The correlation and prediction of the solubility of compounds in water using an amended solvation energy relationship
Author:
Publisher
American Geophysical Union (AGU)
Subject
Pharmaceutical Science
Reference78 articles.
1. Eine einfache korrelation zwischen wasserlos‐lichkeit und strukture von kohlenwasserstoffen und halo‐genkohlenwasserstoffen;Irmann;Chem. Ing. Tech.,1965
2. A method for calculation of aqueous solubility of organic compounds using new fragment solubility constants;Wakita;Chem. Pharm. Bull.,1986
3. Estimation of aqueous solubility of organic molecules by the group contribution approach;Klopman;J. Chem. Inf. Comput. Sci.,1992
4. Group contribution methods to estimate water solubility of organic compounds;Kuhne;Chemosphere,1995
5. Prediction of aqueous solubility of organic compounds based on molecular structure. 2. Application to PNAs, PCBs, PCDDs, etc;Nirmalakhanden;Environ. Sci. Technol.,1989
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