Gramatica, P.; Cassani, S.; Chirico, N. QSARINS-chem: Insubria datasets and new QSAR/QSPR models for environmental pollutants in QSARINS. J. Comput. Chem. 2014, 35, 1036–1044.

Compound

	ID:	303
	Name:	3-(4-hydroxyphenyl)-1-phenylprop-2-en-1-one
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: 4-Hydroxychalcone
	Labels:
	CAS:	20426-12-4
	InChi Code:	InChI=1S/C15H12O2/c16-14-9-6-12(7-10-14)8-11-15(17)13-4-2-1-3-5-13/h1-11,16H

Properties

M4.logRBA: Estrogen receptor relative binding affinity as log(RBA)

Value	Source or prediction
-2.55	experimental value
-1.9913	Tab2.Model_4: EDC estrogen receptor binding (Training set)