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: | 1225-60-1 | |
|---|---|---|
| Name: | Isothipendyl hydrochloride | |
| Description: | ||
| Labels: | eval | |
| CAS: | 1225-60-1 | |
| InChi Code: | InChI=1S/C16H19N3S/c1-12(18(2)3)11-19-13-7-4-5-8-14(13)20-15-9-6-10-17-16(15)19/h4-10,12H,11H2,1-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.039841288 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |