Structures and actual pIC50 activity values of four new h-DAAO inhibitors, compared with their predicted activities by CoMFA and CoMSIA models.
No. | Structure | Actual pIC50 | Predicted pIC50 | |
---|---|---|---|---|
CoMFA | CoMSIA | |||
5m |
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7.097 | 7.262 | 7.676 |
5y |
![]() |
7.523 | 7.259 | 7.619 |
5z |
![]() |
7.222 | 7.072 | 7.481 |
10b |
![]() |
7.398 | 7.234 | 7.407 |