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: | 18479-58-8 | |
|---|---|---|
| Name: | 1,1,5-Trimethyl-6-heptenol | |
| Description: | ||
| Labels: | eval | |
| CAS: | 18479-58-8 | |
| InChi Code: | InChI=1S/C10H20O/c1-5-9(2)7-6-8-10(3,4)11/h5,9,11H,1,6-8H2,2-4H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.003690981 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |