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: | 5444-75-7 | |
|---|---|---|
| Name: | 2-Ethylhexyl benzoate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 5444-75-7 | |
| InChi Code: | InChI=1S/C15H22O2/c1-3-5-9-13(4-2)12-17-15(16)14-10-7-6-8-11-14/h6-8,10-11,13H,3-5,9,12H2,1-2H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.041374811 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |