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One Hundred Carboxylate Receptors.

Alo RüütelSofja TshepelevitshIvo Leito
Published in: The Journal of organic chemistry (2022)
This work presents a compilation of binding constant (log K ass ) values in DMSO-d 6 /H 2 O (0.5% m/m) for a variety of receptors with 12 carboxylate anions (formate, acetate, lactate, pivalate, sorbate, hexanoate, benzoate, glyphosate, glucuronate, ibuprofen, naproxen, and ketoprofen). A total of 489 log K ass values are listed for 100 anion receptor molecules. Most log K ass values originate from previously published articles, along with some values for previously unpublished receptor molecules, spanning a workflow of 8 years. The purpose of this study is to serve as a comprehensive information source for selecting suitable receptor candidates to be used in practical carboxylate sensing applications, such as constructing ion-selective electrodes (ISE-s). To support such decision making, all receptors are presented together with lipophilicity (log P o/w ) data.
Keyphrases
  • decision making
  • electronic health record
  • randomized controlled trial
  • systematic review
  • big data
  • machine learning
  • health information