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

Formula:C24H28N7OBr Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(Z)-[5-(3-bromophenyl)furan-2-yl]methylideneamino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine is not a drug-like molecule.

MolName	N-[(Z)-[5-(3-bromophenyl)furan-2-yl]methylideneamino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine
MolecularFormula	C24H28N7OBr
Smiles	Brc1cc(-c2ccc(/C=N\Nc3nc(N4CCCCC4)nc(N4CCCCC4)n3)o2)ccc1
InChI	InChI=1S/C24H28BrN7O/c25-19-9-7-8-18(16-19)21-11-10-20(33-21)17-26-30-22-27-23(31-12-3-1-4-13-31)29-24(28-22)32-14-5-2-6-15-32/h7-11,16-17H,1-6,12-15H2,(H,27,28,29,30)
InChIK	NNZSBVHSGKUTOQ-UHFFFAOYSA-N
TotalMolweight	510.438
Molweight	510.438
MonoisotopicMass	509.153869
CLogP	7.5926
CLogS	-7.613
H Acceptors	8
H Donors	1
TotalSurfaceArea	364.8
Relative PSA	0.21132
PolarSurfaceArea	82.68
Druglikeness	2.53
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.51515
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	10
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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