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: | 125-65-5 | |
|---|---|---|
| Name: | Pleuromutilin | |
| Description: | ||
| Labels: | eval | |
| CAS: | 125-65-5 | |
| InChi Code: | InChI=1S/C22H34O5/c1-6-20(4)11-16(27-17(25)12-23)21(5)13(2)7-9-22(14(3)19(20)26)10-8-15(24)18(21)22/h6,13-14,16,18-19,23,26H,1,7-12H2,2-5H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.122444728 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |