Acta Pharmaceutica, Vol. 54 No. 2, 2004.
Original scientific paper
Lipophilicity study of salicylamide
MARICA MEDIĆ-SARIĆ
ANA MORNAR
IVONA JASPRICA
Abstract
Molecular lipophilicity was studied using salicylamide as a model drug. Log P value for the target compound was experimentally determined by the "shake-flask" method and calculated using nine different computer programs based on atom/fragment contributions, structural parameters, atom-type electrotopological-state indices and neural network modeling, and on topological structure descriptors. Our analysis demonstrates good agreement between the experimentally observed log P value of salicylamide and the value calculated by the CSLogP program, based on topological structure descriptors and electrotopological indices.
Keywords
lipophilicity; salicylamide; log P; computer modeling
Hrčak ID:
16795
URI
Publication date:
1.6.2004.
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