(E)-N-(6-chloro-2-phenyl-1H-imidazo[1,2-a]pyridin-4-ium-3-yl)-3-phenylprop-2-enamide

Formula:C22H17N3OCl Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-(6-chloro-2-phenyl-1H-imidazo[1,2-a]pyridin-4-ium-3-yl)-3-phenylprop-2-enamide is a drug-like molecule.

MolName(E)-N-(6-chloro-2-phenyl-1H-imidazo[1,2-a]pyridin-4-ium-3-yl)-3-phenylprop-2-enamide
MolecularFormulaC22H17N3OCl
SmilesO=C(/C=C/c1ccccc1)Nc1c(-c2ccccc2)[nH]c(cc2)[n+]1cc2Cl
InChIInChI=1S/C22H16ClN3O/c23-18-12-13-19-24-21(17-9-5-2-6-10-17)22(26(19)15-18)25-20(27)14-11-16-7-3-1-4-8-16/h1-15H,(H,25,27)/p+1
InChIKHDAHLTKOXVYKJO-UHFFFAOYSA-O
TotalMolweight374.85
Molweight374.85
MonoisotopicMass374.106014
CLogP4.2202
CLogS-7.818
H Acceptors4
H Donors2
TotalSurfaceArea264.21
Relative PSA0.0746
PolarSurfaceArea48.99
Druglikeness-0.22789
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.51852
Fragments1
Non HAtoms27
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond4
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms21
Symmetricatoms4
Amides1
Aromatic Nitrogens2
StereoCon

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