| Compound Information | SONAR Target prediction | | Name: | OXYBENZONE | | Unique Identifier: | SPE01500451 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 216.148 g/mol | | X log p: | 17.116 (online calculus) | | Lipinksi Failures | 1 | | TPSA | 26.3 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 3 | | Rotatable Bond Count: | 3 | | Canonical Smiles: | COc1ccc(c(O)c1)C(=O)c1ccccc1 | | Source: | synthetic | | Therapeutics: | ultraviolet screen |
| Species: |
4932 |
| Condition: |
SPE01800170 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.2709±0.175504 |
| Normalized OD Score: sc h |
0.5873±0.381324 |
| Z-Score: |
-10.9638±9.69268 |
| p-Value: |
0.0000197805 |
| Z-Factor: |
-3.51259 |
| Fitness Defect: |
10.8308 |
| Bioactivity Statement: |
Outlier |
| Experimental Conditions | | | Library: | SpectrumTMP | | Plate Number and Position: | 2|A4 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 595 nm | | Robot Temperature: | 20.90 Celcius | | Date: | 2006-12-12 YYYY-MM-DD | | Plate CH Control (+): | 0.039999999999999994±0.00166 | | Plate DMSO Control (-): | 0.473±0.07151 | | Plate Z-Factor: | 0.7020 |
|  png
ps
pdf |
| DBLink | Rows returned: 4 | |
| 4632 |
(2-hydroxy-4-methoxy-phenyl)-phenyl-methanone |
| 10175 |
(2,6-dihydroxy-4-methoxy-phenyl)-phenyl-methanone |
| 96154 |
(2-hydroxy-4-methoxy-phenyl)-(4-methoxyphenyl)methanone |
| 282356 |
(2-hydroxy-4-methoxy-phenyl)-(4-hydroxyphenyl)methanone |
| internal high similarity DBLink | Rows returned: 3 | |
| nonactive | Cluster 9214 | Additional Members: 5 | Rows returned: 2 | |
|
