Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for acute toxicity to Daphnia magna. Q13-31-0060. 2010.
Compound
| ID: | 181 | |
|---|---|---|
| Name: | nitroglycerine | |
| Description: | ||
| Labels: | ||
| CAS: | 55-63-0 | |
| InChi Code: | InChI=1S/C3H5N3O9/c7-4(8)13-1-3(15-6(11)12)2-14-5(9)10/h3H,1-2H2 |
Properties
logLC50: 48-h Daphnia toxicity as log(LC50) [mol/L]
| Value | Source or prediction |
|---|---|
| -3.85 |
experimental value |
| -3.23 |
QSAR: Model for Daphnia toxicity (Tarining set) |