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: | 219947-95-2 | |
|---|---|---|
| Name: | 1-Hexadecyl-3-methylimidazolium hexafluorophosphate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 219947-95-2 | |
| InChi Code: | InChI=1S/C20H39N2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-19-18-21(2)20-22/h18-20H,3-17H2,1-2H3/q+1 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.025585498 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |