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https://hdl.handle.net/11499/46340
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DC Field | Value | Language |
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dc.contributor.author | Topal, Tufan | - |
dc.date.accessioned | 2023-01-09T21:10:50Z | - |
dc.date.available | 2023-01-09T21:10:50Z | - |
dc.date.issued | 2021 | - |
dc.identifier.issn | 1318-0207 | - |
dc.identifier.issn | 1580-3155 | - |
dc.identifier.uri | https://doi.org/10.17344/acsi.2020.6183 | - |
dc.identifier.uri | https://hdl.handle.net/11499/46340 | - |
dc.description.abstract | A detailed description of the two new pyridine ligands, (2E,3Z)-3-[2-(3-chloropyridin-2-yl)hydrazinylidene]-N-hydroxybutan-2-imine and 3-chloro-2-{(2Z)-2-[1-(4 nitrophenyl)ethylidene]hydrazinyl}, is reported. The synthesized compounds were characterized by spectroscopic studies, spectral features were performed by TD-DFT calculations. New-generation pyridine ligand of HL2 was also determinate by single-crystal X-ray diffraction and Hirshfeld surface analysis with two-dimensional fingerprint plots was used to analyze intermolecular interactions in crystals. Molecular-docking was performed to investigate the binding areas of chemical compounds, and the results showed the inhibitory activity of the studied HL1 and HL2 against E. coli. The results of the current study revealed the drug-likeness and bioactive properties of the ligands. | en_US |
dc.language.iso | en | en_US |
dc.publisher | Slovensko Kemijsko Drustvo | en_US |
dc.relation.ispartof | Acta Chimica Slovenica | en_US |
dc.rights | info:eu-repo/semantics/openAccess | en_US |
dc.subject | Pyridine-oxime | en_US |
dc.subject | molecular electrostatic potential (MEP) | en_US |
dc.subject | Drug-likeness | en_US |
dc.subject | E. Coli | en_US |
dc.subject | Hirshfeld surface analysis | en_US |
dc.subject | X-ray diffraction | en_US |
dc.subject | Dna-Binding | en_US |
dc.subject | Intermolecular Interactions | en_US |
dc.subject | Crystal-Structure | en_US |
dc.subject | Dft Calculations | en_US |
dc.subject | Complexes | en_US |
dc.subject | Derivatives | en_US |
dc.subject | Fluorescence | en_US |
dc.title | Synthesis, Crystallographic Structure, Hirshfeld Surface Analysis, Drug-likeness Properties and Molecular Docking Studies of New Oxime-pyridine Compounds | en_US |
dc.type | Article | en_US |
dc.identifier.volume | 68 | en_US |
dc.identifier.issue | 1 | en_US |
dc.identifier.startpage | 88 | en_US |
dc.identifier.endpage | 101 | en_US |
dc.authorid | topal, tufan/0000-0001-6550-4662 | - |
dc.identifier.doi | 10.17344/acsi.2020.6183 | - |
dc.relation.publicationcategory | Makale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı | en_US |
dc.authorscopusid | 56088677200 | - |
dc.identifier.pmid | 34057529 | en_US |
dc.identifier.scopus | 2-s2.0-85104994695 | en_US |
dc.identifier.wos | WOS:000641761700009 | en_US |
dc.identifier.scopusquality | Q3 | - |
item.openairetype | Article | - |
item.fulltext | With Fulltext | - |
item.languageiso639-1 | en | - |
item.cerifentitytype | Publications | - |
item.openairecristype | http://purl.org/coar/resource_type/c_18cf | - |
item.grantfulltext | open | - |
crisitem.author.dept | 10.03. Chemical Engineering | - |
Appears in Collections: | Mühendislik Fakültesi Koleksiyonu PubMed İndeksli Yayınlar Koleksiyonu / PubMed Indexed Publications Collection Scopus İndeksli Yayınlar Koleksiyonu / Scopus Indexed Publications Collection WoS İndeksli Yayınlar Koleksiyonu / WoS Indexed Publications Collection |
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09+aSP+6183-06-11-20.pdf | 1.62 MB | Adobe PDF | View/Open |
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