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: | 108032-11-7 | |
|---|---|---|
| Name: | Bergenin monohydrate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 108032-11-7 | |
| InChi Code: | InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.309136498 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |