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: | 34661-75-1 | |
|---|---|---|
| Name: | Urapidil | |
| Description: | ||
| Labels: | eval | |
| CAS: | 34661-75-1 | |
| InChi Code: | InChI=1S/C20H29N5O3/c1-22-18(15-19(26)23(2)20(22)27)21-9-6-10-24-11-13-25(14-12-24)16-7-4-5-8-17(16)28-3/h4-5,7-8H,6,9-15H2,1-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.119910198 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |