QSPR Studies on Aqueous Solubilities of Drug-Like Compounds

QSPR Studies on Aqueous Solubilities of Drug-Like Compounds

A rapidly growing area of modern pharmaceutical research is the prediction of aqueous solubility of drug-sized compounds from their molecular structures. There exist many different reasons for considering this physico-chemical property as a key parameter: the design of novel entities with adequate a...

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Bibliographic Details
Main Authors: Eduardo A. Castro, Pablo R. Duchowicz
Format: Article
Language:English
Published: MDPI AG 2009-06-01
Series:International Journal of Molecular Sciences
Subjects:
QSPR theory
aqueous solubility
ADME/Tox properties
Lipinski rules
molecular descriptors
replacement method
group contribution methods
high throughput screening techniques
Online Access:http://www.mdpi.com/1422-0067/10/6/2558/

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http://www.mdpi.com/1422-0067/10/6/2558/

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