Evaluating the Physicochemical Properties-Activity Relationship and Discovering New 1,2-Dihydropyridine Derivatives as Promising Inhibitors for PIM1-Kinase: Evidence from Principal Component Analysis, Molecular Docking, and Molecular Dynamics Studies

• Auteurs principaux: Hanna Dib (Auteur), Mahmoud Abu-Samha (Auteur), Khaled Younes (Auteur), Mohamed A. O. Abdelfattah (Auteur)
• Format: Livre
• Publié: MDPI AG, 2024-07-01T00:00:00Z.
• Sujets: article
• Accès en ligne: Connect to this object online.

In this study, we evaluated the physicochemical properties related to the previously reported anticancer activity of a dataset comprising thirty 1,2-dihydropyridine derivatives. We utilized Principal Component Analysis (PCA) to identify the most significant influencing factors. The PCA analysis show...