| Compound Information | SONAR Target prediction | | Name: | CLENBUTEROL HYDROCHLORIDE | | Unique Identifier: | SPE01503917 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 294.499 g/mol | | X log p: | 4.219 (online calculus) | | Lipinksi Failures | 0 | | TPSA | 0 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 3 | | Rotatable Bond Count: | 4 | | Canonical Smiles: | Cl.CC(C)(C)NCC(O)c1cc(Cl)c(N)c(Cl)c1 | | Source: | synthetic; NAB-365 | | Therapeutics: | bronchodilator, beta2 adrenergic agonist |
| Species: |
4932 |
| Condition: |
SSB2 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.7061±0.00721249 |
| Normalized OD Score: sc h |
1.0069±0.00899221 |
| Z-Score: |
0.3767±0.494655 |
| p-Value: |
0.723058 |
| Z-Factor: |
-9.76956 |
| Fitness Defect: |
0.3243 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | SPECMTS3 | | Plate Number and Position: | 22|E11 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 24.70 Celcius | | Date: | 2008-05-29 YYYY-MM-DD | | Plate CH Control (+): | 0.04065±0.00055 | | Plate DMSO Control (-): | 0.678525±0.01616 | | Plate Z-Factor: | 0.9202 |
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| 2783 |
1-(4-amino-3,5-dichloro-phenyl)-2-(tert-butylamino)ethanol |
| 30849 |
[2-(4-amino-3,5-dichloro-phenyl)-2-hydroxy-ethyl]-tert-butyl-azanium chloride |
| 217246 |
1-(4-amino-3,5-dichloro-phenyl)-2-(propan-2-ylamino)ethanol |
| 688427 |
(1R)-1-(4-amino-3,5-dichloro-phenyl)-2-(tert-butylamino)ethanol |
| 688428 |
(1S)-1-(4-amino-3,5-dichloro-phenyl)-2-(tert-butylamino)ethanol |
| 5231296 |
[2-(4-amino-3,5-dichloro-phenyl)-2-hydroxy-ethyl]-tert-butyl-azanium |
| internal high similarity DBLink | Rows returned: 0 | |
| active | Cluster 17428 | Additional Members: 9 | Rows returned: 0 | |
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