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Integration of lipophilicity and steric descriptors suggests improved anticancer activity in pyrimidine hybrids.
Lipophilicity and steric/electronic descriptors govern distribution, protein binding, and anticancer activity. Integrating these features enables design of hybrids overcoming P-gp-mediated multidrug resistance, with hybrid 4k emerging as a promising candidate.
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Mosić et al. (2025) studied this question.
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