| Compound Information | SONAR Target prediction |
| Name: | BUTAMBEN |
| Unique Identifier: | SPE01500767 |
| MolClass: | Checkout models in ver1.5 and ver1.0 |
| Molecular Formula: | |
| Molecular Weight: | 178.123 g/mol |
| X log p: | 7.721 (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(N)cc1 |
| Source: | synthetic |
| Therapeutics: | anesthetic (local) |
| Found: 107 active | as graph: single | with analogs | [1] << Back 71 72 73 74 75 76 77 78 79 80 Next >> [107] |
| Species: | 4932 |
| Condition: | ARX1 |
| Replicates: | 2 |
| Raw OD Value: r im | 0.6145±0.0113844 |
| Normalized OD Score: sc h | 0.8977±0.00234128 |
| Z-Score: | -5.0380±0.311419 |
| p-Value: | 0.000000798504 |
| Z-Factor: | -7.13344 |
| Fitness Defect: | 14.0405 |
| Bioactivity Statement: | Active |
| ps |
| DBLink | Rows returned: 2 |
| 2482 | butyl 4-aminobenzoate |
| 210327 | 3-methylbutyl 4-aminobenzoate |
| internal high similarity DBLink | Rows returned: 0 |
| nonactive | Cluster 13501 | Additional Members: 6 | Rows returned: 2 |
| Prest1201 | 0.333333333333333 |
| Prest994 | 0 |
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