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: | 10040-45-6 | |
|---|---|---|
| Name: | Picosulfate sodium | |
| Description: | ||
| Labels: | eval | |
| CAS: | 10040-45-6 | |
| InChi Code: | InChI=1S/C18H15NO8S2/c20-28(21,22)26-15-8-4-13(5-9-15)18(17-3-1-2-12-19-17)14-6-10-16(11-7-14)27-29(23,24)25/h1-12,18H,(H,20,21,22)(H,23,24,25) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.123748004 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |