10967/186 - QDB Compounds

QsarDB Repository

Papa, E.; Pilutti, P.; Gramatica, P. Prediction of PAH mutagenicity in human cells by QSAR classification. SAR and QSAR in Environmental Research 2008, 19, 115–127.

Compound

ID:23
Name:Benzo[ghi]fluoranthene
Description:
Labels:
CAS:203-12-3
InChi Code:InChI=1S/C18H10/c1-3-11-7-9-13-10-8-12-4-2-6-15-14(5-1)16(11)18(13)17(12)15/h1-10H

Properties

Mutagenicity: Mutagenicity on human h1A1v2 cells i

ValueSource or prediction
no

experimental value

yes

k-NN: Full k-NN model (Training set)

no

CART: Full CART model (Training set)

Links to External Resources