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: | 86-29-3 | |
|---|---|---|
| Name: | Diphenylacetonitrile | |
| Description: | ||
| Labels: | eval | |
| CAS: | 86-29-3 | |
| InChi Code: | InChI=1S/C14H11N/c15-11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.064028508 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |