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: | 3970-62-5 | |
|---|---|---|
| Name: | 2,2-Dimethyl-3-pentanol | |
| Description: | ||
| Labels: | eval | |
| CAS: | 3970-62-5 | |
| InChi Code: | InChI=1S/C7H16O/c1-5-6(8)7(2,3)4/h6,8H,5H2,1-4H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.003452052 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |