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: | 717-74-8 | |
|---|---|---|
| Name: | 1,3,5-Triisopropylbenzene | |
| Description: | ||
| Labels: | training | |
| CAS: | 717-74-8 | |
| InChi Code: | InChI=1S/C15H24/c1-10(2)13-7-14(11(3)4)9-15(8-13)12(5)6/h7-12H,1-6H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.042575695 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |