In Silico Prediction of Drug Solubility. 3. Free Energy of Solvation in Pure Amorphous Matter-Reference-Cited by-同舟云学术

In Silico Prediction of Drug Solubility. 3. Free Energy of Solvation in Pure Amorphous Matter

Published:2007-06-01 Issue:25 Volume:111 Page:7303-7311
ISSN:1520-6106
Container-title:The Journal of Physical Chemistry B
language:en
Short-container-title:J. Phys. Chem. B

Author:

Lüder Kai¹,Lindfors Lennart¹,Westergren Jan¹,Nordholm Sture¹,Kjellander Roland¹

Affiliation:

1. Department of Chemistry, Göteborg University, SE-412 96, Göteborg, Sweden, and Pharmaceutical and Analytical R&D, AstraZeneca R&D Mölndal, 431 83 Mölndal, Sweden

Publisher

American Chemical Society (ACS)

Subject

Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp071687d

Reference33 articles.

1. Drug-like properties and the causes of poor solubility and poor permeability

2. Prediction of drug solubility from structure

3. Jorgensen, W. L.The Encyclopedia of Computational Chemistry; Schleyer, P. v. R., Ed.; John Wiley & Sons: Athens, GA, 1998; Vol. 5, p 3281.

4. Molecular modeling of organic and biomolecular systems usingBOSS andMCPRO

5. In Silico Prediction of Drug Solubility: 1. Free Energy of Hydration

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