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: | 10094-34-5 | |
|---|---|---|
| Name: | 1,1-Dimethyl-2-phenylethyl butanoate | |
| Description: | ||
| Labels: | training | |
| CAS: | 10094-34-5 | |
| InChi Code: | InChI=1S/C14H20O2/c1-4-8-13(15)16-14(2,3)11-12-9-6-5-7-10-12/h5-7,9-10H,4,8,11H2,1-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.039824529 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |