Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for algae toxicity of benzene derivatives. Q13-32-0028. Molcode Ltd., 2009.
Compound
| ID: | 54 | |
|---|---|---|
| Name: | 4-chloro-2,6-dinitroaniline | |
| Description: | ||
| Labels: | ||
| CAS: | 5388-62-5 | |
| InChi Code: | InChI=1S/C6H4ClN3O4/c7-3-1-4(9(11)12)6(8)5(2-3)10(13)14/h1-2H,8H2 |
Properties
pEC50: Algal toxicity as log(1/EC50) [mM]
| Value | Source or prediction |
|---|---|
| 1.19 |
experimental value |
| 0.956 |
QSAR: Model for algal toxicity (Training set) |