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: | 24157-81-1 | |
|---|---|---|
| Name: | 2,6-Diisopropylnaphthalene | |
| Description: | ||
| Labels: | training | |
| CAS: | 24157-81-1 | |
| InChi Code: | InChI=1S/C16H20/c1-11(2)13-5-7-16-10-14(12(3)4)6-8-15(16)9-13/h5-12H,1-4H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.095413093 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |