| 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: |
4896 |
| Condition: |
MT1181-W303mata |
| Replicates: |
2 |
| Raw OD Value: r im |
0.4853±0.00601041 |
| Normalized OD Score: sc h |
1.0724±0.0208239 |
| Z-Score: |
0.7380±0.218092 |
| p-Value: |
0.465822 |
| Z-Factor: |
-8.19693 |
| Fitness Defect: |
0.764 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | Spectrum | | Plate Number and Position: | 5|B9 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 27.10 Celcius | | Date: | 2005-12-14 YYYY-MM-DD | | Plate CH Control (+): | 0.48224999999999996±0.01984 | | Plate DMSO Control (-): | 0.4232±0.04034 | | Plate Z-Factor: | -5.8734 |
|  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 | |
|
