LogD7.4 prediction enhanced by transferring knowledge from chromatographic retention time, microscopic pKa and logP

Lipophilicity is a fundamental physical property that significantly affects various aspects of drug behavior, including solubility, permeability, metabolism, distribution, protein binding, and toxicity. Accurate prediction of lipophilicity, measured by the logD7.4 value (the distribution coefficient...

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Detalles Bibliográficos
Autores principales: Wang, Yitian, Xiong, Jiacheng, Xiao, Fu, Zhang, Wei, Cheng, Kaiyang, Rao, Jingxin, Niu, Buying, Tong, Xiaochu, Qu, Ning, Zhang, Runze, Wang, Dingyan, Chen, Kaixian, Li, Xutong, Zheng, Mingyue
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2023
Materias:
Research
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10478446/
https://www.ncbi.nlm.nih.gov/pubmed/37670374
http://dx.doi.org/10.1186/s13321-023-00754-4

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