| Compound Information | SONAR Target prediction | | Name: | FENDILINE HYDROCHLORIDE | | Unique Identifier: | SPE01501026 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 325.706 g/mol | | X log p: | 31.653 (online calculus) | | Lipinksi Failures | 1 | | TPSA | 0 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 1 | | Rotatable Bond Count: | 7 | | Canonical Smiles: | Cl.CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1 | | Source: | synthetic | | Therapeutics: | coronary vasodilator |
| Species: |
4932 |
| Condition: |
CHS3 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.5221±0.0689429 |
| Normalized OD Score: sc h |
0.7989±0.0981862 |
| Z-Score: |
-9.2516±4.32192 |
| p-Value: |
0.000000000290428 |
| Z-Factor: |
-1.00159 |
| Fitness Defect: |
21.9597 |
| Bioactivity Statement: |
Active |
| Experimental Conditions | | | Library: | SPECMTS3 | | Plate Number and Position: | 22|B4 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 25.40 Celcius | | Date: | 2008-06-20 YYYY-MM-DD | | Plate CH Control (+): | 0.040425±0.00063 | | Plate DMSO Control (-): | 0.6474249999999999±0.02066 | | Plate Z-Factor: | 0.8573 |
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ps
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| DBLink | Rows returned: 5 | |
| 3336 |
3,3-diphenyl-N-(1-phenylethyl)propan-1-amine |
| 26154 |
3,3-diphenylpropyl-(1-phenylethyl)azanium chloride |
| 657353 |
3,3-diphenyl-N-(1-phenylethyl)propan-1-amine; hydrogen(+1) cation; chloride |
| 5702162 |
3,3-diphenyl-N-(1-phenylethyl)propan-1-amine hydrochloride |
| 6604342 |
3,3-diphenyl-N-[(1S)-1-phenylethyl]propan-1-amine |
| internal high similarity DBLink | Rows returned: 0 | |
| nonactive | Cluster 3400 | Additional Members: 5 | Rows returned: 3 | |
|
