Prediction Of Octanol/water Partition Coefficient Of Selected Ferrocene Derivatives Using Rekker Method

dc.contributor.authorAhmedi, R.
dc.contributor.authorLanez, T.
dc.date.accessioned2020-10-18T09:39:54Z
dc.date.available2020-10-18T09:39:54Z
dc.date.issued2011-07-01
dc.descriptionArticale in Journal of fundamental and Applied Sciences Vol. 03 N. 02en_US
dc.description.abstractIn this work we present a theoretical approach for the determination of octanol/water partition coefficient of selected ferrocenes bearing different substituents, the calculation is based on the adaptation of the Rekker method. Our prediction of obtained theoretical partition coefficients values of logP for all studied substituted ferrocene was confirmed by comparison with known experimental values obtained mainly from literature. The results obtained show that calculated partition coefficients are in good agreement with experimental values. For estimation of the octanol/water partition coefficients of the selected compounds, the average absolute error of log P is 0.13, and The correlation coefficient is R2 = 0.966.en_US
dc.identifier.citationArticale in Journal of fundamental and Applied Sciences Vol. 03 N. 02en_US
dc.identifier.issn1112-9867
dc.identifier.urihttp://dspace.univ-eloued.dz/handle/123456789/7139
dc.language.isoenen_US
dc.publisherUniversity of Eloued جامعة الواديen_US
dc.subjectexperimental logP, theoretical partition coefficient, substituted ferrocene, lipophilicity, QSAR.en_US
dc.titlePrediction Of Octanol/water Partition Coefficient Of Selected Ferrocene Derivatives Using Rekker Methoden_US
dc.typeArticleen_US

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