(E)-1-(1-benzofuran-2-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one

Formula:C19H14O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-1-(1-benzofuran-2-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-1-(1-benzofuran-2-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one
MolecularFormula	C19H14O4
Smiles	O=C(/C=C/c(cc1)cc2c1OCCO2)c1cc(cccc2)c2o1
InChI	InChI=1S/C19H14O4/c20-15(18-12-14-3-1-2-4-16(14)23-18)7-5-13-6-8-17-19(11-13)22-10-9-21-17/h1-8,11-12H,9-10H2
InChIK	IDFAZSZLKUMPMI-UHFFFAOYSA-N
TotalMolweight	306.316
Molweight	306.316
MonoisotopicMass	306.08921
CLogP	3.7882
CLogS	-5.205
H Acceptors	4
TotalSurfaceArea	235.58
Relative PSA	0.20014
PolarSurfaceArea	48.67
Druglikeness	-6.1919
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6087
Fragments	1
Non HAtoms	23
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	4
StereoCon

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