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Table 1 All chemical structures of evaluated compounds and their IC50 values regarding α-amylase and lipase inhibitory activities

From: Molecular docking, chemo-informatic properties, alpha-amylase, and lipase inhibition studies of benzodioxol derivatives

Structure Compound code R1 R2 R3 IC50 (µg/ml)
α-amylase Lipase
3a Cl H H 2.52 ± 1.1 145.49 ± 2.5
3b H H H 61.45 ± 1.5 > 400
3c I H H 39.85 ± 1.3 > 400
3d H I H 16.36 ± 0.75 118.86 ± 2.1
3e Br H H 2.57 ± 0.90 78.37 ± 1.72
3f H Br H 9.29 ± 1.4 > 400
3 g Cl H Cl 3.94 ± 2.01 > 400
4a Cl H H 8.88 ± 2.10 > 400
4b H Cl H 1.25 ± 1.01 > 400
4c H H H 4.12 ± 1.63 213.82 ± 2.1
4d I H H 7.95 ± 1.15 187.7 ± 1.23
4e H I H 3.85 ± 0.98 201.2 ± 2.37
4f Br H H 1.11 ± 1.07 290.7 ± 2.23
4 g H Br H 4.90 ± 2.21 225.8 ± 1.43
4 h Cl H Cl 9.50 ± 0.56 206.6 ± 1.96
6a O–CH3 O–CH3 H 8.547 ± 1.55 44.47 ± 2.30
6b O–CH3 H O–CH3 4.286 ± 1.01 100.8 ± 1.73
Acarbose      6.47 ± 2.01 -
Orlistat      25.01 ± 1.71