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: | 500-38-9 | |
|---|---|---|
| Name: | Nordihydroguaiaretic acid | |
| Description: | ||
| Labels: | training | |
| CAS: | 500-38-9 | |
| InChi Code: | InChI=1S/C18H22O4/c1-11(7-13-3-5-15(19)17(21)9-13)12(2)8-14-4-6-16(20)18(22)10-14/h3-6,9-12,19-22H,7-8H2,1-2H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.24434273 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |