(E)-3-(2,3,4,5,6-pentafluorophenyl)-1-(4-phenylphenyl)prop-2-en-1-one

Formula:C21H11OF5 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(2,3,4,5,6-pentafluorophenyl)-1-(4-phenylphenyl)prop-2-en-1-one is not a drug-like molecule.

MolName	(E)-3-(2,3,4,5,6-pentafluorophenyl)-1-(4-phenylphenyl)prop-2-en-1-one
MolecularFormula	C21H11OF5
Smiles	O=C(/C=C/c(c(F)c(c(F)c1F)F)c1F)c(cc1)ccc1-c1ccccc1
InChI	InChI=1S/C21H11F5O/c22-17-15(18(23)20(25)21(26)19(17)24)10-11-16(27)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-11H
InChIK	ZJZBJYPJYZUMSC-UHFFFAOYSA-N
TotalMolweight	374.307
Molweight	374.307
MonoisotopicMass	374.073005
CLogP	5.467
CLogS	-7.496
H Acceptors	1
TotalSurfaceArea	268.78
Relative PSA	0.048516
PolarSurfaceArea	17.07
Druglikeness	-1.2275
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	polyhalo aromatic ring
Shape Index	0.59259
Fragments	1
Non HAtoms	27
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Symmetricatoms	8
StereoCon

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