| Compound Information | SONAR Target prediction | | Name: | ALLOPURINOL | | Unique Identifier: | SPE01500108 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 132.08 g/mol | | X log p: | 3.587 (online calculus) | | Lipinksi Failures | 0 | | TPSA | 41.79 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 5 | | Rotatable Bond Count: | 0 | | Canonical Smiles: | O=C1NC=Nc2nncc12 | | Source: | synthetic | | Therapeutics: | antihyperuricemia, antigout, antiurolithic |
| Species: |
4932 |
| Condition: |
PDE1 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.8236±0.00424264 |
| Normalized OD Score: sc h |
1.0100±0.00320179 |
| Z-Score: |
0.3578±0.102433 |
| p-Value: |
0.721178 |
| Z-Factor: |
-2.89881 |
| Fitness Defect: |
0.3269 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | Spectrum | | Plate Number and Position: | 10|D5 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 24.40 Celcius | | Date: | 2006-05-11 YYYY-MM-DD | | Plate CH Control (+): | 0.038425±0.00147 | | Plate DMSO Control (-): | 0.7976000000000001±0.01213 | | Plate Z-Factor: | 0.9503 |
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| DBLink | Rows returned: 0 | |
| internal high similarity DBLink | Rows returned: 0 | |
| nonactive | Cluster 1079 | Additional Members: 1 | Rows returned: 0 | |
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