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Simple method of computing the partition coefficient

✍ Scribed by Gilles Klopman; Krishnan Namboodiri; Melvin Schochet

Publisher
John Wiley and Sons
Year
1985
Tongue
English
Weight
676 KB
Volume
6
Category
Article
ISSN
0192-8651

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✦ Synopsis

The values of log10 P (partition coefficient, in octanollwater) were calculated for about 200 organic molecules of diverse structures and functionalities. The method involves a simple procedure and appears accurate enough for semiquantitative applications. Further, this method of calculating loglo P values was shown to be successful in providing a better quantitative structure activity relationship (QSAR) than the Hansch-type approach in the study of inhibitory activity of substituted phenols on Bacillus Subtilis spore germination.

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