Table 2. CYP Inhibition of Designed Compounds.
inhibition
(%) |
||||||
---|---|---|---|---|---|---|
compda | clogPb | CYP3A4 | CYP2D6 | CYP1A2 | CYP2C9 | CYP2C19 |
3 | 3.29 | 80 | 24 | 64 | 84 | 81 |
4 | 2.27 | 52 | 7 | 72 | 69 | 29 |
10 | 2.51 | 16 | 18 | 93 | 32 | 36 |
12 | 1.83 | 24 | 14 | 95 | 54 | 42 |
15 | 3.53 | 64 | 25 | 87 | 65 | 55 |
19 | 1.87 | 6 | 16 | 95 | 9 | 8 |
All compounds were tested at 10 μM concentration.
Calculated by Molinspiration.