| Compound Information | SONAR Target prediction | | Name: | 3,4,5-TRIMETHOXYCINNAMALDEHYDE | | Unique Identifier: | SPE00211458 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | C12H14O4 | | Molecular Weight: | 208.126 g/mol | | X log p: | 11.203 (online calculus) | | Lipinksi Failures | 1 | | TPSA | 44.76 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 4 | | Rotatable Bond Count: | 5 | | Canonical Smiles: | COc1cc(C=CC=O)cc(OC)c1OC | | Source: | ex Dalbergia spruceana | | Reference: | Phytochemistry 17: 1419 (1978) |
| Species: |
4932 |
| Condition: |
POP2 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.6449±0.00643467 |
| Normalized OD Score: sc h |
1.0025±0.0128921 |
| Z-Score: |
0.0926±0.594991 |
| p-Value: |
0.675274 |
| Z-Factor: |
-57.9418 |
| Fitness Defect: |
0.3926 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | Spectrum | | Plate Number and Position: | 3|E2 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 25.40 Celcius | | Date: | 2007-10-24 YYYY-MM-DD | | Plate CH Control (+): | 0.040825±0.00089 | | Plate DMSO Control (-): | 0.6461250000000001±0.02155 | | Plate Z-Factor: | 0.8887 |
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| DBLink | Rows returned: 2 | |
| 36798 |
3-(3,4,5-trimethoxyphenyl)prop-2-enal |
| 5839209 |
(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enal |
| internal high similarity DBLink | Rows returned: 1 | |
| active | Cluster 16752 | Additional Members: 9 | Rows returned: 1 | |
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