Calculation of Lipophilicity of Organophosphate Pesticides Using Density Functional Theory

Higher lipophilicity facilitates the passage of a substance across lipid cell membranes, the blood–brain barrier and protein binding, and may also indicate its toxicity. We proposed eight methods for predicting the lipophilicity of the 22 most commonly used organophosphate pesticides. In this work,...

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Bibliographic Details
Main Authors: Kurban E. Magomedov, Ruslan Z. Zeynalov, Sagim I. Suleymanov, Sarizhat D. Tataeva, Viktoriya S. Magomedova
Format: Article
Language:English
Published: MDPI AG 2022-06-01
Series:Membranes
Subjects:
Online Access:https://www.mdpi.com/2077-0375/12/6/632