10967/141 - QDB Compounds

QsarDB Repository

Benigni, R.; Bossa, C.; Netzeva, T. I.; Rodomonte, A.; Tsakovska, I. Mechanistic QSAR of aromatic amines: New models for discriminating between homocyclic mutagens and nonmutagens, and validation of models for carcinogens. Environ. Mol. Mutagen. 2007, 48, 754–771.

Compound

ID:45
Name:4,4'-Methylenebis(o-isopropyl-aniline)
Description:
Labels:
CAS:19900-66-4
InChi Code:InChI=1S/C19H26N2/c1-12(2)16-10-14(5-7-18(16)20)9-15-6-8-19(21)17(11-15)13(3)4/h5-8,10-13H,9,20-21H2,1-4H3

Properties

TA100: Mutagenicity for strain TA100 + S9 metabolism [[lg(revertants/nmol)]]

ValueSource or prediction
-100

experimental value

Mutagenicity: Mutagenic class

ValueSource or prediction
nM

experimental value

nM

Eq8ter: Mutagenic class of homocyclic aromatic amines (Mutagenic class. M - mutagenic; nM - non-mutagenic)