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: | 747-36-4 | |
|---|---|---|
| Name: | Hydroxychloroquine sulfate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 747-36-4 | |
| InChi Code: | InChI=1S/C18H26ClN3O/c1-3-22(11-12-23)10-4-5-14(2)21-17-8-9-20-18-13-15(19)6-7-16(17)18/h6-9,13-14,23H,3-5,10-12H2,1-2H3,(H,20,21) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.150108452 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |