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: | 131-48-6 | |
|---|---|---|
| Name: | Aceneuramic acid | |
| Description: | ||
| Labels: | eval | |
| CAS: | 131-48-6 | |
| InChi Code: | InChI=1S/C11H19NO9/c1-4(14)12-8(5(15)2-6(16)11(20)21)10(19)9(18)7(17)3-13/h5,7-10,13,15,17-19H,2-3H2,1H3,(H,12,14)(H,20,21) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.011596089 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |