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: | 7492-32-2 | |
|---|---|---|
| Name: | Isopropamide | |
| Description: | ||
| Labels: | eval | |
| CAS: | 7492-32-2 | |
| InChi Code: | InChI=1S/C23H32N2O/c1-18(2)25(5,19(3)4)17-16-23(22(24)26,20-12-8-6-9-13-20)21-14-10-7-11-15-21/h6-15,18-19H,16-17H2,1-5H3,(H-,24,26)/p+1 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.109092949 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |