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Pharmacophore-directed retrosynthesis (PDR) and Density functional theory studies applied to the potent ion channel inhibitor waixenicin A : synthetic studies toward a more stable salarin C congener, thia-salarin C, through the lens of PDR.

Parris, Matthew Ray, 1997-Baylor University.2026

… in the vinylogous acetal, which is the proposed pharmacophore. Pharmacophore-directed retrosynthesis (PDR) was also applied to WaixA leading to the design and synthesis of a series of monocyclic derivatives bearing the proposed pharmacophore. The ability of these highly simplified WaixA …

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