(Z)-1-(2,4-dichlorophenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine

Formula:C16H17N4Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-(2,4-dichlorophenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine is a drug-like molecule.

MolName	(Z)-1-(2,4-dichlorophenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine
MolecularFormula	C16H17N4Cl2
Smiles	Clc1cc(Cl)c(/C=N\N(CC2)CCN2c2[nH+]cccc2)cc1
InChI	InChI=1S/C16H16Cl2N4/c17-14-5-4-13(15(18)11-14)12-20-22-9-7-21(8-10-22)16-3-1-2-6-19-16/h1-6,11-12H,7-10H2/p+1
InChIK	WONJEZJYSWIFPJ-UHFFFAOYSA-O
TotalMolweight	336.245
Molweight	336.245
MonoisotopicMass	335.083025
CLogP	1.6808
CLogS	-4.38
H Acceptors	4
H Donors	1
TotalSurfaceArea	238.55
Relative PSA	0.078013
PolarSurfaceArea	32.98
Druglikeness	6.3925
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.68182
Fragments	1
Non HAtoms	22
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	2
Aromatic Nitrogens	1
BasicNitrogens	1
StereoCon

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