(E)-1-(4-fluorophenyl)-3-[5-(4-nitrophenyl)furan-2-yl]prop-2-en-1-one

Formula:C19H12NO4F Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-1-(4-fluorophenyl)-3-[5-(4-nitrophenyl)furan-2-yl]prop-2-en-1-one is a drug-like molecule.

MolName	(E)-1-(4-fluorophenyl)-3-[5-(4-nitrophenyl)furan-2-yl]prop-2-en-1-one
MolecularFormula	C19H12NO4F
Smiles	[O-][N+](c(cc1)ccc1-c1ccc(/C=C/C(c(cc2)ccc2F)=O)o1)=O
InChI	InChI=1S/C19H12FNO4/c20-15-5-1-13(2-6-15)18(22)11-9-17-10-12-19(25-17)14-3-7-16(8-4-14)21(23)24/h1-12H
InChIK	LERQDSBWHWLNER-UHFFFAOYSA-N
TotalMolweight	337.305
Molweight	337.305
MonoisotopicMass	337.075037
CLogP	3.4219
CLogS	-6.074
H Acceptors	5
TotalSurfaceArea	256.74
Relative PSA	0.22423
PolarSurfaceArea	76.03
Druglikeness	-4.6615
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.68
Fragments	1
Non HAtoms	25
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
Symmetricatoms	4
AcidicOxygens	1
StereoCon

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