10967/229 - QDB Compounds

QsarDB Repository

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:89
Name:1,2,4-trichlorobenzene
Description:
Labels:
CAS:120-82-1
InChi Code:InChI=1S/C6H3Cl3/c7-4-1-2-5(8)6(9)3-4/h1-3H

Properties

logLC50: 48-h Daphnia toxicity as log(LC50) [mol/L]

ValueSource or prediction
-4.16

experimental value

-5.27

QSAR: Model for Daphnia toxicity (Tarining set)