| Compound Information | SONAR Target prediction | | Name: | RHODINYL ACETATE | | Unique Identifier: | SPE00310030 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 176.127 g/mol | | X log p: | 2.39 (online calculus) | | Lipinksi Failures | 0 | | TPSA | 26.3 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 2 | | Rotatable Bond Count: | 7 | | Canonical Smiles: | CC(CCOC(C)=O)CCC=C(C)C | | Class: | terpene | | Source: | common constituent of plant essential oils |
| Species: |
4932 |
| Condition: |
CLN2 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.7055±0.00219203 |
| Normalized OD Score: sc h |
1.0070±0.00425038 |
| Z-Score: |
0.7654±0.229205 |
| p-Value: |
0.450004 |
| Z-Factor: |
-5.52969 |
| Fitness Defect: |
0.7985 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | Spectrum_ED | | Plate Number and Position: | 17|G4 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 595 nm | | Robot Temperature: | 30.00 Celcius | | Date: | 2010-08-10 YYYY-MM-DD | | Plate CH Control (+): | 0.08749999999999998±0.00577 | | Plate DMSO Control (-): | 0.8962499999999999±0.02180 | | Plate Z-Factor: | 0.9095 |
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| DBLink | Rows returned: 3 | |
| 9017 |
3,7-dimethyloct-6-enyl acetate |
| 6708682 |
[(3R)-3,7-dimethyloct-6-enyl] acetate |
| 6999975 |
[(3S)-3,7-dimethyloct-6-enyl] acetate |
| internal high similarity DBLink | Rows returned: 2 | |
| active | Cluster 1751 | Additional Members: 1 | Rows returned: 0 | |
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