Quantitative structure-property relationship research of main group compounds
β Scribed by Lei Kelin; Wang Zhendong
- Book ID
- 105631343
- Publisher
- Wuhan University of Technology
- Year
- 2006
- Tongue
- English
- Weight
- 191 KB
- Volume
- 21
- Category
- Article
- ISSN
- 1000-2413
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π SIMILAR VOLUMES
A quantitative structure-property relationship (QSPR) was developed for predicting the aqueous solubility of drug-like compounds from their chemical structures. A set of 321 structurally diverse drugs or related compounds, with their intrinsic aqueous solubility collected from literature, was used i
The liquid viscosity of 361 organic compounds containing C, H, N, O, S and/or halogens was investigated using a quantitative structure-property relationship (QSPR) approach. A five-descriptor equation was obtained with a squared correlation coefficient (R 2 ) of 0.854 and a standard error (S) of 0.2