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: | 126-86-3 | |
|---|---|---|
| Name: | 2,4,7,9-Tetramethyl-5-decyne-4,7-diol | |
| Description: | ||
| Labels: | training | |
| CAS: | 126-86-3 | |
| InChi Code: | InChI=1S/C14H26O2/c1-11(2)9-13(5,15)7-8-14(6,16)10-12(3)4/h11-12,15-16H,9-10H2,1-6H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.011270213 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |