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: | 63133-74-4 | |
|---|---|---|
| Name: | 2-(Ethyl(3-methylphenyl)amino)acetonitrile | |
| Description: | ||
| Labels: | eval | |
| CAS: | 63133-74-4 | |
| InChi Code: | InChI=1S/C11H14N2/c1-3-13(8-7-12)11-6-4-5-10(2)9-11/h4-6,9H,3,8H2,1-2H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.100166799 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |