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: | 69-89-6 | |
|---|---|---|
| Name: | Xanthine | |
| Description: | ||
| Labels: | eval | |
| CAS: | 69-89-6 | |
| InChi Code: | InChI=1S/C5H4N4O2/c10-4-2-3(7-1-6-2)8-5(11)9-4/h1H,(H3,6,7,8,9,10,11) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.025558841 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |