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The thermogravimetric analysis results of compounds 3 show that tremendous heat is released from its thermal decomposition, which indicates that the compound qualifies as a high-energy candidate.
The five dose results of compounds 3 and 7a showed enhancement of anticancer activity (GI50 values range from 1.00 to 7.10 μM) against all the cell lines in comparison with some of earlier molecules.
Reported herein are the isolation, structure elucidation and bioactivity investigation results of compounds 1 5.
Docking results of compounds 2 7 with BChE provided valuable information about the nature of the binding interactions that were satisfactorily correlated with the experimental studies.
The structural results of compounds 1 4 are in good agreement with similar typed Cu II) complexes with a paddle wheel geometry.
Fig. 7 Detailed view of the docking results of compounds 1 and 2 in the active site of neuraminidase (PDB ID: 2HU4).
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The docking results of compound 12b into the active sites of COXs, ALK1 and Aurora kinases indicated that it fits nicely inside their active sites.
MD results of compound 3a showed that it reached the stable state after 30 ps which was in agreement with the calculated potential and kinetic energy of compound 3a.
Table 32 Antiviral activity results of compound c10 Compound EC50 (µM) c10 17.2 AZT 0.0074.
The HMBC spectral results of compound 4i showed the long-ranged interaction that appeared in this spectrum (Fig. 2).
The good results of compound 10 may be attributed to the presence of salicylic ring, an active part of majority of drugs, and also its activity may be due to the presence of hydroxyl group.
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