Recognizing molecules with drug-like properties

Citation
Wp. Walters et al., Recognizing molecules with drug-like properties, CURR OP C B, 3(4), 1999, pp. 384-387
Citations number
36
Categorie Soggetti
Biochemistry & Biophysics
Journal title
CURRENT OPINION IN CHEMICAL BIOLOGY
ISSN journal
13675931 → ACNP
Volume
3
Issue
4
Year of publication
1999
Pages
384 - 387
Database
ISI
SICI code
1367-5931(199908)3:4<384:RMWDP>2.0.ZU;2-7
Abstract
A variety of successful approaches to the problem of recognizing 'drug-like ' molecules have been employed. These range from simple counting schemes su ch as the Lipinski 'rule of five' to the analysis of the multidimensional ' chemistry space' occupied by drugs, to neural network learning systems. Wit h this variety of tools, it now appears possible to design libraries that a re enriched in compounds which have desirable or 'drug-like' properties. Ve rifying the robustness of these methods, and extending them, will form the basis of research in this field during the next few years.