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: | 17506-66-0 | |
|---|---|---|
| Name: | Oxypertine hydrochloride | |
| Description: | ||
| Labels: | eval | |
| CAS: | 17506-66-0 | |
| InChi Code: | InChI=1S/C23H29N3O2/c1-17-19(20-15-22(27-2)23(28-3)16-21(20)24-17)9-10-25-11-13-26(14-12-25)18-7-5-4-6-8-18/h4-8,15-16,24H,9-14H2,1-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.156051084 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |