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: | 205-99-2 | |
|---|---|---|
| Name: | Benzo(b)fluoranthene | |
| Description: | ||
| Labels: | training | |
| CAS: | 205-99-2 | |
| InChi Code: | InChI=1S/C20H12/c1-2-7-14-13(6-1)12-19-16-9-4-3-8-15(16)18-11-5-10-17(14)20(18)19/h1-12H |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.187075252 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |