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: | 87-18-3 | |
|---|---|---|
| Name: | 4-tert-Butylphenyl salicylate | |
| Description: | ||
| Labels: | training | |
| CAS: | 87-18-3 | |
| InChi Code: | InChI=1S/C17H18O3/c1-17(2,3)12-8-10-13(11-9-12)20-16(19)14-6-4-5-7-15(14)18/h4-11,18H,1-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.219199896 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |