Contribution assessment of multiparameter optimization descriptors in CNS penetration
Author:
Affiliation:
1. Department of Computer-Aided Molecular Design, Institute of Physiologically Active Compounds, Russian Academy of Science, Russia
2. School of Pharmacy and Biomolecular Sciences, Liverpool John Moores University, UK
Publisher
Informa UK Limited
Subject
Drug Discovery,Molecular Medicine,General Medicine,Bioengineering
Link
https://www.tandfonline.com/doi/pdf/10.1080/1062936X.2018.1514652
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3. H.D. van de Waterbeemd and M. Kansy, Hydrogen-bonding capacity and brain penetration, Chimia 46 (1992), pp. 299–303.
4. Estimation of Caco-2 Cell Permeability using Calculated Molecular Descriptors
5. Estimation of Blood-Brain Barrier Crossing of Drugs Using Molecular Size and Shape, and H-Bonding Descriptors
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