[(Z)-[(2E,4E,6E)-7-(4-fluorophenyl)hepta-2,4,6-trienylidene]amino]urea

Formula:C14H14N3OF Mutagenic:none Tumorigenic:none Reproductive Effective:none [(Z)-[(2E,4E,6E)-7-(4-fluorophenyl)hepta-2,4,6-trienylidene]amino]urea is a drug-like molecule.

MolName[(Z)-[(2E,4E,6E)-7-(4-fluorophenyl)hepta-2,4,6-trienylidene]amino]urea
MolecularFormulaC14H14N3OF
SmilesNC(N/N=C\C=C\C=C\C=C\c(cc1)ccc1F)=O
InChIInChI=1S/C14H14FN3O/c15-13-9-7-12(8-10-13)6-4-2-1-3-5-11-17-18-14(16)19/h1-11H,(H3,16,18,19)
InChIKDTLJHCBHVHJBNC-UHFFFAOYSA-N
TotalMolweight259.283
Molweight259.283
MonoisotopicMass259.11209
CLogP2.5676
CLogS-4.044
H Acceptors4
H Donors2
TotalSurfaceArea221.6
Relative PSA0.23141
PolarSurfaceArea67.48
Druglikeness3.211
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.84211
Fragments1
Non HAtoms19
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond5
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Symmetricatoms2
Amides1
StereoCon

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