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: | 32 | |
|---|---|---|
| Name: | Picene | |
| Description: | ||
| Labels: | ||
| CAS: | 213-46-7 | |
| InChi Code: | InChI=1S/C22H14/c1-3-7-17-15(5-1)9-11-21-19(17)13-14-20-18-8-4-2-6-16(18)10-12-22(20)21/h1-14H |
Properties
Mutagenicity: Mutagenicity on human h1A1v2 cells i
| Value | Source or prediction |
|---|---|
| no |
experimental value |
| no |
k-NN: Full k-NN model (Training set) |
| yes |
CART: Full CART model (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID8073895 | US EPA CompTox Dashboard |