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: | 14765-30-1 | |
|---|---|---|
| Name: | 2-sec-Butylcyclohexanone | |
| Description: | ||
| Labels: | training | |
| CAS: | 14765-30-1 | |
| InChi Code: | InChI=1S/C10H18O/c1-3-8(2)9-6-4-5-7-10(9)11/h8-9H,3-7H2,1-2H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.034529791 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |