Hydration patterns of rings in drugs and relationship to lipophilicity: A DFT study
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DOI: 10.1002/jcc.26808
Abstract: Rings are one of the major scaffold components of drugs in medicinal chemistry, due to their unique electronic distribution, scaffold rigidity, and three‐dimensionality while lipophilicity is considered as a vital parameter of rings that can… read more here.
Keywords: topology; hydration; chemistry; lipophilicity ... See more keywords