A DFT/PCM Study on the Affinity of Salinomycin to Bind Monovalent Metal Cations.


Journal

Molecules (Basel, Switzerland)
ISSN: 1420-3049
Titre abrégé: Molecules
Pays: Switzerland
ID NLM: 100964009

Informations de publication

Date de publication:
14 Jan 2022
Historique:
received: 23 12 2021
revised: 08 01 2022
accepted: 11 01 2022
entrez: 21 1 2022
pubmed: 22 1 2022
medline: 17 2 2022
Statut: epublish

Résumé

The affinity of the polyether ionophore salinomycin to bind IA/IB metal ions was accessed using the Gibbs free energy of the competition reaction between SalNa (taken as a reference) and its rival ions: [M

Identifiants

pubmed: 35056843
pii: molecules27020532
doi: 10.3390/molecules27020532
pmc: PMC8779476
pii:
doi:

Substances chimiques

Cations, Monovalent 0
Metals 0
Pyrans 0
salinomycin 62UXS86T64

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Subventions

Organisme : Bulgarian National Science Fund
ID : KP-06-H29/3

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Auteurs

Todor Dudev (T)

Laboratory of Computational Chemistry and Spectroscopy, Faculty of Chemistry and Pharmacy, "St. Kl. Ohridski" University of Sofia, 1164 Sofia, Bulgaria.

Diana Cheshmedzhieva (D)

Laboratory of Computational Chemistry and Spectroscopy, Faculty of Chemistry and Pharmacy, "St. Kl. Ohridski" University of Sofia, 1164 Sofia, Bulgaria.

Peter Dorkov (P)

Research & Development Department, Biovet Ltd., 4550 Peshtera, Bulgaria.

Ivayla Pantcheva (I)

Laboratory of Biocoordination and Bioanalytical Chemistry, Faculty of Chemistry and Pharmacy, "St. Kl. Ohridski" University of Sofia, 1164 Sofia, Bulgaria.

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Classifications MeSH