Analysis of antimicrobial activity and biofilm inhibition of Ag-NHC complexes by in-vitro and molecular docking method

<b>1d</b> showed superior activity while <b>2a</b> and <b>2d</b> were effective against <i>C. albicans</i>, with activity comparable to fluconazole in the range of 8.6-8.7 µM. The highest binding affinity was recorded for 2a as -7.93 kcal/mol against DNA Gyrase, while <b>2b</b> has the best interactions with -5.49 kcal/mol against SarA. and -7.74 kcal/mol binding affinity was determined for <b>2a</b> with molecular docking. All the molecules interacted with the same grove of DNA.

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Publication Details

Journal
Future Medicinal Chemistry
Published
2025-08-28
DOI
https://doi.org/10.1080/17568919.2025.2552635
Primary Topic
N-Heterocyclic Carbenes in Organic and Inorganic Chemistry
Type
article
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article

Analysis of antimicrobial activity and biofilm inhibition of Ag-NHC complexes by in-vitro and molecular docking method

Uğur Tutar, Elvan Üstün, Neslihan Şahin, Cem Çeli̇k
1 links
Future Medicinal Chemistry
N-Heterocyclic Carbenes in Organic and Inorganic Chemistry
article

Analysis of antimicrobial activity and biofilm inhibition of Ag-NHC complexes by in-vitro and molecular docking method

Uğur Tutar, Elvan Üstün, Neslihan Şahin, Cem Çeli̇k
article en

Abstract

<b>1d</b> showed superior activity while <b>2a</b> and <b>2d</b> were effective against <i>C. albicans</i>, with activity comparable to fluconazole in the range of 8.6-8.7 µM. The highest binding affinity was recorded for 2a as -7.93 kcal/mol against DNA Gyrase, while <b>2b</b> has the best interactions with -5.49 kcal/mol against SarA. and -7.74 kcal/mol binding affinity was determined for <b>2a</b> with molecular docking. All the molecules interacted with the same grove of DNA.

Future Medicinal ChemistryVol. 17(17)
Sivas Cumhuriyet Üniversitesi (TR), Malatya Turgut Özal Üniversitesi (TR), Ordu University (TR), Turgut Özal University (TR)
Clean water and sanitation
Openalex Percentile: Top 83%
N-Heterocyclic Carbenes in Organic and Inorganic Chemistry
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