Skip to main content

Table 2 Rerank scores obtained during docking studies

From: Phytochemical composition, antiparasitic and α–glucosidase inhibition activities from Pelliciera rhizophorae

Compound

IC50 (mM)

Rerank score

Interaction with Lys 1420

1

1.45

33.4917

Hydrogen bond

2

0.02

−55.6135

Hydrogen bond

3

1.08

−6.54481

Ionic

4

0.98

−24.732

Hydrogen bond

5

2.37

−14.5051

Ionic

 

r2

0.3195

 
 

r2 (5 as outlier)

0.8642