Katritzky, A. R.; Kasemets, K.; Slavov, S.; Radzvilovits, M.; Tämm, K.; Karelson, M. Estimating the toxicities of organic chemicals in activated sludge process. Water Res. 2010, 44, 2451–2460.
Compound
| ID: | 102 | |
|---|---|---|
| Name: | 3'-Chloroacetophenone | |
| Description: | ||
| Labels: | ||
| CAS: | 99-02-5 | |
| InChi Code: | InChI=1S/C8H7ClO/c1-6(10)7-3-2-4-8(9)5-7/h2-5H,1H3 |
Properties
logEC50: Bioluminescent Shk1 aquatic toxicity as logEC50 [log(mmol/L)] i
| Value | Source or prediction |
|---|---|
| -0.37 |
experimental value |
| -0.87 |
Table.8: Final model (Training set) |