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: | 2694-54-4 | |
|---|---|---|
| Name: | Triallyl trimellitate | |
| Description: | ||
| Labels: | training | |
| CAS: | 2694-54-4 | |
| InChi Code: | InChI=1S/C18H18O6/c1-4-9-22-16(19)13-7-8-14(17(20)23-10-5-2)15(12-13)18(21)24-11-6-3/h4-8,12H,1-3,9-11H2 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.050596042 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |