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: | 830-89-7 | |
|---|---|---|
| Name: | Albutoin | |
| Description: | ||
| Labels: | eval | |
| CAS: | 830-89-7 | |
| InChi Code: | InChI=1S/C10H16N2OS/c1-4-5-12-9(13)8(6-7(2)3)11-10(12)14/h4,7-8H,1,5-6H2,2-3H3,(H,11,14) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.011699847 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |