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: | 6624-73-3 | |
|---|---|---|
| Name: | Pentane-1,5-diyl dibenzoate | |
| Description: | ||
| Labels: | training | |
| CAS: | 6624-73-3 | |
| InChi Code: | InChI=1S/C19H20O4/c20-18(16-10-4-1-5-11-16)22-14-8-3-9-15-23-19(21)17-12-6-2-7-13-17/h1-2,4-7,10-13H,3,8-9,14-15H2 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.027667279 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |