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: | 18835-02-4 | |
|---|---|---|
| Name: | Ethyl 3-acetyl-4-oxopentanoate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 18835-02-4 | |
| InChi Code: | InChI=1S/C9H14O4/c1-4-13-9(12)5-8(6(2)10)7(3)11/h8H,4-5H2,1-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.001701573 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |