Log P as a tool in intramolecular hydrogen bond considerations
نویسندگان
چکیده
منابع مشابه
Integrating intramolecular hydrogen bonding (IMHB) considerations in drug discovery using ΔlogP as a tool.
This study demonstrates that ΔlogP(oct-tol) (difference between logP(octanol) and logP(toluene)) describes compounds propensity to form intramolecular hydrogen bonds (IMHB) and may be considered a privileged molecular descriptor for use in drug discovery and for prediction of IMHB in drug candidates. We identified experimental protocols for acquiring reliable ΔlogP(oct-tol) values on a set of c...
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ژورنال
عنوان ژورنال: Drug Discovery Today: Technologies
سال: 2018
ISSN: 1740-6749
DOI: 10.1016/j.ddtec.2018.03.001