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: | 44 | |
|---|---|---|
| Name: | 2,4-dinitroaniline | |
| Description: | ||
| Labels: | ||
| CAS: | 97-02-9 | |
| InChi Code: | InChI=1S/C6H5N3O4/c7-5-2-1-4(8(10)11)3-6(5)9(12)13/h1-3H,7H2 |
Properties
pEC50: Algal toxicity as log(1/EC50) [mM]
| Value | Source or prediction |
|---|---|
| -0.36 |
experimental value |
| 0.14 |
QSAR: Model for algal toxicity (Training set) |