| Compound Information | SONAR Target prediction |
| Name: | MEXAMINE |
| Unique Identifier: | SPE02300296 |
| MolClass: | Checkout models in ver1.5 and ver1.0 |
| Molecular Formula: | |
| Molecular Weight: | 211.583 g/mol |
| X log p: | 8.17 (online calculus) |
| Lipinksi Failures | 1 |
| TPSA | 9.23 |
| Hydrogen Bond Donor Count: | 0 |
| Hydrogen Bond Acceptors Count: | 3 |
| Rotatable Bond Count: | 3 |
| Canonical Smiles: | Cl.COc1ccc2ncc(CCN)c2c1 |
| Source: | synthetic |
| Reference: | J Med Chem 30: 1 (1987) |
| Therapeutics: | 5HT agonist |
| Found: 192 nonactive as graph: single | with analogs | 1 2 3 4 5 6 7 8 9 10 Next >> [192] |
| Species: | 4932 |
| Condition: | AAT2 |
| Replicates: | 2 |
| Raw OD Value: r im | 0.7128±0.00311127 |
| Normalized OD Score: sc h | 1.0030±0.0042963 |
| Z-Score: | 0.1587±0.224938 |
| p-Value: | 0.875192 |
| Z-Factor: | -19.2841 |
| Fitness Defect: | 0.1333 |
| Bioactivity Statement: | Nonactive |
| ps |
| DBLink | Rows returned: 0 |
| internal high similarity DBLink | Rows returned: 2 |
| AC 11641 | 0.9167 |
| LOPAC 01058 | 1.0000 |
| active | Cluster 15603 | Additional Members: 14 | Rows returned: 1 |
| LOPAC 00976 | 0.442622950819672 |
Service provided by the
Mike Tyers Laboratory