(3E,5E)-3,5-bis[(4-fluorophenyl)methylidene]oxan-4-one

Formula:C19H14O2F2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (3E,5E)-3,5-bis[(4-fluorophenyl)methylidene]oxan-4-one is a drug-like molecule.

MolName	(3E,5E)-3,5-bis[(4-fluorophenyl)methylidene]oxan-4-one
MolecularFormula	C19H14O2F2
Smiles	O=C(/C(/COC1)=C/c(cc2)ccc2F)/C1=C/c(cc1)ccc1F
InChI	InChI=1S/C19H14F2O2/c20-17-5-1-13(2-6-17)9-15-11-23-12-16(19(15)22)10-14-3-7-18(21)8-4-14/h1-10H,11-12H2
InChIK	WKMOLEZJQBCNIK-UHFFFAOYSA-N
TotalMolweight	312.314
Molweight	312.314
MonoisotopicMass	312.096186
CLogP	3.8756
CLogS	-4.329
H Acceptors	2
TotalSurfaceArea	236.91
Relative PSA	0.097252
PolarSurfaceArea	26.3
Druglikeness	-2.769
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.65217
Fragments	1
Non HAtoms	23
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	12
StereoCon

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