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: | 52225-20-4 | |
|---|---|---|
| Name: | dl-alpha-Tocopheryl acetate | |
| Description: | ||
| Labels: | training | |
| CAS: | 52225-20-4 | |
| InChi Code: | InChI=1S/C31H52O3/c1-21(2)13-10-14-22(3)15-11-16-23(4)17-12-19-31(9)20-18-28-26(7)29(33-27(8)32)24(5)25(6)30(28)34-31/h21-23H,10-20H2,1-9H3/t22-,23-,31-/m1/s1 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.084373401 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |