(Z)-3-[5-(2,4-dichlorophenyl)furan-2-yl]-2-naphthalen-1-ylprop-2-enenitrile

Formula:C23H13NOCl2 Mutagenic:high Tumorigenic:high Reproductive Effective:none (Z)-3-[5-(2,4-dichlorophenyl)furan-2-yl]-2-naphthalen-1-ylprop-2-enenitrile is not a drug-like molecule.

MolName	(Z)-3-[5-(2,4-dichlorophenyl)furan-2-yl]-2-naphthalen-1-ylprop-2-enenitrile
MolecularFormula	C23H13NOCl2
Smiles	N#C/C(/c1cccc2ccccc12)=C\c1ccc(-c(ccc(Cl)c2)c2Cl)o1
InChI	InChI=1S/C23H13Cl2NO/c24-17-8-10-21(22(25)13-17)23-11-9-18(27-23)12-16(14-26)20-7-3-5-15-4-1-2-6-19(15)20/h1-13H
InChIK	GXGGFVBNKJTBJF-UHFFFAOYSA-N
TotalMolweight	390.268
Molweight	390.268
MonoisotopicMass	389.037418
CLogP	6.6779
CLogS	-8.167
H Acceptors	2
TotalSurfaceArea	294.33
Relative PSA	0.09401
PolarSurfaceArea	36.93
Druglikeness	-3.4929
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.55556
Fragments	1
Non HAtoms	27
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
StereoCon

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