Investigation of the Usability of Some Triazole Derivative Compounds as Drug Active Ingredients by ADME and Molecular Docking Properties
| Dublin Core | PKP Metadata Items | Metadata for this Document | |
| 1. | Title | Title of document | Investigation of the Usability of Some Triazole Derivative Compounds as Drug Active Ingredients by ADME and Molecular Docking Properties |
| 2. | Creator | Author's name, affiliation, country | Fatih İslamoğlu; Recep Tayyip Erdogan University; Turkey |
| 2. | Creator | Author's name, affiliation, country | Esra Hacıfazlıoğlu; Recep Tayyip Erdogan University; Turkey |
| 3. | Subject | Discipline(s) | |
| 3. | Subject | Keyword(s) | SwissADME, ADME parameters, Docking, Triazole Derivatives |
| 4. | Description | Abstract | In this study, some important ADME parameters such as physicochemical properties, lipophilicity, water solubility, pharmacokinetics, medicinal chemistry and drug-likeness properties of ten triazole derivative compounds, which may be drug active ingredients, were performed on the SwissADME a web tool worked on-line. Bioavailability radar plotted for each molecule for rapid assessment of drug-likeness. The BOILED-Egg graph was plotted for each molecule to assess passive gastrointestinal absorption (HIA) and brain penetration (BBB) relative to the position of the molecules. SwissTargetPrediction a web tool worked on-line was used to predict the most likely protein targets of molecules. Docking programs have a wide range of applications ranging from computer aided to drug design. Molecules were docked with the determined target protein using the SwissDock a web tool worked on-line. |
| 5. | Publisher | Organizing agency, location | |
| 6. | Contributor | Sponsor(s) | |
| 7. | Date | (YYYY-MM-DD) | 26-05-2022 |
| 8. | Type | Status & genre | Peer-reviewed Article |
| 8. | Type | Type | |
| 9. | Format | File format | |
| 10. | Identifier | Uniform Resource Identifier | https://revues.imist.ma/index.php/morjchem/article/view/30855 |
| 10. | Identifier | Digital Object Identifier (DOI) | https://doi.org/10.48317/IMIST.PRSM/morjchem-v10i3.30855 |
| 11. | Source | Title; vol., no. (year) | Moroccan Journal of Chemistry; Vol 10, No 4 (2022) |
| 12. | Language | English=en | en |
| 13. | Relation | Supp. Files |
Untitled (1MB) Untitled (258KB) |
| 14. | Coverage | Geo-spatial location, chronological period, research sample (gender, age, etc.) | |
| 15. | Rights | Copyright and permissions |
Copyright (c) 2022 Moroccan Journal of Chemistry |