作者
JL McDonagh, T van Mourik, JBO Mitchell
发表日期
2016/10/1
期刊
Molecular Informatics
出版商
Wiley-VCH, Weinheim
简介
In the published version of this article, Equation 1 (top and bottom) contains two errors, which present the first terms on the right hand sides of Equation 1 as being an order of magnitude too small. The equations should read: log 10 S= 0.8-log 10 P-0.01 (MP-25) log 10 S= 0.5-log 10 P-0.01 (MP-25) Equation 1. Top: original General Solubility Equation (GSE) from Yalkowsky and Valvani [2c]; bottom: revised GSE by Jain and Yalkowsky [2a]. Log 10 S is the logarithm to the base ten of the aqueous solubility (S; units referred to mol/L), log 10 P is the base ten logarithm of the n-octanol/water partition coefficient, and MP (C) is the melting point.
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