Correlation of Octanol/Water Solubility Ratios and Partition Coefficients

Sirirat Pinsuwan; An Li; Samuel H. Yalkowsky

doi:10.1021/je00019a019

Correlation of Octanol/Water Solubility Ratios and Partition Coefficients

Sirirat Pinsuwan, An Li, Samuel H. Yalkowsky

Pharmacology and Toxicology

Research output: Contribution to journal › Article › peer-review

74 Scopus citations

Abstract

The octanol/water solubility ratio (S_o/S_w) was found to be highly correlated with the octanol/water partition coefficient (K_ow) of 82 pharmaceutically and environmentally relevant compounds. The solubility ratio gives comparable estimates to that of the group contribution (log P(calcd)) method for estimating the partition coefficient of the compounds used in this study.

Original language	English (US)
Pages (from-to)	623-626
Number of pages	4
Journal	Journal of Chemical and Engineering Data
Volume	40
Issue number	3
DOIs	https://doi.org/10.1021/je00019a019
State	Published - May 1 1995

ASJC Scopus subject areas

General Chemistry
General Chemical Engineering

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10.1021/je00019a019

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title = "Correlation of Octanol/Water Solubility Ratios and Partition Coefficients",

abstract = "The octanol/water solubility ratio (So/Sw) was found to be highly correlated with the octanol/water partition coefficient (Kow) of 82 pharmaceutically and environmentally relevant compounds. The solubility ratio gives comparable estimates to that of the group contribution (log P(calcd)) method for estimating the partition coefficient of the compounds used in this study.",

author = "Sirirat Pinsuwan and An Li and Yalkowsky, {Samuel H.}",

year = "1995",

month = may,

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doi = "10.1021/je00019a019",

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publisher = "American Chemical Society",

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T1 - Correlation of Octanol/Water Solubility Ratios and Partition Coefficients

AU - Pinsuwan, Sirirat

AU - Li, An

AU - Yalkowsky, Samuel H.

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Y1 - 1995/5/1

N2 - The octanol/water solubility ratio (So/Sw) was found to be highly correlated with the octanol/water partition coefficient (Kow) of 82 pharmaceutically and environmentally relevant compounds. The solubility ratio gives comparable estimates to that of the group contribution (log P(calcd)) method for estimating the partition coefficient of the compounds used in this study.

AB - The octanol/water solubility ratio (So/Sw) was found to be highly correlated with the octanol/water partition coefficient (Kow) of 82 pharmaceutically and environmentally relevant compounds. The solubility ratio gives comparable estimates to that of the group contribution (log P(calcd)) method for estimating the partition coefficient of the compounds used in this study.

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U2 - 10.1021/je00019a019

DO - 10.1021/je00019a019

M3 - Article

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JO - Journal of Chemical and Engineering Data

JF - Journal of Chemical and Engineering Data

IS - 3

ER -

Correlation of Octanol/Water Solubility Ratios and Partition Coefficients

Abstract

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