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: | 21564-17-0 | |
|---|---|---|
| Name: | 2-(Thiocyanomethylthio)benzothiazole | |
| Description: | ||
| Labels: | training | |
| CAS: | 21564-17-0 | |
| InChi Code: | InChI=1S/C9H6N2S3/c10-5-12-6-13-9-11-7-3-1-2-4-8(7)14-9/h1-4H,6H2 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.025503014 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |