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:96
Name:2,2',3,3',6,6'-Hexachlorobiphenyl
Description:
Labels:
CAS:38411-22-2
InChi Code:

Properties

LogBCF: Fish bioconcentration factor as logBCF

ValueSource or prediction
5.43

experimental value

4.66

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

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