Structural, antioxidant, antiproliferative and in‒silico study of pyridine-based hydrazonyl‒selenazoles and their sulphur isosteres
Samo za registrovane korisnike
2021
Autori
Araškov, JovanaNikolić, Milan
Armaković, Stevan
Armaković, Sanja
Rodić, Marko
Višnjevac, Aleksandar
Padrón, José M.
Todorović, Tamara
Filipović, Nenad R.
Članak u časopisu (Objavljena verzija)
Metapodaci
Prikaz svih podataka o dokumentuApstrakt
To evaluate the impact of chalcogen atom type, we performed a comparative study of antioxidant capacity and antiproliferative activity of a focused library of three pyridine-based hydrazonyl-1,3-selenazoles and their sulfur isosteres in five antioxidant assays and in six human solid tumor cell lines, respectively. In-silico calculations were further used to check pharmacokinetic profiles of investigated compounds such as drug-likeness parameters and interaction with water. Generally, selenium compounds appear to be more potent in comparison to sulfur isosteres in the performed essays.
Ključne reči:
Antioxidant activity / Antiproliferative activity / DFT / Drug likeness parameters / Hydrazonyl‒thiazoles / Single crystal X-ray analysisIzvor:
Journal of Molecular Structure, 2021, 1240, 130512-Izdavač:
- Elsevier
Finansiranje / projekti:
- Ministarstvo nauke, tehnološkog razvoja i inovacija Republike Srbije, institucionalno finansiranje - 200288 (Inovacioni centar Hemijskog fakulteta u Beogradu doo) (RS-200288)
- Ministarstvo nauke, tehnološkog razvoja i inovacija Republike Srbije, institucionalno finansiranje - 200168 (Univerzitet u Beogradu, Hemijski fakultet) (RS-200168)
- Spanish Government financial support through project PGC2018-094503-B-C22 (MCIU/AEI/FEDER, UE).
Napomena:
- Supplementary material: https://cherry.chem.bg.ac.rs/handle/123456789/4540
Povezane informacije:
DOI: 10.1016/j.molstruc.2021.130512
ISSN: 0022-2860
WoS: 000664244900012
Scopus: 2-s2.0-85105531083
URI
https://www.sciencedirect.com/science/article/pii/S0022286021006451https://cherry.chem.bg.ac.rs/handle/123456789/4539
Kolekcije
Institucija/grupa
Hemijski fakultet / Faculty of ChemistryTY - JOUR AU - Araškov, Jovana AU - Nikolić, Milan AU - Armaković, Stevan AU - Armaković, Sanja AU - Rodić, Marko AU - Višnjevac, Aleksandar AU - Padrón, José M. AU - Todorović, Tamara AU - Filipović, Nenad R. PY - 2021 UR - https://www.sciencedirect.com/science/article/pii/S0022286021006451 UR - https://cherry.chem.bg.ac.rs/handle/123456789/4539 AB - To evaluate the impact of chalcogen atom type, we performed a comparative study of antioxidant capacity and antiproliferative activity of a focused library of three pyridine-based hydrazonyl-1,3-selenazoles and their sulfur isosteres in five antioxidant assays and in six human solid tumor cell lines, respectively. In-silico calculations were further used to check pharmacokinetic profiles of investigated compounds such as drug-likeness parameters and interaction with water. Generally, selenium compounds appear to be more potent in comparison to sulfur isosteres in the performed essays. PB - Elsevier T2 - Journal of Molecular Structure T1 - Structural, antioxidant, antiproliferative and in‒silico study of pyridine-based hydrazonyl‒selenazoles and their sulphur isosteres VL - 1240 SP - 130512 DO - 10.1016/j.molstruc.2021.130512 ER -
@article{ author = "Araškov, Jovana and Nikolić, Milan and Armaković, Stevan and Armaković, Sanja and Rodić, Marko and Višnjevac, Aleksandar and Padrón, José M. and Todorović, Tamara and Filipović, Nenad R.", year = "2021", abstract = "To evaluate the impact of chalcogen atom type, we performed a comparative study of antioxidant capacity and antiproliferative activity of a focused library of three pyridine-based hydrazonyl-1,3-selenazoles and their sulfur isosteres in five antioxidant assays and in six human solid tumor cell lines, respectively. In-silico calculations were further used to check pharmacokinetic profiles of investigated compounds such as drug-likeness parameters and interaction with water. Generally, selenium compounds appear to be more potent in comparison to sulfur isosteres in the performed essays.", publisher = "Elsevier", journal = "Journal of Molecular Structure", title = "Structural, antioxidant, antiproliferative and in‒silico study of pyridine-based hydrazonyl‒selenazoles and their sulphur isosteres", volume = "1240", pages = "130512", doi = "10.1016/j.molstruc.2021.130512" }
Araškov, J., Nikolić, M., Armaković, S., Armaković, S., Rodić, M., Višnjevac, A., Padrón, J. M., Todorović, T.,& Filipović, N. R.. (2021). Structural, antioxidant, antiproliferative and in‒silico study of pyridine-based hydrazonyl‒selenazoles and their sulphur isosteres. in Journal of Molecular Structure Elsevier., 1240, 130512. https://doi.org/10.1016/j.molstruc.2021.130512
Araškov J, Nikolić M, Armaković S, Armaković S, Rodić M, Višnjevac A, Padrón JM, Todorović T, Filipović NR. Structural, antioxidant, antiproliferative and in‒silico study of pyridine-based hydrazonyl‒selenazoles and their sulphur isosteres. in Journal of Molecular Structure. 2021;1240:130512. doi:10.1016/j.molstruc.2021.130512 .
Araškov, Jovana, Nikolić, Milan, Armaković, Stevan, Armaković, Sanja, Rodić, Marko, Višnjevac, Aleksandar, Padrón, José M., Todorović, Tamara, Filipović, Nenad R., "Structural, antioxidant, antiproliferative and in‒silico study of pyridine-based hydrazonyl‒selenazoles and their sulphur isosteres" in Journal of Molecular Structure, 1240 (2021):130512, https://doi.org/10.1016/j.molstruc.2021.130512 . .