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: | 134605-64-4 | |
|---|---|---|
| Name: | Butafenacil | |
| Description: | ||
| Labels: | training | |
| CAS: | 134605-64-4 | |
| InChi Code: | InChI=1S/C20H18ClF3N2O6/c1-5-8-31-17(29)19(2,3)32-16(28)12-9-11(6-7-13(12)21)26-15(27)10-14(20(22,23)24)25(4)18(26)30/h5-7,9-10H,1,8H2,2-4H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.164469126 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |