(E)-3-(4-bromophenyl)-N-(4-fluorophenyl)prop-2-enamide

Formula:C15H11NOBrF Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(4-bromophenyl)-N-(4-fluorophenyl)prop-2-enamide is a drug-like molecule.

MolName(E)-3-(4-bromophenyl)-N-(4-fluorophenyl)prop-2-enamide
MolecularFormulaC15H11NOBrF
SmilesO=C(/C=C/c(cc1)ccc1Br)Nc(cc1)ccc1F
InChIInChI=1S/C15H11BrFNO/c16-12-4-1-11(2-5-12)3-10-15(19)18-14-8-6-13(17)7-9-14/h1-10H,(H,18,19)
InChIKCOSZHEYFOCGPLB-UHFFFAOYSA-N
TotalMolweight320.16
Molweight320.16
MonoisotopicMass319.000803
CLogP3.9623
CLogS-4.646
H Acceptors2
H Donors1
TotalSurfaceArea213.71
Relative PSA0.11464
PolarSurfaceArea29.1
Druglikeness-3.5689
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.73684
Fragments1
Non HAtoms19
NonCHAtoms4
Electronegative Atoms4
Rotatable Bond3
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Symmetricatoms4
Amides1
StereoCon

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