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: | 136-45-8 | |
|---|---|---|
| Name: | Dipropyl 2,5-pyridinedicarboxylate | |
| Description: | ||
| Labels: | training | |
| CAS: | 136-45-8 | |
| InChi Code: | InChI=1S/C13H17NO4/c1-3-7-17-12(15)10-5-6-11(14-9-10)13(16)18-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.013346699 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |