| Compound Information | SONAR Target prediction | | Name: | AVOCADYNE | | Unique Identifier: | SPE01505234 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 252.18 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 | | Class: | lipid | | Source: | Persea spp | | Reference: | An Acad Brasil Cienc 42 (suplemento): 45 (1970); Tetrahedron 25:4617 (1969) | | Therapeutics: | antibacterial, antifungal |
| Species: |
4932 |
| Condition: |
IRE1 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.7014±0.0205061 |
| Normalized OD Score: sc h |
0.7823±0.0135912 |
| Z-Score: |
-5.9711±0.184512 |
| p-Value: |
0.0000000031248 |
| Z-Factor: |
0.501712 |
| Fitness Defect: |
19.5839 |
| Bioactivity Statement: |
Active |
| Experimental Conditions | | | Library: | Spectrum | | Plate Number and Position: | 22|D2 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 24.00 Celcius | | Date: | 2007-11-23 YYYY-MM-DD | | Plate CH Control (+): | 0.040025±0.00048 | | Plate DMSO Control (-): | 0.6973±0.17527 | | Plate Z-Factor: | 0.1034 |
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| DBLink | Rows returned: 1 | |
| 3015189 |
heptadec-16-yne-1,2,4-triol |
| internal high similarity DBLink | Rows returned: 0 | |
| active | Cluster 289 | Additional Members: 6 | Rows returned: 5 | |
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