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: | 169590-41-4 | |
|---|---|---|
| Name: | Deracoxib | |
| Description: | ||
| Labels: | eval | |
| CAS: | 169590-41-4 | |
| InChi Code: | InChI=1S/C17H14F3N3O3S/c1-26-16-7-2-10(8-13(16)18)15-9-14(17(19)20)22-23(15)11-3-5-12(6-4-11)27(21,24)25/h2-9,17H,1H3,(H2,21,24,25) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.171709557 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |