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: | 14611-52-0 | |
|---|---|---|
| Name: | Selegiline hydrochloride | |
| Description: | ||
| Labels: | eval | |
| CAS: | 14611-52-0 | |
| InChi Code: | InChI=1S/C13H17N/c1-4-10-14(3)12(2)11-13-8-6-5-7-9-13/h1,5-9,12H,10-11H2,2-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.054112347 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |