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:13010-08-7
Name:N-Butyl-N'-nitro-N-nitrosoguanidine
Description:
Labels:eval
CAS:13010-08-7
InChi Code:InChI=1S/C5H11N5O3/c1-2-3-4-9(8-11)5(6)7-10(12)13/h2-4H2,1H3,(H2,6,7)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.009904998

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