(Z)-2-naphthalen-1-yl-3-pyridin-4-ylprop-2-enenitrile

Formula:C18H12N2 Mutagenic:none Tumorigenic:high Reproductive Effective:none (Z)-2-naphthalen-1-yl-3-pyridin-4-ylprop-2-enenitrile is a drug-like molecule.

MolName	(Z)-2-naphthalen-1-yl-3-pyridin-4-ylprop-2-enenitrile
MolecularFormula	C18H12N2
Smiles	N#C/C(/c1cccc2ccccc12)=C\c1ccncc1
InChI	InChI=1S/C18H12N2/c19-13-16(12-14-8-10-20-11-9-14)18-7-3-5-15-4-1-2-6-17(15)18/h1-12H
InChIK	QYBFMQRNTOVHFE-UHFFFAOYSA-N
TotalMolweight	256.307
Molweight	256.307
MonoisotopicMass	256.100048
CLogP	3.5261
CLogS	-4.44
H Acceptors	2
TotalSurfaceArea	212.8
Relative PSA	0.11527
PolarSurfaceArea	36.68
Druglikeness	-5.0798
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.55
Fragments	1
Non HAtoms	20
NonCHAtoms	2
Electronegative Atoms	2
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

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