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: | NOCAS_47346 | |
|---|---|---|
| Name: | SSR162369 | |
| Description: | ||
| Labels: | training | |
| CAS: | ||
| InChi Code: | InChI=1S/C18H22F2N6O/c19-18(20)8-15(9-21)25(11-18)16(27)10-24-12-6-13-2-3-14(7-12)26(13)17-22-4-1-5-23-17/h1,4-5,12-15,24H,2-3,6-8,10-11H2/t12?,13?,14?,15-/m0/s1 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.151674913 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |