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Lipophilicity study of salicylamide

MARICA MEDIĆ-SARIĆ
ANA MORNAR
IVONA JASPRICA


Puni tekst: engleski pdf 95 Kb

str. 91-101

preuzimanja: 1.050

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Sažetak

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.

Ključne riječi

lipophilicity, salicylamide, log P, computer modeling

Hrčak ID:

16795

URI

https://hrcak.srce.hr/16795

Podaci na drugim jezicima: hrvatski

Posjeta: 1.913 *