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:	4861-85-2
	Name:	Isopropyl phenylacetate
	Description:
	Labels:	eval
	CAS:	4861-85-2
	InChi Code:	InChI=1S/C11H14O2/c1-9(2)13-11(12)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3

Properties

bindingClass: Androgen Receptor Binding Class

Value	Source or prediction
0	experimental value
0.024416803	Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class)