(Z)-2-(4-chlorophenyl)-3-phenyl-3-pyridin-2-ylprop-2-enenitrile

Formula:C20H13N2Cl Mutagenic:none Tumorigenic:low Reproductive Effective:high (Z)-2-(4-chlorophenyl)-3-phenyl-3-pyridin-2-ylprop-2-enenitrile is a drug-like molecule.

MolName	(Z)-2-(4-chlorophenyl)-3-phenyl-3-pyridin-2-ylprop-2-enenitrile
MolecularFormula	C20H13N2Cl
Smiles	N#C/C(/c(cc1)ccc1Cl)=C(/c1ccccc1)\c1ncccc1
InChI	InChI=1S/C20H13ClN2/c21-17-11-9-15(10-12-17)18(14-22)20(16-6-2-1-3-7-16)19-8-4-5-13-23-19/h1-13H
InChIK	DTMPHIBDOAJNRF-UHFFFAOYSA-N
TotalMolweight	316.79
Molweight	316.79
MonoisotopicMass	316.076725
CLogP	3.5404
CLogS	-4.799
H Acceptors	2
TotalSurfaceArea	251.59
Relative PSA	0.0975
PolarSurfaceArea	36.68
Druglikeness	-5.3542
Mutagenic	none
Tumorigenic	low
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.47826
Fragments	1
Non HAtoms	23
NonCHAtoms	3
Electronegative Atoms	3
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Symmetricatoms	4
Aromatic Nitrogens	1
StereoCon

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