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: | 97-36-9 | |
|---|---|---|
| Name: | N-(2,4-Dimethylphenyl)-3-oxobutanamide | |
| Description: | ||
| Labels: | eval | |
| CAS: | 97-36-9 | |
| InChi Code: | InChI=1S/C12H15NO2/c1-8-4-5-11(9(2)6-8)13-12(15)7-10(3)14/h4-6H,7H2,1-3H3,(H,13,15) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.054576822 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |