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: | 117-84-0 | |
|---|---|---|
| Name: | Dioctyl phthalate | |
| Description: | ||
| Labels: | training | |
| CAS: | 117-84-0 | |
| InChi Code: | InChI=1S/C24H38O4/c1-3-5-7-9-11-15-19-27-23(25)21-17-13-14-18-22(21)24(26)28-20-16-12-10-8-6-4-2/h13-14,17-18H,3-12,15-16,19-20H2,1-2H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.034410664 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |