| Compound Information | SONAR Target prediction |
| Name: | PEUCEDANIN |
| Unique Identifier: | SPE01504168 |
| MolClass: | Checkout models in ver1.5 and ver1.0 |
| Molecular Formula: | C15H14O4 |
| Molecular Weight: | 244.158 g/mol |
| X log p: | 9.136 (online calculus) |
| Lipinksi Failures | 1 |
| TPSA | 44.76 |
| Hydrogen Bond Donor Count: | 0 |
| Hydrogen Bond Acceptors Count: | 4 |
| Rotatable Bond Count: | 2 |
| Canonical Smiles: | COc1c(oc2cc3OC(=O)C=Cc3cc21)C(C)C |
| Source: | ex Peucedanum spp |
| Reference: | Indian J Chem 2: 464 (1964) |
| Found: 61 active | as graph: single | with analogs | [1] << Back 51 52 53 54 55 56 57 58 59 60 Next >> [61] |
| Species: | 4932 |
| Condition: | SER1 |
| Replicates: | 2 |
| Raw OD Value: r im | 0.5607±0.0350725 |
| Normalized OD Score: sc h | 0.8282±0.0166526 |
| Z-Score: | -5.4055±0.376182 |
| p-Value: | 0.000000144845 |
| Z-Factor: | -0.852924 |
| Fitness Defect: | 15.7476 |
| Bioactivity Statement: | Active |
| ps |
| DBLink | Rows returned: 1 |
| 8616 |
| internal high similarity DBLink | Rows returned: 0 |
| nonactive | Cluster 14605 | Additional Members: 7 | Rows returned: 3 |
| SPE00100101 | 0.491228070175439 |
| SPE01502242 | 0 |
| Prest1125 | 0 |
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