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: | 331717-63-6 | |
|---|---|---|
| Name: | 1-Ethyl-3-methylimidazolium thiocyanate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 331717-63-6 | |
| InChi Code: | InChI=1S/C6H11N2/c1-3-8-5-4-7(2)6-8/h4-6H,3H2,1-2H3/q+1 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.017371829 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |