| 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: |
pdr24h |
| Replicates: |
2 |
| Raw OD Value: r im |
0.7038±0.0227688 |
| Normalized OD Score: sc h |
0.9760±0.000823665 |
| Z-Score: |
-0.9323±0.00553065 |
| p-Value: |
0.35117 |
| Z-Factor: |
-1.95432 |
| Fitness Defect: |
1.0465 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | LATCA | | Plate Number and Position: | 15|C9 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 27.20 Celcius | | Date: | 2007-03-08 YYYY-MM-DD | | Plate CH Control (+): | 0.0421±0.00182 | | Plate DMSO Control (-): | 0.7021±0.01681 | | Plate Z-Factor: | 0.9225 |
|  png
ps
pdf |
| 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 | |
|
