article · Journal of Biomolecular Structure and Dynamics

Design of novel isoxazole derivatives as tubulin inhibitors using computer-aided techniques: QSAR modeling, <i>in silico</i> ADMETox, molecular docking, molecular dynamics, biological efficacy, and retrosynthesis

20244 citationsUniversité Sultan Moulay Slimane

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Abstract

compound is more effective than the others. Finally, the computer-assisted retrosynthesis process of two high confidence sequences was used to synthesize drug candidates.

Research topics

Bioactive Compounds and Antitumor Agents
Synthesis and biological activity
Cancer therapeutics and mechanisms

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DOI: 10.1080/07391102.2024.2306493

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