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Table 4 Experimental and predicted activities for the compounds with residual

From: In silico modeling of tetraoxane-8-aminoquinoline hybrids active against Plasmodium falciparum

Compounds

Experimental activity (pEC50)

Predicted activity (pEC50)

Residual

1a

6.690370

6.809850

− 0.119480

2

7.244125

7.141499

0.102626

3

7.124939

7.269416

− 0.144477

4a

7.214670

6.957825

0.256845

5

7.221849

7.266572

− 0.044723

6a

6.850781

7.158224

− 0.307440

7

7.119186

7.053930

0.065256

8a

7.346787

6.709780

0.637008

9

7.795880

7.855448

− 0.059568

10

7.823909

7.862578

− 0.038669

11

7.823909

7.842876

− 0.018967

12

7.769551

7.624906

0.144645

13

7.036212

7.242101

− 0.205889

14

7.004365

6.868879

0.135485

15

7.721246

7.645882

0.075365

16

6.754487

6.681501

0.072986

17a

6.920819

6.671336

0.249482

18

7.091515

7.064604

0.026911

19

6.542118

6.574618

− 0.032500

20

6.038105

6.116586

− 0.078482

21a

5.377786

6.057060

− 0.679270

22a

5.246417

5.781937

− 0.535520

  1. aTest set