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: | 28159-98-0 | |
|---|---|---|
| Name: | Cybutryne | |
| Description: | ||
| Labels: | training | |
| CAS: | 28159-98-0 | |
| InChi Code: | InChI=1S/C11H19N5S/c1-11(2,3)16-9-13-8(12-7-5-6-7)14-10(15-9)17-4/h7H,5-6H2,1-4H3,(H2,12,13,14,15,16) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.018981032 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |