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Synthesis and antifungal activity of nitrophenyl-pyrazole substituted Schiff bases

Andres Restrepo-Acevedo, Nicolas Osorio, Luis E. Giraldo-Lopez,Richard F. D'Vries,Susana Zacchino,Rodrigo Abonia,Ronan Le Lagadec,Fernando Cuenu-Cabezas

Journal of Molecular Structure（2022）

Cited 6|Views11
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Abstract
•Nitrophenyl pyrazole-based azomethine isomers are readily prepared.•The antifungal activity depends on the position of the nitro substituent.•DFT calculations and molecular docking simulations show interactions with proteins.
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Key words
Ab initio calculations,Antifungal agents,Nitrogen heterocycles,Nitrophenyl,Schiff bases
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