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:	261
	Name:	4-[2,2,2-trichloro-1-(4-hydroxyphenyl)ethyl]phenol
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: HPTE
	Labels:
	CAS:	2971-36-0
	InChi Code:	InChI=1S/C14H11Cl3O2/c15-14(16,17)13(9-1-5-11(18)6-2-9)10-3-7-12(19)8-4-10/h1-8,13,18-19H

Properties

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

Value	Source or prediction
-0.6	experimental value
-0.8437	Tab2.Model_4: EDC estrogen receptor binding (Training set)