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: | 58769-20-3 | |
|---|---|---|
| Name: | Kadethrin | |
| Description: | ||
| Labels: | eval | |
| CAS: | 58769-20-3 | |
| InChi Code: | InChI=1S/C23H24O4S/c1-23(2)19(12-17-8-9-28-22(17)25)20(23)21(24)27-14-16-11-18(26-13-16)10-15-6-4-3-5-7-15/h3-7,11-13,19-20H,8-10,14H2,1-2H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.347731804 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |