(E)-3-(2,4-dichlorophenyl)-1-(4-fluorophenyl)prop-2-en-1-one

Formula:C15H9OCl2F Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(2,4-dichlorophenyl)-1-(4-fluorophenyl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-(2,4-dichlorophenyl)-1-(4-fluorophenyl)prop-2-en-1-one
MolecularFormula	C15H9OCl2F
Smiles	O=C(/C=C/c(ccc(Cl)c1)c1Cl)c(cc1)ccc1F
InChI	InChI=1S/C15H9Cl2FO/c16-12-5-1-10(14(17)9-12)4-8-15(19)11-2-6-13(18)7-3-11/h1-9H
InChIK	JXJPSCKSDZPJKP-UHFFFAOYSA-N
TotalMolweight	295.139
Molweight	295.139
MonoisotopicMass	294.001447
CLogP	4.6166
CLogS	-5.626
H Acceptors	1
TotalSurfaceArea	214.46
Relative PSA	0.060804
PolarSurfaceArea	17.07
Druglikeness	-1.1423
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.68421
Fragments	1
Non HAtoms	19
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Symmetricatoms	2
StereoCon

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