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: | 32388-55-9 | |
|---|---|---|
| Name: | 1-Cedr-8-en-9-ylethanone | |
| Description: | ||
| Labels: | training | |
| CAS: | 32388-55-9 | |
| InChi Code: | InChI=1S/C17H26O/c1-10-6-7-15-16(4,5)14-9-17(10,15)8-13(11(14)2)12(3)18/h10,14-15H,6-9H2,1-5H3/t10-,14+,15+,17+/m1/s1 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.18385111 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |