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Development of an in silico prediction system of human renal excretion and clearance from chemical structure information incorporating fraction unbound in plasma as a descriptor

Prediction of pharmacokinetic profiles of new chemical entities is essential in drug development to minimize the risks of potential withdrawals. The excretion of unchanged compounds by the kidney constitutes a major route in drug elimination and plays an important role in pharmacokinetics. Herein, w...

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Detalhes bibliográficos
Publicado no:Sci Rep
Main Authors: Watanabe, Reiko, Ohashi, Rikiya, Esaki, Tsuyoshi, Kawashima, Hitoshi, Natsume-Kitatani, Yayoi, Nagao, Chioko, Mizuguchi, Kenji
Formato: Artigo
Idioma:Inglês
Publicado em: Nature Publishing Group UK 2019
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6906481/
https://ncbi.nlm.nih.gov/pubmed/31827176
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-019-55325-1
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