N-[(Z)-(5-bromo-2-phenylmethoxyphenyl)methylideneamino]-4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-amine

Formula:C25H28N7OBr Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(Z)-(5-bromo-2-phenylmethoxyphenyl)methylideneamino]-4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-amine is not a drug-like molecule.

MolName	N-[(Z)-(5-bromo-2-phenylmethoxyphenyl)methylideneamino]-4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-amine
MolecularFormula	C25H28N7OBr
Smiles	Brc(cc1)cc(/C=N\Nc2nc(N3CCCC3)nc(N3CCCC3)n2)c1OCc1ccccc1
InChI	InChI=1S/C25H28BrN7O/c26-21-10-11-22(34-18-19-8-2-1-3-9-19)20(16-21)17-27-31-23-28-24(32-12-4-5-13-32)30-25(29-23)33-14-6-7-15-33/h1-3,8-11,16-17H,4-7,12-15,18H2,(H,28,29,30,31)
InChIK	GGOBBBNNGOEBQH-UHFFFAOYSA-N
TotalMolweight	522.449
Molweight	522.449
MonoisotopicMass	521.153869
CLogP	7.3178
CLogS	-6.954
H Acceptors	8
H Donors	1
TotalSurfaceArea	371.35
Relative PSA	0.19653
PolarSurfaceArea	78.77
Druglikeness	1.8743
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.5
Fragments	1
Non HAtoms	34
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	8
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	10
Symmetricatoms	11
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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