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: | 84088-42-6 | |
|---|---|---|
| Name: | Roquinimex | |
| Description: | ||
| Labels: | eval | |
| CAS: | 84088-42-6 | |
| InChi Code: | InChI=1S/C18H16N2O3/c1-19(12-8-4-3-5-9-12)17(22)15-16(21)13-10-6-7-11-14(13)20(2)18(15)23/h3-11,15H,1-2H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.170250461 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |