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: | 80-56-8 | |
|---|---|---|
| Name: | alpha-Pinene | |
| Description: | ||
| Labels: | training, eval | |
| CAS: | 80-56-8 | |
| InChi Code: | InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.037852469 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |