(E)-3-[2-(2-amino-2-oxoethoxy)phenyl]-N-(4-chlorophenyl)-2-cyanoprop-2-enamide

Formula:C18H14N3O3Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-[2-(2-amino-2-oxoethoxy)phenyl]-N-(4-chlorophenyl)-2-cyanoprop-2-enamide is a drug-like molecule.

MolName	(E)-3-[2-(2-amino-2-oxoethoxy)phenyl]-N-(4-chlorophenyl)-2-cyanoprop-2-enamide
MolecularFormula	C18H14N3O3Cl
Smiles	NC(COc1c(/C=C(/C(Nc(cc2)ccc2Cl)=O)\C#N)cccc1)=O
InChI	InChI=1S/C18H14ClN3O3/c19-14-5-7-15(8-6-14)22-18(24)13(10-20)9-12-3-1-2-4-16(12)25-11-17(21)23/h1-9H,11H2,(H2,21,23)(H,22,24)
InChIK	OZFCXOUZOMQXBP-UHFFFAOYSA-N
TotalMolweight	355.78
Molweight	355.78
MonoisotopicMass	355.072369
CLogP	2.2565
CLogS	-4.375
H Acceptors	6
H Donors	2
TotalSurfaceArea	274.1
Relative PSA	0.27862
PolarSurfaceArea	105.21
Druglikeness	-1.237
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.6
Fragments	1
Non HAtoms	25
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	2
Amides	2
StereoCon

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