(E)-3-(1,3-benzodioxol-5-yl)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]prop-2-enamide

Formula:C18H14N3O3Cl Mutagenic:none Tumorigenic:none Reproductive Effective:high (E)-3-(1,3-benzodioxol-5-yl)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]prop-2-enamide is a drug-like molecule.

MolName(E)-3-(1,3-benzodioxol-5-yl)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]prop-2-enamide
MolecularFormulaC18H14N3O3Cl
SmilesO=C(/C=C/c(cc1)cc2c1OCO2)NCc1cn(cc(cc2)Cl)c2n1
InChIInChI=1S/C18H14ClN3O3/c19-13-3-5-17-21-14(10-22(17)9-13)8-20-18(23)6-2-12-1-4-15-16(7-12)25-11-24-15/h1-7,9-10H,8,11H2,(H,20,23)
InChIKGBBMKNHFCHTXSC-UHFFFAOYSA-N
TotalMolweight355.78
Molweight355.78
MonoisotopicMass355.072369
CLogP2.5596
CLogS-6.066
H Acceptors6
H Donors1
TotalSurfaceArea262.18
Relative PSA0.24189
PolarSurfaceArea64.86
Druglikeness1.4753
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functions
Shape Index0.64
Fragments1
Non HAtoms25
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond4
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms15
Sp3Atoms4
Amides1
Aromatic Nitrogens2
BasicNitrogens1
StereoCon

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