(E)-3-(2,3-dihydro-1-benzofuran-5-yl)-1-phenylprop-2-en-1-one

Formula:C17H14O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(2,3-dihydro-1-benzofuran-5-yl)-1-phenylprop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-(2,3-dihydro-1-benzofuran-5-yl)-1-phenylprop-2-en-1-one
MolecularFormula	C17H14O2
Smiles	O=C(/C=C/c(cc1)cc2c1OCC2)c1ccccc1
InChI	InChI=1S/C17H14O2/c18-16(14-4-2-1-3-5-14)8-6-13-7-9-17-15(12-13)10-11-19-17/h1-9,12H,10-11H2
InChIK	WBRIJHYFOFAUIH-UHFFFAOYSA-N
TotalMolweight	250.296
Molweight	250.296
MonoisotopicMass	250.09938
CLogP	3.5296
CLogS	-4.207
H Acceptors	2
TotalSurfaceArea	201.29
Relative PSA	0.11446
PolarSurfaceArea	26.3
Druglikeness	-0.39359
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.63158
Fragments	1
Non HAtoms	19
NonCHAtoms	2
Electronegative Atoms	2
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	2
StereoCon

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