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: | 4418-26-2 | |
|---|---|---|
| Name: | Sodium dehydroacetate | |
| Description: | ||
| Labels: | training | |
| CAS: | 4418-26-2 | |
| InChi Code: | InChI=1S/C8H8O4/c1-4-3-6(10)7(5(2)9)8(11)12-4/h3,9H,1-2H3/b7-5+ |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.021493901 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |