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: | 2448-68-2 | |
|---|---|---|
| Name: | Pipamperone dihydrochloride | |
| Description: | ||
| Labels: | eval | |
| CAS: | 2448-68-2 | |
| InChi Code: | InChI=1S/C21H30FN3O2/c22-18-8-6-17(7-9-18)19(26)5-4-12-24-15-10-21(11-16-24,20(23)27)25-13-2-1-3-14-25/h6-9H,1-5,10-16H2,(H2,23,27) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.031997424 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |