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Designed molecular fragments along with their predicted activities by Topomer CoMFA and HQSAR analysis.
| Molecule number | R1 Fragments | Predicted Activity | |
|---|---|---|---|
| Topomer CoMFA | HQSAR | ||
| 28A |  |
6.66 | 6.62 |
| 28B |  |
6.94 | 6.78 |
| 28C |  |
6.74 | 6.79 |
| 28D |  |
6.60 | 6.52 |
| 28E |  |
6.57 | 6.34 |
For all designed molecules, the variable part is the R1 fragment.
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