N-[(Z)-(3-chlorophenyl)methylideneamino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine

Formula:C20H26N7Cl Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(Z)-(3-chlorophenyl)methylideneamino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine is not a drug-like molecule.

MolName	N-[(Z)-(3-chlorophenyl)methylideneamino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine
MolecularFormula	C20H26N7Cl
Smiles	Clc1cc(/C=N\Nc2nc(N3CCCCC3)nc(N3CCCCC3)n2)ccc1
InChI	InChI=1S/C20H26ClN7/c21-17-9-7-8-16(14-17)15-22-26-18-23-19(27-10-3-1-4-11-27)25-20(24-18)28-12-5-2-6-13-28/h7-9,14-15H,1-6,10-13H2,(H,23,24,25,26)
InChIK	JWBNWPPVXAYVRN-UHFFFAOYSA-N
TotalMolweight	399.928
Molweight	399.928
MonoisotopicMass	399.19382
CLogP	6.5345
CLogS	-6.055
H Acceptors	7
H Donors	1
TotalSurfaceArea	312.14
Relative PSA	0.20177
PolarSurfaceArea	69.54
Druglikeness	2.8442
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	10
Symmetricatoms	10
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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