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:	80-05-7
	Name:	Bisphenol A
	Description:
	Labels:	training
	CAS:	80-05-7
	InChi Code:	InChI=1S/C15H16O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12/h3-10,16-17H,1-2H3

Properties

bindingClass: Androgen Receptor Binding Class

Value	Source or prediction
1	experimental value
0.645708331	Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class)