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: | 78415-72-2 | |
|---|---|---|
| Name: | Milrinone | |
| Description: | ||
| Labels: | eval | |
| CAS: | 78415-72-2 | |
| InChi Code: | InChI=1S/C12H9N3O/c1-8-11(9-2-4-14-5-3-9)6-10(7-13)12(16)15-8/h2-6,11H,1H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.106028811 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |