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:23778-52-1
Name:2,5,8,11,14-Pentaoxahexadecan-16-ol
Description:
Labels:eval
CAS:23778-52-1
InChi Code:InChI=1S/C11H24O6/c1-13-4-5-15-8-9-17-11-10-16-7-6-14-3-2-12/h12H,2-11H2,1H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.003532545

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