(Z)-3-(2-iodophenyl)-2-pyridin-2-ylprop-2-enenitrile

Formula:C14H9N2I Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-3-(2-iodophenyl)-2-pyridin-2-ylprop-2-enenitrile is a drug-like molecule.

MolName	(Z)-3-(2-iodophenyl)-2-pyridin-2-ylprop-2-enenitrile
MolecularFormula	C14H9N2I
Smiles	N#C/C(/c1ncccc1)=C\c(cccc1)c1I
InChI	InChI=1S/C14H9IN2/c15-13-6-2-1-5-11(13)9-12(10-16)14-7-3-4-8-17-14/h1-9H
InChIK	IKWNJLKQFINQMG-UHFFFAOYSA-N
TotalMolweight	332.139
Molweight	332.139
MonoisotopicMass	331.981046
CLogP	2.8228
CLogS	-3.874
H Acceptors	2
TotalSurfaceArea	204.48
Relative PSA	0.11996
PolarSurfaceArea	36.68
Druglikeness	-4.272
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.58824
Fragments	1
Non HAtoms	17
NonCHAtoms	3
Electronegative Atoms	3
Rotatable Bond	2
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Aromatic Nitrogens	1
StereoCon

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