Compound Information | SONAR Target prediction | Name: | ETHAVERINE HYDROCHLORIDE | Unique Identifier: | SPE01501000 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | | Molecular Weight: | 401.714 g/mol | X log p: | 15.917 (online calculus) | Lipinksi Failures | 1 | TPSA | 49.28 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 5 | Rotatable Bond Count: | 10 | Canonical Smiles: | Cl.CCOc1ccc(Cc2nccc3cc(OCC)c(OCC)cc23)cc1OCC | Source: | synthetic | Therapeutics: | antispasmodic |
Species: |
4932 |
Condition: |
TOP1 |
Replicates: |
2 |
Raw OD Value: r im |
0.5327±0.00827315 |
Normalized OD Score: sc h |
0.8593±0.0088391 |
Z-Score: |
-2.2734±0.254758 |
p-Value: |
0.0252328 |
Z-Factor: |
-0.092254 |
Fitness Defect: |
3.6796 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | Spectrum | Plate Number and Position: | 18|G3 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 25.70 Celcius | Date: | 2006-04-26 YYYY-MM-DD | Plate CH Control (+): | 0.0392±0.00106 | Plate DMSO Control (-): | 0.621825±0.02492 | Plate Z-Factor: | 0.8602 |
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DBLink | Rows returned: 2 | |
3280 |
1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-isoquinoline |
5702159 |
1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-isoquinoline hydrochloride |
internal high similarity DBLink | Rows returned: 3 | |
active | Cluster 1145 | Additional Members: 7 | Rows returned: 1 | |
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