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: | 141-92-4 | |
|---|---|---|
| Name: | Hydroxycitronellal dimethyl acetal | |
| Description: | ||
| Labels: | eval | |
| CAS: | 141-92-4 | |
| InChi Code: | InChI=1S/C12H26O3/c1-10(9-11(14-4)15-5)7-6-8-12(2,3)13/h10-11,13H,6-9H2,1-5H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.004443928 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |