10967/225 - 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 rat chronic LOAEL. Q13-414-0035. Molcode Ltd., 2010.

Compound

ID:36
Name:Dimethyl terephthalate
Description:
Labels:
CAS:120-61-6
InChi Code:InChI=1S/C10H10O4/c1-13-9(11)7-3-5-8(6-4-7)10(12)14-2/h3-6H,1-2H3

Properties

LOAEL: Rat chronic LOAEL [log(umol/kg)]

ValueSource or prediction
2.81

experimental value

3.4

QSAR: Model for chronic toxicity (Training set)