| Compound Information | SONAR Target prediction |
| Name: | VINBLASTINE SULFATE |
| Unique Identifier: | SPE01500611 |
| MolClass: | Checkout models in ver1.5 and ver1.0 |
| Molecular Formula: | C46H60N4O13S |
| Molecular Weight: | 850.593 g/mol |
| X log p: | (online calculus) |
| Lipinksi Failures | |
| TPSA | |
| Hydrogen Bond Donor Count: | |
| Hydrogen Bond Acceptors Count: | |
| Rotatable Bond Count: | |
| Canonical Smiles: | CCC1(O)CC2CN(CCc3c(nc4ccccc43)C(C2)(C(=O)OC)c2cc3c(cc2OC)N(C)C2C(O)(C( OC(C)=O)C4(CC)C=CCN5CCC23C54)C(=O)OC)C1.OS(O)(=O)=O |
| Class: | alkaloid |
| Source: | Vinca rosea |
| Therapeutics: | antineoplastic, spindle poison |
| Found: 104 nonactive as graph: single | with analogs | [1] << Back 11 12 13 14 15 16 17 18 19 20 Next >> [104] |
| Species: | 4932 |
| Condition: | pdr_yCG196 |
| Replicates: | 2 |
| Raw OD Value: r im | 0.7375±0.00212132 |
| Normalized OD Score: sc h | 0.9725±0.0293373 |
| Z-Score: | -0.9237±0.988172 |
| p-Value: | 0.463358 |
| Z-Factor: | -5.48784 |
| Fitness Defect: | 0.7693 |
| Bioactivity Statement: | Nonactive |
| ps |
| DBLink | Rows returned: 0 |
| internal high similarity DBLink | Rows returned: 0 |
| active | Cluster 15220 | Additional Members: 6 | Rows returned: 0 |
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