| Compound Information | SONAR Target prediction | | Name: | PD 98,059 | | Unique Identifier: | LOPAC 01174 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | C16H13NO3 | | Molecular Weight: | 254.176 g/mol | | X log p: | 16.42 (online calculus) | | Lipinksi Failures | 1 | | TPSA | 35.53 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 4 | | Rotatable Bond Count: | 2 | | Canonical Smiles: | COc1cccc(c1N)C1Oc2ccccc2C(=O)C=1 | | Class: | Phosphorylation | | Action: | Inhibitor | | Selectivity: | MEK2 |
| Species: |
4932 |
| Condition: |
SAP30 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.8090±0.00848528 |
| Normalized OD Score: sc h |
0.9970±0.000279502 |
| Z-Score: |
-0.2569±0.0405196 |
| p-Value: |
0.797308 |
| Z-Factor: |
-23.286 |
| Fitness Defect: |
0.2265 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | Lopac | | Plate Number and Position: | 13|G9 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 26.20 Celcius | | Date: | 2005-11-18 YYYY-MM-DD | | Plate CH Control (+): | 0.039150000000000004±0.00126 | | Plate DMSO Control (-): | 0.7788250000000001±0.01996 | | Plate Z-Factor: | 0.9342 |
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ps
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| DBLink | Rows returned: 1 | |
| 4713 |
2-(2-amino-3-methoxy-phenyl)chromen-4-one |
| internal high similarity DBLink | Rows returned: 0 | |
| active | Cluster 12019 | Additional Members: 25 | Rows returned: 7 | 1 2 Next >> |
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