| Compound Information | SONAR Target prediction |
| Name: | NISOLDIPINE |
| Unique Identifier: | SPE01505390 |
| MolClass: | Checkout models in ver1.5 and ver1.0 |
| Molecular Formula: | C20H24N2O6 |
| Molecular Weight: | 364.224 g/mol |
| X log p: | (online calculus) |
| Lipinksi Failures | |
| TPSA | |
| Hydrogen Bond Donor Count: | |
| Hydrogen Bond Acceptors Count: | |
| Rotatable Bond Count: | |
| Canonical Smiles: | [O-][N+](=O)c1ccccc1C1C(=C(C)NC(C)=C1C(=O)OCC(C)C)C(=O)OC |
| Source: | synthetic; bayk-5552 |
| Therapeutics: | vasodilator (coronary) |
| Found: 93 active | as graph: single | with analogs | [1] << Back 11 12 13 14 15 16 17 18 19 20 Next >> [93] |
| Species: | 4932 |
| Condition: | CCR4 |
| Replicates: | 2 |
| Raw OD Value: r im | 0.0491±0.0000707107 |
| Normalized OD Score: sc h | 0.0808±0.000768048 |
| Z-Score: | -39.1839±0.328625 |
| p-Value: | 0 |
| Z-Factor: | 0.873495 |
| Fitness Defect: | INF |
| Bioactivity Statement: | Toxic |
| ps |
| DBLink | Rows returned: 0 |
| internal high similarity DBLink | Rows returned: 0 |
| active | Cluster 5071 | Additional Members: 12 | Rows returned: 3 |
| SPE01500431 | 0 |
| LOPAC 00213 | 0 |
| Prest357 | 0 |
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