Cargando…

Increasing the Coverage of Medicinal Chemistry-Relevant Space in Commercial Fragments Screening

[Image: see text] Analyzing the chemical space coverage in commercial fragment screening collections revealed the overlap between bioactive medicinal chemistry substructures and rule-of-three compliant fragments is only ∼25%. We recommend including these fragments in fragment screening libraries to...

Descripción completa

Detalles Bibliográficos
Autores principales: Mok, N. Yi, Brenk, Ruth, Brown, Nathan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2014
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3904764/
https://www.ncbi.nlm.nih.gov/pubmed/24405118
http://dx.doi.org/10.1021/ci400632y