Synthesis, structure–activity relationship studies using density functional theory and in silico molecular docking on substituted benzohydrazide derivatives

PM Gurubasavaraj, VP Sajjan, BM Muñoz-Flores… - Journal of Molecular …, 2024 - Elsevier
The present study demonstrates the utility of benzohydrazide derivatives based on an
approach to identify potential targets for a series of synthesized compounds that show potent …

Evaluation of novel pyridoxal isonicotinoyl hydrazone (PIH) derivatives as potential anti‐tuberculosis agents: An in silico investigation

MS Hossain, SS Al Abbad… - … Journal of Quantum …, 2024 - Wiley Online Library
This investigation employed computational methodologies to assess the therapeutic
potential of derivatives (1–16) of pyridoxal isonicotinoyl hydrazone (PIH) as potential …

Synthesis, biological profile and computational insights of new derivatives of benzo [B][1, 4] diazepines as prospective anticancer agents for inhibiting the CDK-2 …

PA Dar, BA Bhat, MA Mir, SY Chaudhari… - Journal of …, 2024 - Taylor & Francis
In the current work, a new series of benzo [b][1, 4] diazepines (A-1 to C-4) was synthesized
and screened against three different human cancer cell lines, HepG2 (hepatocellular …

Synthesis, Computational, and Photophysical Probing Studies on Mono-Azo Sulfonamides, and Their Antibacterial Activity

P Shekharagouda, GP Mamatha, KM Pallavi… - Russian Journal of …, 2024 - Springer
Objective: Novel azo-linked substituted sulfonamides were synthesized via diazo coupling
with the molecular formula (C9H10N4O2S2, C11H11N3O2S) and characterized by FT-IR …