| Compound Information | SONAR Target prediction |
| Name: | Scopoletin |
| Unique Identifier: | Prest1125 |
| MolClass: | Checkout models in ver1.5 and ver1.0 |
| Molecular Formula: | C10H8O4 |
| Molecular Weight: | 184.105 g/mol |
| X log p: | 8.75 (online calculus) |
| Lipinksi Failures | 1 |
| TPSA | 35.53 |
| Hydrogen Bond Donor Count: | 0 |
| Hydrogen Bond Acceptors Count: | 4 |
| Rotatable Bond Count: | 1 |
| Canonical Smiles: | COc1cc2C=CC(=O)Oc2cc1O |
| Found: 3 nonactive as graph: single | with analogs | 1 2 3 Next >> |
| Species: | 9606 |
| Condition: | TMPPre001 |
| Replicates: | 2 |
| Raw OD Value: r im | 955.0000±0 |
| Normalized OD Score: sc h | 1.0403±0 |
| Z-Score: | 0.9096±0 |
| p-Value: | 0.363052 |
| Z-Factor: | -98.1291 |
| Fitness Defect: | 1.0132 |
| Bioactivity Statement: | Nonactive |
| ps |
| DBLink | Rows returned: 1 |
| 5280460 | 7-hydroxy-6-methoxy-chromen-2-one |
| internal high similarity DBLink | Rows returned: 0 |
| active | Cluster 14605 | Additional Members: 7 | Rows returned: 2 |
| SPE01504168 | 0.573770491803279 |
| SPE00100101 | 0.491228070175439 |
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