Skip to main content
. 2020 Jun 22;15(14):1294–1309. doi: 10.1002/cmdc.202000250

Table 4.

Binding affinity (K d) and IC50 values for compounds against CaCYP51.

Cmpd

CaCYP51

K d

R1

R2

X

IC50 [μM]a

[nM]

5 b

4‐F

H

CH

1.41

87±27

5 c

4‐Cl

H

CH

1.01

60±4

5 d

4‐Cl

Cl

CH

0.39

17±5

5 e

2,4‐diCl

H

CH

0.99

83±26

5 f

2,4‐diCl

Cl

CH

0.46

62±17

5 g

4‐CH3

H

CH

2.45

144±47

5 h

4‐CF3

H

CH

2.21

85±19

5 i

4‐OCH3

H

CH

0.91

55±10

5 j

3,4‐diOCH3

H

CH

6.15

5 k

4‐Cl

H

N

4.32

167±17

7

1.96

12 a

H

0.54

115±16

12 b

4‐F

0.20

55±27

12 c

4‐Cl

0.33

43±18

12 d

4‐OCH3

0.79

110±22

Fluc

0.31

41±13

[a] Curve‐fitted IC50 values (v i=z o+{v o/1+([I]/IC50)n Mean K d values of three replicates are shown along with associated standard deviations.