A Structural Analogue Approach to the Prediction of the Octanol−Water Partition Coefficient-Reference-Cited by-同舟云学术

A Structural Analogue Approach to the Prediction of the Octanol−Water Partition Coefficient

Published:2006-04-20 Issue:4 Volume:46 Page:1598-1603
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Sedykh Aleksandr Y.¹,Klopman Gilles¹

Affiliation:

1. Department of Chemistry, Case Western Reserve University, 10900 Euclid Ave, Cleveland, Ohio 44106, and MULTICASE Inc., 23811 Chagrin Blvd, Suite 305, Beachwood, Ohio 44122

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ci0505269

Reference19 articles.

1. Leo, A. Octanol/Water Partition Coefficients.Handbook of PropertyEstimation Methods for Chemicals; Boethling, R. S., Mackay, D., Eds.; Lewis Publishers: Boca Raton, FL, 2000; pp 89−114.

2. A New Substituent Constant, π, Derived from Partition Coefficients

3. Rm values of phenols. Their relation with log P values and activity

4. Additive-constitutive character of partition coefficients

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