An article Synthesis and crystal structure of phosphonic acid and bisphosphoramidate derivatives: QSAR studies of their anti-fungal potential on Macrophomina Phaseolina (Tassi) Goid WOS:000604177100003 published article about SIMILARITY/DIVERSITY ANALYSIS; MOLECULAR DESCRIPTORS; GETAWAY DESCRIPTORS; PREDICTION; DOCKING; INDEXES; ASSAY; RICE in [Gholivand, Khodayar; Barzegar, Omolbanin; Nasrollah Tabar, Hadis; Yaghoubi, Rouhollah; Hosseini, Mahdieh; Rahimzadeh Dashtaki, Maryam; Mani-Varnosfaderani, Ahmad] Tarbiat Modares Univ, Dept Chem, Fac Basic Sci, POB 14115-175, Tehran, Iran; [Abbod, Mohsen; Safaie, Naser] Tarbiat Modares Univ, Fac Agr, Dept Plant Pathol, Tehran, Iran; [Ebrahimi Valmoozi, Ali Asghar] Imam Hossein Univ, Dept Adv Mat, Tech Engn Fac, Tehran, Iran; [Dusek, Michal] ASCR, Vvi, Inst Phys, Slovance 2, Prague 18221 8, Czech Republic in 2021.0, Cited 51.0. HPLC of Formula: C13H13N. The Name is Diphenylmethanamine. Through research, I have a further understanding and discovery of 91-00-9
A series of phosphonic acid and bisphosphoramidate derivatives were synthesized and characterized. The bioactivities against the fungal pathogen Macrophomina phaseolina and human acetylcholinesterase AChE enzyme were studied using QSAR based on multiple linear regression. L17, with (p-Cl-C6H4-NH) (p-Cl-C6H4)C(H)P(O)(OC2H5)(2) skeleton, demonstrated a great mortality on the M. phaseolina mycelial growth by 83% inhibition at 150 mg/L; the other tested derivative showed moderate to weak antifungal activity against the fungus. QSAR model based on the GA-MLR method revealed the importance of 3D descriptors (De, Mor18e, H8m, and Mor30p) on the antifungal activity. It showed good capability in predicting the fungicidal activity of the studied molecules. Another derivative, L5, with (m-CH3-NC5H4-NH)(m-CH3-C6H4)C(H)P(O)(OCH3)(2) skeleton displays the most potent anti-AChE activity. The electronic parameters, Delta EL-H, and E-LUMO, have the highest contribution of human AChE. The authors suggest that these models could be usefully employed in designing more effective crop protection compounds without side effects on non-target organisms.
HPLC of Formula: C13H13N. Welcome to talk about 91-00-9, If you have any questions, you can contact Gholivand, K; Abbod, M; Valmoozi, AAE; Barzegar, O; Tabar, HN; Yaghoubi, R; Hosseini, M; Safaie, N; Dashtaki, MR; Dusek, M; Mani-Varnosfaderani, A or send Email.
Reference:
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