## Abstract ChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 100 leading journals. To access a ChemInform Abstract of an article which was published elsewhere, please select a โFull Textโ option. The original article is trackable v
Occurrence of pharmaceutically acceptable anions and cations in the Cambridge Structural Database
โ Scribed by Delia A. Haynes; William Jones; W.D. Samuel Motherwell
- Publisher
- John Wiley and Sons
- Year
- 2005
- Tongue
- English
- Weight
- 229 KB
- Volume
- 94
- Category
- Article
- ISSN
- 0022-3549
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โฆ Synopsis
The occurrence of a number of pharmaceutically acceptable counterions in the Cambridge Structural Database (CSD) has been investigated. The results have been compared to the occurrence of the same counterions in a list of known pharmaceutical salts. Chloride salts are by far the highest occurring in both groups. The occurrence of hydrates in the structures of salts of pharmaceutically acceptable counterions in the CSD has also been investigated. It was found that salts of these counterions show an increased tendency to hydrate when compared to the database average. The CSD was also searched for co-crystals of the list of pharmaceutically acceptable acids and bases corresponding to the list of counterions used for the salt investigation.
๐ SIMILAR VOLUMES
## Abstract Complexes of 18โcrownโ6 with alkaliโmetal cations (Na^+^, K^+^, and Rb^+^), urea, and the uncomplexed crown ether were studied __in vacuo__ with the molecular dynamics method. Conformational data from these calculations (simulation times in the range from 6โ15 ns) was compared with info