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: | 135158-54-2 | |
|---|---|---|
| Name: | Acibenzolar-S-methyl | |
| Description: | ||
| Labels: | training | |
| CAS: | 135158-54-2 | |
| InChi Code: | InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.030355178 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |