Garcia-Sosa, A. T.; Maran, U. Combined Naïve Bayesian, chemical fingerprints, and molecular docking classifiers to model and predict androgen receptor binding activity data for environmentally- and health-sensitive substances. Int. J. Mol. Sci. 2021, 22, 6695.
Compound
| ID: | 6807-17-6 | |
|---|---|---|
| Name: | 4,4'-(4-Methylpentane-2,2-diyl)diphenol | |
| Description: | ||
| Labels: | eval | |
| CAS: | 6807-17-6 | |
| InChi Code: | InChI=1S/C18H22O2/c1-13(2)12-18(3,14-4-8-16(19)9-5-14)15-6-10-17(20)11-7-15/h4-11,13,19-20H,12H2,1-3H3 |
Properties
BindingClass: Activity in Androgen Receptor
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 1 |
Procedure_13: Multivariate Logistic Regression Model (Evaluation set) |