10967/138 - QDB Compounds

QsarDB Repository

Richard, A.M.; Hunter, E.S. Quantitative structure-activity relationships for the developmental toxicity of haloacetic acids in mammalian whole embryo culture. Teratology 1996, 53, 352-360.

Compound

ID:DCA
Name:Dichloroacetic acid
Description:
Labels:
CAS:79-43-6
InChi Code:InChI=1S/C2H2Cl2O2/c3-1(4)2(5)6/h1H,(H,5,6)

Properties

pBCm: Benchmark concentration for 5% increase in embryos with neural tube defects as log(1/BCm)

ValueSource or prediction
2.61

experimental value

2.8412764

QSAR2: Developmental toxicity of haloacetic acids (Training set)