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. 2022 Jun 27;23(13):7123. doi: 10.3390/ijms23137123

Table 5.

Effect of the type of substituents occurring in the main structure of aminoalkanol derivatives (I), (II), (III) and (IV) on inhibitory potency (IC50) and affinity strength (Ki) of CAT.

Compound R1 R2 R3 Ki [mM] IC50 [mM] Docking Energy [kcal/mol]
Derivative (I) graphic file with name ijms-23-07123-i001.jpg graphic file with name ijms-23-07123-i002.jpg graphic file with name ijms-23-07123-i003.jpg 1.61 11.40 −8.6
Derivative (II) graphic file with name ijms-23-07123-i004.jpg graphic file with name ijms-23-07123-i005.jpg graphic file with name ijms-23-07123-i006.jpg 3.04 12.80 −8.4
Derivative (III) graphic file with name ijms-23-07123-i007.jpg graphic file with name ijms-23-07123-i008.jpg graphic file with name ijms-23-07123-i009.jpg 1.32 10.30 −8.9
Derivative (IV) graphic file with name ijms-23-07123-i010.jpg graphic file with name ijms-23-07123-i011.jpg graphic file with name ijms-23-07123-i012.jpg 1.79 12.20 −8.2