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: | 3737-09-5 | |
|---|---|---|
| Name: | Disopyramide | |
| Description: | ||
| Labels: | eval | |
| CAS: | 3737-09-5 | |
| InChi Code: | InChI=1S/C21H29N3O/c1-16(2)24(17(3)4)15-13-21(20(22)25,18-10-6-5-7-11-18)19-12-8-9-14-23-19/h5-12,14,16-17H,13,15H2,1-4H3,(H2,22,25) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.032136537 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |