Managing Experimental 3D Structures in the Beyond‐Rule‐of‐5 Chemical Space: The Case of Rifampicin

The beyond‐Rule‐of‐5 (bRo5) chemical space is a source of new oral drugs and includes large and flexible compounds. Because of their size and conformational variability, bRo5 molecules assume different privileged conformations in the compartments of human body, i. e., they can exhibit chameleonic pr...

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Detalles Bibliográficos
Autores principales: Ermondi, Giuseppe, Lavore, Francesca, Vallaro, Maura, Tiana, Guido, Vasile, Francesca, Caron, Giulia
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2021
Materias:
Full Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8361677/
https://www.ncbi.nlm.nih.gov/pubmed/34114271
http://dx.doi.org/10.1002/chem.202100961

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8361677/
https://www.ncbi.nlm.nih.gov/pubmed/34114271
http://dx.doi.org/10.1002/chem.202100961

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