(E)-2-cyano-3-[5-(2,6-dichlorophenyl)furan-2-yl]-N-phenylprop-2-enamide

Formula:C20H12N2O2Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-2-cyano-3-[5-(2,6-dichlorophenyl)furan-2-yl]-N-phenylprop-2-enamide is not a drug-like molecule.

MolName	(E)-2-cyano-3-[5-(2,6-dichlorophenyl)furan-2-yl]-N-phenylprop-2-enamide
MolecularFormula	C20H12N2O2Cl2
Smiles	N#C/C(/C(Nc1ccccc1)=O)=C\c1ccc(-c(c(Cl)ccc2)c2Cl)o1
InChI	InChI=1S/C20H12Cl2N2O2/c21-16-7-4-8-17(22)19(16)18-10-9-15(26-18)11-13(12-23)20(25)24-14-5-2-1-3-6-14/h1-11H,(H,24,25)
InChIK	LUBHAZODUMLAIJ-UHFFFAOYSA-N
TotalMolweight	383.233
Molweight	383.233
MonoisotopicMass	382.027582
CLogP	5.1392
CLogS	-6.702
H Acceptors	4
H Donors	1
TotalSurfaceArea	288.94
Relative PSA	0.18056
PolarSurfaceArea	66.03
Druglikeness	-0.70327
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.57692
Fragments	1
Non HAtoms	26
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Symmetricatoms	5
Amides	1
StereoCon

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