4-[(Z)-[4-[(Z)-(4-cyanophenyl)methylideneamino]piperazin-1-yl]iminomethyl]benzonitrile

Formula:C20H18N6 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[(Z)-[4-[(Z)-(4-cyanophenyl)methylideneamino]piperazin-1-yl]iminomethyl]benzonitrile is a drug-like molecule.

MolName	4-[(Z)-[4-[(Z)-(4-cyanophenyl)methylideneamino]piperazin-1-yl]iminomethyl]benzonitrile
MolecularFormula	C20H18N6
Smiles	N#Cc1ccc(/C=N\N(CC2)CCN2/N=C\c(cc2)ccc2C#N)cc1
InChI	InChI=1S/C20H18N6/c21-13-17-1-5-19(6-2-17)15-23-25-9-11-26(12-10-25)24-16-20-7-3-18(14-22)4-8-20/h1-8,15-16H,9-12H2
InChIK	QAVBCVHVDILAKT-UHFFFAOYSA-N
TotalMolweight	342.405
Molweight	342.405
MonoisotopicMass	342.159294
CLogP	2.9302
CLogS	-4.836
H Acceptors	6
TotalSurfaceArea	288.1
Relative PSA	0.19868
PolarSurfaceArea	78.78
Druglikeness	1.2384
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.76923
Fragments	1
Non HAtoms	26
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Symmetricatoms	16
StereoCon

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