| Compound Information | SONAR Target prediction | | Name: | TERBUTALINE HEMISULFATE | | Unique Identifier: | SPE01500558 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 302.197 g/mol | | X log p: | 5.569 (online calculus) | | Lipinksi Failures | 1 | | TPSA | 0 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 4 | | Rotatable Bond Count: | 4 | | Canonical Smiles: | CC(C)(C)NCC(O)c1cc(O)cc(O)c1.OS(O)(=O)=O | | Source: | synthetic | | Therapeutics: | betaadrenergic agonist, bronchodilator |
| Species: |
4932 |
| Condition: |
IRE1 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.7705±0.00834386 |
| Normalized OD Score: sc h |
0.9774±0.0013087 |
| Z-Score: |
-1.0253±0.038664 |
| p-Value: |
0.305398 |
| Z-Factor: |
-17.8998 |
| Fitness Defect: |
1.1861 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | Spectrum_ED | | Plate Number and Position: | 5|B6 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 595 nm | | Robot Temperature: | 30.00 Celcius | | Date: | 2010-08-10 YYYY-MM-DD | | Plate CH Control (+): | 0.09950000000000002±0.00719 | | Plate DMSO Control (-): | 0.9605000000000001±0.02374 | | Plate Z-Factor: | 0.8685 |
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| DBLink | Rows returned: 4 | |
| 31620 |
[2-(3,5-dihydroxyphenyl)-2-hydroxy-ethyl]-tert-butyl-azanium sulfate |
| 441333 |
5-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,3-diol; sulfuric acid |
| 441334 |
5-[1-hydroxy-2-(tert-butylamino)ethyl]benzene-1,3-diol; sulfuric acid |
| 657301 |
5-[1-hydroxy-2-(tert-butylamino)ethyl]benzene-1,3-diol; sulfuric acid |
| internal high similarity DBLink | Rows returned: 4 | |
| active | Cluster 17428 | Additional Members: 9 | Rows returned: 0 | |
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