(E)-1-(1-benzofuran-2-yl)-3-naphthalen-1-ylprop-2-en-1-one

Formula:C21H14O2 Mutagenic:none Tumorigenic:high Reproductive Effective:none (E)-1-(1-benzofuran-2-yl)-3-naphthalen-1-ylprop-2-en-1-one is not a drug-like molecule.

MolName	(E)-1-(1-benzofuran-2-yl)-3-naphthalen-1-ylprop-2-en-1-one
MolecularFormula	C21H14O2
Smiles	O=C(/C=C/c1cccc2ccccc12)c1cc(cccc2)c2o1
InChI	InChI=1S/C21H14O2/c22-19(21-14-17-7-2-4-11-20(17)23-21)13-12-16-9-5-8-15-6-1-3-10-18(15)16/h1-14H
InChIK	WOELOJGPZBZFRM-UHFFFAOYSA-N
TotalMolweight	298.34
Molweight	298.34
MonoisotopicMass	298.09938
CLogP	5.0038
CLogS	-6.629
H Acceptors	2
TotalSurfaceArea	236.16
Relative PSA	0.11496
PolarSurfaceArea	30.21
Druglikeness	0.85563
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.56522
Fragments	1
Non HAtoms	23
NonCHAtoms	2
Electronegative Atoms	2
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	19
StereoCon

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