| Compound Information | SONAR Target prediction | | Name: | Avocatin B | | Unique Identifier: | LAT001B04 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | C34H66O6 | | Molecular Weight: | 504.36 g/mol | | X log p: | -1.131 (online calculus) | | Lipinksi Failures | 1 | | TPSA | 0 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 3 | | Rotatable Bond Count: | 14 | | Canonical Smiles: | OCC(O)CC(O)CCCCCCCCCCCC=C.OCC(O)CC(O)CCCCCCCCCCCC#C |
| Species: |
4932 |
| Condition: |
pdr18h |
| Replicates: |
2 |
| Raw OD Value: r im |
0.0421±0.000353553 |
| Normalized OD Score: sc h |
0.0677±0.00160099 |
| Z-Score: |
-26.2252±2.0274 |
| p-Value: |
0 |
| Z-Factor: |
-0.228173 |
| Fitness Defect: |
INF |
| Bioactivity Statement: |
Toxic |
| Experimental Conditions | | | Library: | LATCA | | Plate Number and Position: | 1|B4 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 24.90 Celcius | | Date: | 2007-03-08 YYYY-MM-DD | | Plate CH Control (+): | 0.040175±0.00183 | | Plate DMSO Control (-): | 0.629975±0.20881 | | Plate Z-Factor: | -0.0737 |
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ps
pdf |
| DBLink | Rows returned: 1 | |
| 6710748 |
heptadec-16-ene-1,2,4-triol; heptadec-16-yne-1,2,4-triol |
| internal high similarity DBLink | Rows returned: 1 | |
| active | Cluster 289 | Additional Members: 6 | Rows returned: 5 | |
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