[HTML][HTML] Molecular properties and In silico bioactivity evaluation of (4-fluorophenyl)[5)-3-phen-(4-nitrophenyl yl-4, 5-dihydro-1H-pyrazol-1-yl] methanone derivatives …

IA Omotayo, S Banjo, OT Emmanuel, LD Felix… - Journal of Taibah …, 2023 - Elsevier
Objectives Molecular structures, spectroscopic properties, charge distributions, frontier
orbital energies, nonlinear optical (NLO) properties and molecular docking simulations were …

Electron withdrawing group effect on biological activities of pyrimidine hybrids as potential anti-matrix metalloproteinase-7

AK Oyebamiji, SA Akintelu, KA Odelade, B Adetuyi… - Química …, 2023 - SciELO Brasil
We investigated the effect of both electron donating group and e//lectron withdrawing group
on biological activity of pyrimidine-based compounds as metalloproteinase-7 inhibitors and …

In silico investigations of triazole-trimethoxyphenyl hybrids as anti-proliferative agents against adenocarcinomic human alveolar basal epithelial cells (A549): DFT …

AO Sunday, S Abdullahi, OK Gabriel, OE Moses… - 2024 - researchsquare.com
Twenty-eight sets of synthesized triazole-trimethoxyphenyl hybrids (TPD) were considered
as anti-proliferative drugs against human alveolar basal epithelial (A549) cancer cell lines …