Mostrando 3 resultados de: 3
Filtros aplicados
Subtipo de publicación
Article(3)
Área de conocimiento
Relación cuantitativa estructura-actividad(3)
Farmacología(1)
Química ambiental(1)
Origen
scopus(3)
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:scopusPbkp_rediction of drug intestinal absorption by new linear and non-linear QSPR
ArticleAbstract: In order to minimize the high attrition rate that usually characterizes drug research and developmenPalabras claves:ADME properties, Drug intestinal absorption, Model's applicability domain, Molecular descriptors, QSPR Theory, Replacement methodAutores:Bellera C.L., Bruno-Blanch L.E., Castro E.A., Goodarzi M., Ortiz E.V., Pablo R. Duchowicz, Pesce G., Talevi A.Fuentes:scopus