| Compound Information | SONAR Target prediction | | Name: | UMBELLIFERONE | | Unique Identifier: | SPE00231084 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | C9H6O3 | | Molecular Weight: | 156.094 g/mol | | X log p: | (online calculus) | | Lipinksi Failures | | | TPSA | | | Hydrogen Bond Donor Count: | | | Hydrogen Bond Acceptors Count: | | | Rotatable Bond Count: | | | Canonical Smiles: | Oc1ccc2C=CC(=O)Oc2c1 | | Class: | coumarin | | Source: | Angelica, Artemisia, Coronilla, Ferula and Ruta spp | | Reference: | Chem Pharm Bull 19:640 (1971); Phytochemistry 14:1083 (1975) | | Therapeutics: | antifungal, phytoalexin |
| Species: |
4932 |
| Condition: |
CCR4 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.6651±0.0079196 |
| Normalized OD Score: sc h |
1.0452±0.0076977 |
| Z-Score: |
1.9196±0.316473 |
| p-Value: |
0.060997 |
| Z-Factor: |
-1.30916 |
| Fitness Defect: |
2.7969 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | SPECMTS3 | | Plate Number and Position: | 12|G8 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 28.80 Celcius | | Date: | 2008-04-16 YYYY-MM-DD | | Plate CH Control (+): | 0.041374999999999995±0.00063 | | Plate DMSO Control (-): | 0.6109±0.01911 | | Plate Z-Factor: | 0.9033 |
|  png
ps
pdf |
| DBLink | Rows returned: 0 | |
| internal high similarity DBLink | Rows returned: 0 | |
| nonactive | Cluster 16508 | Additional Members: 6 | Rows returned: 2 | |
|
