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: | 113-07-5 | |
|---|---|---|
| Name: | Doxapram hydrochloride | |
| Description: | ||
| Labels: | eval | |
| CAS: | 113-07-5 | |
| InChi Code: | InChI=1S/C24H30N2O2/c1-2-26-19-22(13-14-25-15-17-28-18-16-25)24(23(26)27,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,22H,2,13-19H2,1H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.286636708 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |