| Compound Information | SONAR Target prediction | | Name: | Novel | | Unique Identifier: | LAT015C09 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | C12H16O3 | | Molecular Weight: | 192.127 g/mol | | X log p: | 6.422 (online calculus) | | Lipinksi Failures | 1 | | TPSA | 17.07 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 3 | | Rotatable Bond Count: | 5 | | Canonical Smiles: | CCCCCC(=O)c1ccc(O)cc1O |
| Species: |
4932 |
| Condition: |
pdr22h |
| Replicates: |
2 |
| Raw OD Value: r im |
0.6378±0.0203647 |
| Normalized OD Score: sc h |
0.9503±0.00425103 |
| Z-Score: |
-1.8585±0.188926 |
| p-Value: |
0.0654446 |
| Z-Factor: |
-0.548108 |
| Fitness Defect: |
2.7266 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | LATCA | | Plate Number and Position: | 15|C9 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 27.00 Celcius | | Date: | 2007-03-08 YYYY-MM-DD | | Plate CH Control (+): | 0.041675000000000004±0.00220 | | Plate DMSO Control (-): | 0.6626000000000001±0.01352 | | Plate Z-Factor: | 0.9278 |
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| DBLink | Rows returned: 3 | |
| 76596 |
1-(2,4-dihydroxyphenyl)hexan-1-one |
| 283375 |
1,6-bis(2,4-dihydroxyphenyl)hexane-1,6-dione |
| 6917096 |
1-(2,4,6-trihydroxyphenyl)hexan-1-one |
| internal high similarity DBLink | Rows returned: 0 | |
| active | Cluster 16963 | Additional Members: 14 | Rows returned: 5 | |
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