Garcia-Sosa, A. T.; Maran, U. Using combined docking, chemical fingerprints, and Bayesian classifiers for the androgen receptor binding activity of the CoMPARA data. Toxicological Sciences 2020.
Compound
| ID: | 80-43-3 | |
|---|---|---|
| Name: | Dicumyl peroxide | |
| Description: | ||
| Labels: | training | |
| CAS: | 80-43-3 | |
| InChi Code: | InChI=1S/C18H22O2/c1-17(2,15-11-7-5-8-12-15)19-20-18(3,4)16-13-9-6-10-14-16/h5-14H,1-4H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.083900107 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |