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: | 2008-41-5 | |
|---|---|---|
| Name: | Butylate | |
| Description: | ||
| Labels: | training | |
| CAS: | 2008-41-5 | |
| InChi Code: | InChI=1S/C11H23NOS/c1-6-14-11(13)12(7-9(2)3)8-10(4)5/h9-10H,6-8H2,1-5H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.008028462 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |