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: | 101001-34-7 | |
|---|---|---|
| Name: | Pamicogrel | |
| Description: | ||
| Labels: | eval | |
| CAS: | 101001-34-7 | |
| InChi Code: | InChI=1S/C25H24N2O4S/c1-4-31-22(28)16-27-15-5-6-21(27)25-26-23(17-7-11-19(29-2)12-8-17)24(32-25)18-9-13-20(30-3)14-10-18/h5-15H,4,16H2,1-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.117676779 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |