| 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: |
GAS1 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.2849±0.0289207 |
| Normalized OD Score: sc h |
0.8295±0.0071116 |
| Z-Score: |
-1.6967±0.106315 |
| p-Value: |
0.0906616 |
| Z-Factor: |
-0.853312 |
| Fitness Defect: |
2.4006 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | Spectrum | | Plate Number and Position: | 5|B9 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 23.70 Celcius | | Date: | 2006-01-20 YYYY-MM-DD | | Plate CH Control (+): | 0.043775±0.00220 | | Plate DMSO Control (-): | 0.413725±0.04833 | | Plate Z-Factor: | 0.5811 |
|  png
ps
pdf |
| 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 | |
|
