(E)-3-(1,3-benzodioxol-5-yl)-N-phenylprop-2-enamide

Formula:C16H13NO3 Mutagenic:none Tumorigenic:none Reproductive Effective:high (E)-3-(1,3-benzodioxol-5-yl)-N-phenylprop-2-enamide is a drug-like molecule.

MolName	(E)-3-(1,3-benzodioxol-5-yl)-N-phenylprop-2-enamide
MolecularFormula	C16H13NO3
Smiles	O=C(/C=C/c(cc1)cc2c1OCO2)Nc1ccccc1
InChI	InChI=1S/C16H13NO3/c18-16(17-13-4-2-1-3-5-13)9-7-12-6-8-14-15(10-12)20-11-19-14/h1-10H,11H2,(H,17,18)
InChIK	OLODFBQVPPIUQA-UHFFFAOYSA-N
TotalMolweight	267.283
Molweight	267.283
MonoisotopicMass	267.089544
CLogP	3.2477
CLogS	-4.209
H Acceptors	4
H Donors	1
TotalSurfaceArea	208.99
Relative PSA	0.21293
PolarSurfaceArea	47.56
Druglikeness	-0.47528
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.65
Fragments	1
Non HAtoms	20
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	2
Amides	1
StereoCon

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