| Compound Information | SONAR Target prediction |
| Name: | Bacitracin |
| Unique Identifier: | Prest1333 |
| MolClass: | Checkout models in ver1.5 and ver1.0 |
| Molecular Formula: | C66H103N17O16S |
| Molecular Weight: | 1318.88 g/mol |
| X log p: | 7.444 (online calculus) |
| Lipinksi Failures | 3 |
| TPSA | 289 |
| Hydrogen Bond Donor Count: | 0 |
| Hydrogen Bond Acceptors Count: | 33 |
| Rotatable Bond Count: | 35 |
| Canonical Smiles: | CCC(C)C(N)C1SCC(N=1)C(=O)NC(CC(C)C)C(=O)NC(CCC(O)=O)C(=O)NC(C(C)CC)C(= O)NC1CCCCNC(=O)C(CC(N)=O)NC(=O)C(CC(O)=O)NC(=O)C(Cc2ncnc2)NC(=O)C(Cc2c cccc2)NC(=O)C(NC(=O)C(CCCN)NC1=O)C(C)CC |
| Found: 3 nonactive as graph: single | with analogs | 1 2 3 Next >> |
| Species: | 9606 |
| Condition: | TMPPre001 |
| Replicates: | 2 |
| Raw OD Value: r im | 981.0000±0 |
| Normalized OD Score: sc h | 1.1145±0 |
| Z-Score: | 2.5817±0 |
| p-Value: | 0.00983106 |
| Z-Factor: | -8.66229 |
| Fitness Defect: | 4.6222 |
| Bioactivity Statement: | Nonactive |
| ps |
| DBLink | Rows returned: 0 |
| internal high similarity DBLink | Rows returned: 0 |
| nonactive | Cluster 1 | Additional Members: 50 | Rows returned: 45 | << Back 1 2 3 4 5 6 7 8 Next >> |
| Prest240 | 0 |
| Prest172 | 0 |
| LAT006C10 | 0 |
| Prest816 | 0 |
| SPE01503428 | 0 |
| LAT007G08 | 0 |
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