10967/110 - QDB Compounds

QsarDB Repository

Gramatica, P.; Papa, E. An Update of the BCF QSAR Model Based on Theoretical Molecular Descriptors. QSAR Comb. Sci. 2005, 24, 8, 935–960.

Compound

ID:189
Name:2-Methyl-4,6-Dinitrophenol
Description:
Labels:
CAS:534-52-1
InChi Code:

Properties

LogBCF: Fish bioconcentration factor as logBCF

ValueSource or prediction
0.16

experimental value

0.79

Eq2: Updated validated correlation (2005) (Training set)

Links to External Resources