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: | 94-26-8 | |
|---|---|---|
| Name: | Butylparaben | |
| Description: | ||
| Labels: | training | |
| CAS: | 94-26-8 | |
| InChi Code: | InChI=1S/C11H14O3/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7,12H,2-3,8H2,1H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.073857085 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |