Synthesis, Antimycobacterial Activity, and Computational Insight of Novel 1,4‐Benzoxazin‐2‐one Derivatives as Promising Candidates against Multidrug‐Resistant Mycobacterium Tuberculosis
Sign Up to like & getrecommendations! Published in 2025 at "Chemmedchem"
DOI: 10.1002/cmdc.202500073
Abstract: In the search for new antitubercular agents, a series of 1,4‐benzoxazinone‐based compounds is designed, synthesized, and evaluated. These molecules show potent antimycobacterial activity, with a minimum inhibitory concentration between 2 and 8 μg mL−1. This interesting profile… read more here.
Keywords: synthesis antimycobacterial; insight novel; antimycobacterial activity; activity computational ... See more keywords
Insight into the novel inhibition mechanism of apigenin to Pneumolysin by molecular modeling
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DOI: 10.1016/j.cplett.2017.09.003
Abstract: Abstract In this study, the mechanism of apigenin inhibition was explored using molecular modelling, binding energy calculation, and mutagenesis assays. Energy decomposition analysis indicated that apigenin binds in the gap between domains 3 and 4… read more here.
Keywords: insight novel; novel inhibition; mechanism; mechanism apigenin ... See more keywords
Insight into novel ErMI (M = S, Se) chalcohalide materials for next-generation energy applications
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DOI: 10.1039/d5ra05496f
Abstract: The study unveils an inclusive first-principles study of the electronic structure, optical, thermoelectric, and elastic properties of two novel rare-earth chalcohalides, ErSI and ErSeI, through density functional theory with the GGA + U approach, which… read more here.
Keywords: chalcohalide materials; novel ermi; materials next; ersi ersei ... See more keywords
An insight into novel therapeutic potentials of taxifolin
Sign Up to like & getrecommendations! Published in 2023 at "Frontiers in Pharmacology"
DOI: 10.3389/fphar.2023.1173855
Abstract: Taxifolin is a flavonoid compound, originally isolated from the bark of Douglas fir trees, which is often found in foods such as onions and olive oil, and is also used in commercial preparations, and has… read more here.
Keywords: system; novel therapeutic; therapeutic potentials; insight novel ... See more keywords