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: | 52-49-3 | |
|---|---|---|
| Name: | Trihexyphenidyl hydrochloride | |
| Description: | ||
| Labels: | eval | |
| CAS: | 52-49-3 | |
| InChi Code: | InChI=1S/C20H31NO/c22-20(18-10-4-1-5-11-18,19-12-6-2-7-13-19)14-17-21-15-8-3-9-16-21/h1,4-5,10-11,19,22H,2-3,6-9,12-17H2 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.141490931 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |