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: | 18127-01-0 | |
|---|---|---|
| Name: | 3-(4-tert-Butylphenyl)propanal | |
| Description: | ||
| Labels: | eval | |
| CAS: | 18127-01-0 | |
| InChi Code: | InChI=1S/C13H18O/c1-13(2,3)12-8-6-11(7-9-12)5-4-10-14/h6-10H,4-5H2,1-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.150977059 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |