Design, Synthesis, QSAR and Molecular Docking of some Substituted Acridinedione Derivatives as Calcium Channel Antagonist
| المصدر: | المجلة العربية للنشر العلمي |
|---|---|
| الناشر: | مركز البحث وتطوير الموارد البشرية - رماح |
| المؤلف الرئيسي: | Ali, Ahmed Abaker Ahmed (Author) |
| مؤلفين آخرين: | Osman, Abubaker Mohammed (Co-Author) , Saeed, Ahmed El Sadig Mohammed (Co-Author) |
| المجلد/العدد: | ع40 |
| محكمة: | نعم |
| الدولة: |
الأردن |
| التاريخ الميلادي: |
2022
|
| الشهر: | شباط |
| الصفحات: | 1 - 24 |
| ISSN: |
2663-5798 |
| رقم MD: | 1435967 |
| نوع المحتوى: | بحوث ومقالات |
| اللغة: | الإنجليزية |
| قواعد المعلومات: | EduSearch, HumanIndex |
| مواضيع: | |
| كلمات المؤلف المفتاحية: |
Acridinedione Derivatives | QSAR | Docking Studies | Multi-Component Reactions
|
| رابط المحتوى: |
| المستخلص: |
In this review, the validation of the model was developed by using LOO method (leave one out method) in order to obtain very good model equation with higher R2 and very low RMSE value. The statistical quality of the model was also justified by statistical parameters. Molecular docking was also carried out in order to find the good binding affinities of these derivatives with the protein 4gdb. Based upon the QSAR model, a group of acridinedione derivatives were designed and synthesized by the one-pot Hantzsch condensation of an aromatic aldehyde, 5, 5- dimethyl 1, 3-cyclohexanedione (dimedone), and any appropriate amine in refluxing water. |
|---|---|
| ISSN: |
2663-5798 |
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