New styrylquinoxaline: synthesis, structural, biological evaluation, ADMET prediction and molecular docking investigations.

Molecular Docking Simulation Hydrogen Peroxide Quantum Theory Static Electricity
DFT calculations Hirshfeld surface analysis Quinoxaline antidiabetic activity energy gap molecular docking

Journal

Journal of biomolecular structure & dynamics
ISSN: 1538-0254
Titre abrégé: J Biomol Struct Dyn
Pays: England
ID NLM: 8404176

Informations de publication

Date de publication:
04 2023
Historique:
medline: 13 4 2023
pubmed: 18 2 2022
entrez: 17 2 2022
Statut: ppublish

Résumé

The organic compound (

Identifiants

DOI: 10.1080/07391102.2022.2040592 PMID: 35174770
pubmed: 35174770
doi: 10.1080/07391102.2022.2040592
doi:

Substances chimiques

Hydrogen Peroxide BBX060AN9V

Types de publication

Journal Article Research Support, Non-U.S. Gov't

Langues

eng

Sous-ensembles de citation

IM

Pagination

2861-2877

Auteurs

Salma Mortada (S)

Laboratories of Pharmacology and Toxicology, Pharmaceutical and Toxicological Analysis Research Team, Faculty of Medicine and Pharmacy, Mohammed V University in Rabat, Rabat, Morocco.

Mohcine Missioui (M)

Laboratory of Medicinal Chemistry, Drug Sciences Research Center, Faculty of Medicine and Pharmacy, Mohammed V University in Rabat, Rabat, Morocco.

Walid Guerrab (W)

Laboratory of Medicinal Chemistry, Drug Sciences Research Center, Faculty of Medicine and Pharmacy, Mohammed V University in Rabat, Rabat, Morocco.

Güneş Demirtaş (G)

Department of Physics, Faculty of Arts and Sciences, Ondokuz Mayıs University, Samsun, Turkey.
ORCID: 0000-0001-9953-4026

Joel T Mague (JT)

Department of Chemistry, Tulane University, New Orleans, LA, USA.

My El Abbes Faouzi (MEA)

Laboratories of Pharmacology and Toxicology, Pharmaceutical and Toxicological Analysis Research Team, Faculty of Medicine and Pharmacy, Mohammed V University in Rabat, Rabat, Morocco.
ORCID: 0000-0003-3863-4677

Youssef Ramli (Y)

Laboratory of Medicinal Chemistry, Drug Sciences Research Center, Faculty of Medicine and Pharmacy, Mohammed V University in Rabat, Rabat, Morocco.
ORCID: 0000-0002-6885-5692

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Classifications MeSH

questionsmedicales.fr › Sciences de l'information › Méthodologies informatiques › Simulation numérique › Simulation de docking moléculaire › New styrylquinoxaline: synthesis, structural,...
questionsmedicales.fr › Composés chimiques organiques › Radicaux libres › Peroxydes › Peroxyde d'hydrogène › New styrylquinoxaline: synthesis, structural,...
questionsmedicales.fr › Disciplines des sciences naturelles › Physique › Physique nucléaire › Théorie quantique › New styrylquinoxaline: synthesis, structural,...
questionsmedicales.fr › Phénomènes physiques › Phénomènes magnétiques › Phénomènes électromagnétiques › Électricité › Électricité statique › New styrylquinoxaline: synthesis, structural,...