10967/234 - QDB Compounds

QsarDB Repository

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:84852-53-9
Name:1,1'-Ethane-1,2-diylbis(pentabromobenzene)
Description:
Labels:eval
CAS:84852-53-9
InChi Code:InChI=1S/C14H4Br10/c15-5-3(6(16)10(20)13(23)9(5)19)1-2-4-7(17)11(21)14(24)12(22)8(4)18/h1-2H2

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.030908258

Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class)