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: | 124832-27-5 | |
|---|---|---|
| Name: | Valacyclovir hydrochloride | |
| Description: | ||
| Labels: | eval | |
| CAS: | 124832-27-5 | |
| InChi Code: | InChI=1S/C13H20N6O4/c1-7(2)8(14)12(21)23-4-3-22-6-19-5-16-9-10(19)17-13(15)18-11(9)20/h5,7-8H,3-4,6,14H2,1-2H3,(H3,15,17,18,20) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.008620774 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |