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Druglikeness/ADME/Toxicity prediction of the most active compound 4m and acarbose.
| Druglikeness/ADME/T a | Compound | |
|---|---|---|
| 4m | Acarbose | |
| Rule of Five | Suitable | Violated |
| Caco2 | 21.0452 | 9.44448 |
| HIA | 97.792576 | 0.000000 |
| BBB | 0.588671 | 0.0271005 |
| Ames_test | Mutagen | Mutagen |
| Carcino_Mouse | Negative | Positive |
| Carcino_Rat | Negative | Negative |
| hERG inhibition | Low risk | Ambiguous |
aThe recommended ranges for Caco2: < 25 poor, > 500 great, HIA: > 80% is high < 25% is poor, and BBB = − 3.0 − 1.2.
