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: | 107-54-0 | |
|---|---|---|
| Name: | 3,5-Dimethyl-1-hexyn-3-ol | |
| Description: | ||
| Labels: | training | |
| CAS: | 107-54-0 | |
| InChi Code: | InChI=1S/C8H14O/c1-5-8(4,9)6-7(2)3/h1,7,9H,6H2,2-4H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.003461006 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |