1-(4-fluorophenyl)-3-[(E)-2-(furan-2-yl)ethenyl]urea

Formula:C13H11N2O2F Mutagenic:none Tumorigenic:none Reproductive Effective:none 1-(4-fluorophenyl)-3-[(E)-2-(furan-2-yl)ethenyl]urea is a drug-like molecule.

MolName1-(4-fluorophenyl)-3-[(E)-2-(furan-2-yl)ethenyl]urea
MolecularFormulaC13H11N2O2F
SmilesO=C(N/C=C/c1ccco1)Nc(cc1)ccc1F
InChIInChI=1S/C13H11FN2O2/c14-10-3-5-11(6-4-10)16-13(17)15-8-7-12-2-1-9-18-12/h1-9H,(H2,15,16,17)
InChIKJYNSHCYJTHTXCZ-UHFFFAOYSA-N
TotalMolweight246.24
Molweight246.24
MonoisotopicMass246.080456
CLogP2.1125
CLogS-4.155
H Acceptors4
H Donors2
TotalSurfaceArea196.23
Relative PSA0.25516
PolarSurfaceArea54.27
Druglikeness-0.92652
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.72222
Fragments1
Non HAtoms18
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond3
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms11
Symmetricatoms2
Amides2
StereoCon

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