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: | 16051-77-7 | |
|---|---|---|
| Name: | Isosorbide 5-mononitrate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 16051-77-7 | |
| InChi Code: | InChI=1S/C6H9NO6/c8-3-1-11-6-4(13-7(9)10)2-12-5(3)6/h3-6,8H,1-2H2 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.00336255 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |