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: | 68694-11-1 | |
|---|---|---|
| Name: | Triflumizole | |
| Description: | ||
| Labels: | training | |
| CAS: | 68694-11-1 | |
| InChi Code: | InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3/b21-14+ |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.521332113 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |