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

Formula:C24H28N7OCl Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(E)-[5-(4-chlorophenyl)furan-2-yl]methylideneamino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine is not a drug-like molecule.

MolName	N-[(E)-[5-(4-chlorophenyl)furan-2-yl]methylideneamino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine
MolecularFormula	C24H28N7OCl
Smiles	Clc(cc1)ccc1-c1ccc(/C=N/Nc2nc(N3CCCCC3)nc(N3CCCCC3)n2)o1
InChI	InChI=1S/C24H28ClN7O/c25-19-9-7-18(8-10-19)21-12-11-20(33-21)17-26-30-22-27-23(31-13-3-1-4-14-31)29-24(28-22)32-15-5-2-6-16-32/h7-12,17H,1-6,13-16H2,(H,27,28,29,30)
InChIK	IDIOQXGRWFEZKG-UHFFFAOYSA-N
TotalMolweight	465.987
Molweight	465.987
MonoisotopicMass	465.204385
CLogP	7.4734
CLogS	-7.515
H Acceptors	8
H Donors	1
TotalSurfaceArea	361.59
Relative PSA	0.2132
PolarSurfaceArea	82.68
Druglikeness	4.3347
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.54545
Fragments	1
Non HAtoms	33
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	10
Symmetricatoms	12
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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