(Z)-3-[5-(2,6-dichlorophenyl)furan-2-yl]-2-phenylprop-2-enenitrile

Formula:C19H11NOCl2 Mutagenic:high Tumorigenic:high Reproductive Effective:none (Z)-3-[5-(2,6-dichlorophenyl)furan-2-yl]-2-phenylprop-2-enenitrile is not a drug-like molecule.

MolName	(Z)-3-[5-(2,6-dichlorophenyl)furan-2-yl]-2-phenylprop-2-enenitrile
MolecularFormula	C19H11NOCl2
Smiles	N#C/C(/c1ccccc1)=C\c1ccc(-c(c(Cl)ccc2)c2Cl)o1
InChI	InChI=1S/C19H11Cl2NO/c20-16-7-4-8-17(21)19(16)18-10-9-15(23-18)11-14(12-22)13-5-2-1-3-6-13/h1-11H
InChIK	RZXIBNTXLFJUKL-UHFFFAOYSA-N
TotalMolweight	340.208
Molweight	340.208
MonoisotopicMass	339.021768
CLogP	5.4835
CLogS	-6.561
H Acceptors	2
TotalSurfaceArea	259.73
Relative PSA	0.10653
PolarSurfaceArea	36.93
Druglikeness	-3.4929
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.56522
Fragments	1
Non HAtoms	23
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Symmetricatoms	5
StereoCon

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