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Author

M. N. da Rocha

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Open access Aug 2026

Mapping the electronic and biological landscape of halogenated aryl quinoline derivatives via computational approaches

The results showed that the QNL1 and QNL3 derivatives were the most favorable due to high intestinal absorption and apparent permeability and apparent permeability, showing potential as a future drug.

M. Sales, Caroline Do Nascimento Gonçalves, Abraão Lucas Silva dos Santos et al. · 0 citations
Open access 2026

Anticandidal, molecular docking, antioxidant, and cytotoxic effects of the essential oil of Vitex gardneriana Schauer.

It is suggested that V. gardneriana EO has moderate antifungal activity, however, it shows promising potential when combined with conventional antifungal agents and supports future research toward the development of therapeutic formulations.

Amanda L. Barros, F. L. L. de Aguiar, Andréa Maria Neves et al. · 0 citations
Open access Jul 2026

Evaluation of Chalcone (E)‑3-(4-Fluorophenyl)-1-(2-hydroxy-3,4,6-trimethoxyphenyl)-prop-2-en-1-one against Trypanosoma cruzi (Y Strain): In Vitro Assay, In Silico Drug-Target Analysis, and MPO-Based Drug Likeness

The CPN4F molecule demonstrates potent in vitro efficacy against Chagas disease, outperforming BZN in molecular docking studies targeting cruzain and outperforming BZN in molecular docking studies targeting cruzain.

J. Pinto, Francisco Nithael Melo Lucio, L. R. Ribeiro et al. · 0 citations

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