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: | 633-03-4 | |
|---|---|---|
| Name: | Brilliant Green | |
| Description: | ||
| Labels: | eval | |
| CAS: | 633-03-4 | |
| InChi Code: | InChI=1S/C27H33N2/c1-5-28(6-2)25-18-14-23(15-19-25)27(22-12-10-9-11-13-22)24-16-20-26(21-17-24)29(7-3)8-4/h9-21H,5-8H2,1-4H3/q+1 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.199792246 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |