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: | 136790-76-6 | |
|---|---|---|
| Name: | Lubiprostone | |
| Description: | ||
| Labels: | eval | |
| CAS: | 136790-76-6 | |
| InChi Code: | InChI=1S/C20H32F2O5/c1-2-3-11-19(21,22)20(26)12-10-15-14(16(23)13-17(15)27-20)8-6-4-5-7-9-18(24)25/h14-15,17,26H,2-13H2,1H3,(H,24,25) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.110133198 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |