N-[(Z)-(2-chlorophenyl)methylideneamino]-2,6-di(piperidin-1-yl)pyrimidin-4-amine

Formula:C21H27N6Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(2-chlorophenyl)methylideneamino]-2,6-di(piperidin-1-yl)pyrimidin-4-amine is not a drug-like molecule.

MolName	N-[(Z)-(2-chlorophenyl)methylideneamino]-2,6-di(piperidin-1-yl)pyrimidin-4-amine
MolecularFormula	C21H27N6Cl
Smiles	Clc1c(/C=N\Nc2nc(N3CCCCC3)nc(N3CCCCC3)c2)cccc1
InChI	InChI=1S/C21H27ClN6/c22-18-10-4-3-9-17(18)16-23-26-19-15-20(27-11-5-1-6-12-27)25-21(24-19)28-13-7-2-8-14-28/h3-4,9-10,15-16H,1-2,5-8,11-14H2,(H,24,25,26)
InChIK	BYUJWLAOKMYCRJ-UHFFFAOYSA-N
TotalMolweight	398.94
Molweight	398.94
MonoisotopicMass	398.198571
CLogP	6.622
CLogS	-6.186
H Acceptors	6
H Donors	1
TotalSurfaceArea	313.38
Relative PSA	0.16596
PolarSurfaceArea	56.65
Druglikeness	2.8442
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	10
Symmetricatoms	4
Aromatic Nitrogens	2
BasicNitrogens	2
StereoCon

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