Compound no.

E-value

1

−283.40

2

−265.67

3

−271.19

4

−275.11

5

−264.86

6

−267.75

7

−263.37

8

−299.54

9

−277.55

10

−276.51

11

−262.84

12

−258.33

13

−264.64

14

−265.53

15

−263.89

16

−281.81

HOF

−230.62