(E)-2-cyano-3-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-N-phenylprop-2-enamide

Formula:C23H16N2O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-2-cyano-3-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-N-phenylprop-2-enamide is not a drug-like molecule.

MolName	(E)-2-cyano-3-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-N-phenylprop-2-enamide
MolecularFormula	C23H16N2O2Cl2
Smiles	N#C/C(/C(Nc1ccccc1)=O)=C\c(cc1)ccc1OCc(cc1)cc(Cl)c1Cl
InChI	InChI=1S/C23H16Cl2N2O2/c24-21-11-8-17(13-22(21)25)15-29-20-9-6-16(7-10-20)12-18(14-26)23(28)27-19-4-2-1-3-5-19/h1-13H,15H2,(H,27,28)
InChIK	NNEZCJVRKYHFIB-UHFFFAOYSA-N
TotalMolweight	423.298
Molweight	423.298
MonoisotopicMass	422.058882
CLogP	5.5484
CLogS	-6.583
H Acceptors	4
H Donors	1
TotalSurfaceArea	323.01
Relative PSA	0.14879
PolarSurfaceArea	62.12
Druglikeness	-1.9128
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.65517
Fragments	1
Non HAtoms	29
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	4
Amides	1
StereoCon

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