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

Formula:C20H10N2O2Cl4 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-2-cyano-N-(3,5-dichlorophenyl)-3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enamide is not a drug-like molecule.

MolName	(E)-2-cyano-N-(3,5-dichlorophenyl)-3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enamide
MolecularFormula	C20H10N2O2Cl4
Smiles	N#C/C(/C(Nc1cc(Cl)cc(Cl)c1)=O)=C\c1ccc(-c2cccc(Cl)c2Cl)o1
InChI	InChI=1S/C20H10Cl4N2O2/c21-12-7-13(22)9-14(8-12)26-20(27)11(10-25)6-15-4-5-18(28-15)16-2-1-3-17(23)19(16)24/h1-9H,(H,26,27)
InChIK	BTJKUTYEEOOMCR-UHFFFAOYSA-N
TotalMolweight	452.123
Molweight	452.123
MonoisotopicMass	449.949636
CLogP	6.3512
CLogS	-8.174
H Acceptors	4
H Donors	1
TotalSurfaceArea	319.78
Relative PSA	0.16314
PolarSurfaceArea	66.03
Druglikeness	-0.70327
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.53571
Fragments	1
Non HAtoms	28
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Symmetricatoms	3
Amides	1
StereoCon

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