Title of article
High throughput solubility determination with application to selection of compounds for fragment screening Original Research Article
Author/Authors
Nicola Colclough، نويسنده , , Alison Hunter، نويسنده , , Peter W. Kenny، نويسنده , , Rod S. Kittlety، نويسنده , , Lynsey Lobedan، نويسنده , , Kin Y. Tam، نويسنده , , Mark A. Timms، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2008
Pages
6
From page
6611
To page
6616
Abstract
The development and application of a high throughput aqueous solubility assay is reported. Measurements for up to 637 compounds can be made in a fully automated experiment. Results from this assay were used to quantify risk of unacceptable solubility as a function of lipophilicity for neutral fragment-like compounds. Assessment of risk of unacceptable solubility was combined with experimental solubility measurement to select compounds for inclusion in a fragment-screening library.
Keywords
Structure–property relationship , Physicochemical properties , Fragment-based drug discovery , Screening library , Fragment screening , Solubility , UV/Vis spectroscopy , Automation
Journal title
Bioorganic and Medicinal Chemistry
Serial Year
2008
Journal title
Bioorganic and Medicinal Chemistry
Record number
1304467
Link To Document