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: | 77-40-7 | |
|---|---|---|
| Name: | Bisphenol B | |
| Description: | ||
| Labels: | training | |
| CAS: | 77-40-7 | |
| InChi Code: | InChI=1S/C16H18O2/c1-3-16(2,12-4-8-14(17)9-5-12)13-6-10-15(18)11-7-13/h4-11,17-18H,3H2,1-2H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.578168514 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |