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. 2022 Nov 7;27(21):7640. doi: 10.3390/molecules27217640

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© 2022 by the authors.

Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/).

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Genotoxicity and hepatotoxicity endpoints for selected compounds. The highlighted table shows the StarDrop V7 (Optibrium, Ltd., Cambridge, UK)–derived toxicity endpoints using the Derek Nexus module based on a knowledge-based prediction. Structural alerts within the molecule with a level of likelihood for concerns are based on precedence from experimental data. Likelihood level 0 = No report; 1 = Inactive; 2 = Equivocal; 3 = Plausible; 4 = Probable. Ethyl methanesulfonate (EMS) was used as a positive control for genotoxicity [47], and Lumiracoxib [48] as a positive control for hepatotoxicity endpoints.