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: | 1742-14-9 | |
|---|---|---|
| Name: | 1,1-Bis(3,4-dimethylphenyl)ethane | |
| Description: | ||
| Labels: | training | |
| CAS: | 1742-14-9 | |
| InChi Code: | InChI=1S/C18H22/c1-12-6-8-17(10-14(12)3)16(5)18-9-7-13(2)15(4)11-18/h6-11,16H,1-5H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.091956068 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |