(Z)-1-(4-fluorophenyl)-3-(3-nitroanilino)prop-2-en-1-one

Formula:C15H11N2O3F Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-(4-fluorophenyl)-3-(3-nitroanilino)prop-2-en-1-one is a drug-like molecule.

MolName	(Z)-1-(4-fluorophenyl)-3-(3-nitroanilino)prop-2-en-1-one
MolecularFormula	C15H11N2O3F
Smiles	[O-][N+](c1cccc(N/C=C\C(c(cc2)ccc2F)=O)c1)=O
InChI	InChI=1S/C15H11FN2O3/c16-12-6-4-11(5-7-12)15(19)8-9-17-13-2-1-3-14(10-13)18(20)21/h1-10,17H
InChIK	WJHOHPFCHMPUHL-UHFFFAOYSA-N
TotalMolweight	286.261
Molweight	286.261
MonoisotopicMass	286.075371
CLogP	1.6537
CLogS	-4.56
H Acceptors	5
H Donors	1
TotalSurfaceArea	218.75
Relative PSA	0.25106
PolarSurfaceArea	74.92
Druglikeness	-5.9225
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.66667
Fragments	1
Non HAtoms	21
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	2
AcidicOxygens	1
StereoCon

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