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Identifiers and physicochemical properties of the selected compounds.

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Figshare2016-05-13 更新2026-04-29 收录
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Full names, their abbreviations as used in the text and CAS registry numbers (CAS RN) are given as compound identifiers. Molecular weight (MW) and logD at pH 7.4 were predicted or calculated using Marvins' Calculater Plugins and Instant JChem 6.1.3 was used for structure database management (ChemAxon Kft. [39]). Both the MW and the logD of the compounds fit within Lipinski's 'rule of 5' [42].

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2016-05-13
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