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: | 66346-01-8 | |
|---|---|---|
| Name: | 1-(4-Chlorophenyl)-4,4-dimethyl-pentan-3-one | |
| Description: | ||
| Labels: | eval | |
| CAS: | 66346-01-8 | |
| InChi Code: | InChI=1S/C13H17ClO/c1-13(2,3)12(15)9-6-10-4-7-11(14)8-5-10/h4-5,7-8H,6,9H2,1-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.394204347 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |