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Application of descriptors based on Lipinski's rules in the QSPR study of aqueous solubilities
ArticleAbstract: We complement new physically interpretable descriptors inspired by the Lipinski's rules of drug bioaPalabras claves:Aqueous solubility, Molecular descriptors, QSPR Theory, Replacement methodAutores:Bellera C.L., Bruno-Blanch L.E., Castro E.A., Pablo R. Duchowicz, Talevi A.Fuentes:scopusNew QSPR study for the pbkp_rediction of aqueous solubility of drug-like compounds
ArticleAbstract: Solubility has become one of the key physicochemical screens at early stages of the drug developmentPalabras claves:Aqueous solubility, Dragon molecular descriptors, Group contribution method, QSPR Theory, Replacement method variable subset selectionAutores:Bruno-Blanch L.E., Castro E.A., Pablo R. Duchowicz, Talevi A.Fuentes:scopus