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: | 87760-53-0 | |
|---|---|---|
| Name: | Tandospirone | |
| Description: | ||
| Labels: | eval | |
| CAS: | 87760-53-0 | |
| InChi Code: | InChI=1S/C21H29N5O2/c27-19-17-15-4-5-16(14-15)18(17)20(28)26(19)9-2-1-8-24-10-12-25(13-11-24)21-22-6-3-7-23-21/h3,6-7,15-18H,1-2,4-5,8-14H2 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.02809191 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |