Compounds

ε_LUMO+1^a

d(C₆-C₅)^b

TSA^c

Relative IC₅₀

Antimalarial activity

1

19.15

1.550

526.1

0.90

cha

2

20.44

1.551

529.2

0.45

cha

3

20.44

1.551

610.1

0.45

cha

4

39.01

1.551

604.4

1.50

cha

5

49.52

1.551

602.9

1.50

cha

6

30.90

1.5505

618.4

2.25

cha

7

23.18

1.551

513.3

0.28

cha

8

22.57

1.551

541.6

0.24

cha

9

32.45

1.553

585.3

0.11

cla

10

36.75

1.553

605.2

0.05

cla

11

27.55

1.553

608.2

0.02

cla

12

56.10

1.553

613.5

0.10

cla

13

55.13

1.553

592.9

0.09

cla

14

48.95

1.553

611.0

0.02

cla

15

60.22

1.553

630.9

0.24

cla

16

23.55

1.553

663.4

0.02

cla

17

48.86

1.553

649.1

0.07

cla

18

35.99

1.553

687.0

0.02

cla

19

46.26

1.553

599.3

0.02

cla

Descriptor

ε_LUMO+1

0.565

0.436

d(C₆-C₅)

0.641