Synthesis, Characterization, DFT, and In Silico Investigation of Two Newly Synthesized β-Diketone Derivatives as Potent COX-2 Inhibitors

Synthesis, Characterization, DFT, and In Silico Investigation of Two Newly Synthesized β-Diketone Derivatives as Potent COX-2 Inhibitors

Despite extensive genetic and biochemical characterization, the molecular genetic basis underlying the biosynthesis of β-diketones remains largely unexplored. β-Diketones and their complexes find broad applications as biologically active compounds. In this study, in silico molecular docking results...

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Bibliographic Details
Main Authors: Malahat Musrat Kurbanova, Abel Mammadali Maharramov, Arzu Zabit Sadigova, Fidan Zaur Gurbanova, Suraj Narayan Mali, Rashad Al-Salahi, Youness El Bakri, Chin-Hung Lai
Format: Article
Language:English
Published: MDPI AG 2023-11-01
Series:Bioengineering
Subjects:
β-diketone
COX-2
DFT
Hirshfeld surface
ADME
Online Access:https://www.mdpi.com/2306-5354/10/12/1361

Internet

https://www.mdpi.com/2306-5354/10/12/1361

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