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: | 82558-50-7 | |
|---|---|---|
| Name: | Isoxaben | |
| Description: | ||
| Labels: | training | |
| CAS: | 82558-50-7 | |
| InChi Code: | InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.14245927 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |