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: | 67-47-0 | |
|---|---|---|
| Name: | 5-(Hydroxymethyl)-2-furfural | |
| Description: | ||
| Labels: | eval | |
| CAS: | 67-47-0 | |
| InChi Code: | InChI=1S/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H2 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.02399696 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |