of dichloroacetyl oxazolidine compounds. The QSAR equation of this series compounds was obtained by using (Least-Squares Regression) PLS regression. The results showed that log p and dipole moment played a major role, variable surface area (aprox), hydration energy, refractivity and polarizability played a secondary role. The equation building of this series compounds can not only forecast the activity of new compound, but also lead design of higher activity herbicide safener.
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Reference:
Oxazolidine – Wikipedia,
,Oxazolidine | C3H7NO – PubChem