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

Formula:C13H8O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(2,4-dichlorophenyl)-1-(furan-2-yl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-(2,4-dichlorophenyl)-1-(furan-2-yl)prop-2-en-1-one
MolecularFormula	C13H8O2Cl2
Smiles	O=C(/C=C/c(ccc(Cl)c1)c1Cl)c1ccco1
InChI	InChI=1S/C13H8Cl2O2/c14-10-5-3-9(11(15)8-10)4-6-12(16)13-2-1-7-17-13/h1-8H
InChIK	CGFDRFIZOVHGDL-UHFFFAOYSA-N
TotalMolweight	267.111
Molweight	267.111
MonoisotopicMass	265.990134
CLogP	3.7045
CLogS	-4.994
H Acceptors	2
TotalSurfaceArea	197.8
Relative PSA	0.13726
PolarSurfaceArea	30.21
Druglikeness	0.73672
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.64706
Fragments	1
Non HAtoms	17
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
StereoCon

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