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: | 538-74-9 | |
|---|---|---|
| Name: | Benzyl sulfide | |
| Description: | ||
| Labels: | eval | |
| CAS: | 538-74-9 | |
| InChi Code: | InChI=1S/C14H14S/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h1-10H,11-12H2 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.102861519 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |