| Compound Information | SONAR Target prediction |
| Name: | Butylparaben |
| Unique Identifier: | Prest1201 |
| MolClass: | Checkout models in ver1.5 and ver1.0 |
| Molecular Formula: | C11H14O3 |
| Molecular Weight: | 180.116 g/mol |
| X log p: | 8.369 (online calculus) |
| Lipinksi Failures | 1 |
| TPSA | 26.3 |
| Hydrogen Bond Donor Count: | 0 |
| Hydrogen Bond Acceptors Count: | 3 |
| Rotatable Bond Count: | 5 |
| Canonical Smiles: | CCCCOC(=O)c1ccc(O)cc1 |
| Found: 3 nonactive as graph: single | with analogs | 1 2 3 Next >> |
| Species: | 9606 |
| Condition: | TMPPre001 |
| Replicates: | 2 |
| Raw OD Value: r im | 1000.0000±0 |
| Normalized OD Score: sc h | 0.9503±0 |
| Z-Score: | -1.1194±0 |
| p-Value: | 0.262978 |
| Z-Factor: | -16.0332 |
| Fitness Defect: | 1.3357 |
| Bioactivity Statement: | Nonactive |
| ps |
| DBLink | Rows returned: 4 |
| 7184 | butyl 4-hydroxybenzoate |
| 37453 | sodium 4-butoxycarbonylphenolate |
| 81009 | 3-methylbutyl 4-hydroxybenzoate |
| 3015995 | potassium 4-butoxycarbonylphenolate |
| internal high similarity DBLink | Rows returned: 0 |
| active | Cluster 13501 | Additional Members: 6 | Rows returned: 1 |
| SPE01500767 | 0 |
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