| Compound Information | SONAR Target prediction | | Name: | ISOTECTORIGENIN TRIMETHYL ETHER | | Unique Identifier: | SPE00201341 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | C19H18O6 | | Molecular Weight: | 324.2 g/mol | | X log p: | 14.131 (online calculus) | | Lipinksi Failures | 1 | | TPSA | 63.22 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 6 | | Rotatable Bond Count: | 5 | | Canonical Smiles: | COc1ccc(cc1)C1=COc2c(OC)c(OC)cc(OC)c2C1=O | | Source: | parent ex Dalbergia spp, Millettia auriculata |
| Species: |
4932 |
| Condition: |
BNI1 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.7033±0.000424264 |
| Normalized OD Score: sc h |
1.0018±0.00188525 |
| Z-Score: |
0.0875±0.090335 |
| p-Value: |
0.930448 |
| Z-Factor: |
-12.0315 |
| Fitness Defect: |
0.0721 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | Spectrum | | Plate Number and Position: | 5|B9 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 25.30 Celcius | | Date: | 2007-09-14 YYYY-MM-DD | | Plate CH Control (+): | 0.04215±0.00127 | | Plate DMSO Control (-): | 0.6956±0.03546 | | Plate Z-Factor: | 0.8258 |
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| DBLink | Rows returned: 2 | |
| 253929 |
5,6,7,8-tetramethoxy-3-(4-methoxyphenyl)chromen-4-one |
| 3279840 |
5,7,8-trimethoxy-3-(4-methoxyphenyl)chromen-4-one |
| internal high similarity DBLink | Rows returned: 5 | |
| active | Cluster 5360 | Additional Members: 5 | Rows returned: 4 | |
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