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:26
Name:Ethylene cyanohydrin
Description:
Labels:
CAS:109-78-4
InChi Code:InChI=1S/C3H5NO/c4-2-1-3-5/h5H,1,3H2

Properties

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

ValueSource or prediction
1.85

experimental value

2.11

QSAR: Model for chronic toxicity (Training set)