Moving beyond rules: the development of a central nervous system multiparameter optimization (CNS MPO) approach to enable alignment of druglike properties.
By Travis T Wager, Xinjun Hou, P. Verhoest, A. Villalobos. ACS Chemical Neuroscience, 2010
926 citations recorded by the source corpus.
Subfields: Computational Theory and Mathematics, Pharmacology, Spectroscopy
View Paper: https://www.semanticscholar.org/paper/fce202b4841f4aa76dcc0405f55d08b20390da3a
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In Computational Theory and Mathematics
In Pharmacology
In Spectroscopy
Citations in the corpus
- Quantifying the chemical beauty of drugs. (2012, background): “, prioritization of molecular targets, penetration of the central nervous syste”
- Current Challenges and Opportunities in Treating Glioblastoma (2018, methodology): “An analysis of FDA-approved CNS drugs demonstrated 74% have a CNS MPO desirability score $4 (Wager et al., 2010).”
- The influence of lipophilicity in drug discovery and design (2012, methodology): “Thus if a log P of > 3 were used as a strict cutoff, drug design of appropriate CNS drugs may be significantly restricted [88].”