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: | 5424-37-3 | |
|---|---|---|
| Name: | Aminoquinuride dihydrochloride | |
| Description: | ||
| Labels: | eval | |
| CAS: | 5424-37-3 | |
| InChi Code: | InChI=1S/C21H20N6O/c1-11-7-17(22)15-9-13(3-5-19(15)24-11)26-21(28)27-14-4-6-20-16(10-14)18(23)8-12(2)25-20/h3-10H,1-2H3,(H2,22,24)(H2,23,25)(H2,26,27,28) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.123400234 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |