2-N-[(Z)-[3,5-dibromo-4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-4-N,6-N-diphenyl-1,3,5-triazine-2,4,6-triamine

Formula:C29H21N7OBr2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-N-[(Z)-[3,5-dibromo-4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-4-N,6-N-diphenyl-1,3,5-triazine-2,4,6-triamine is not a drug-like molecule.

MolName	2-N-[(Z)-[3,5-dibromo-4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-4-N,6-N-diphenyl-1,3,5-triazine-2,4,6-triamine
MolecularFormula	C29H21N7OBr2Cl2
Smiles	Clc1cc(Cl)c(COc(c(Br)cc(/C=N\Nc2nc(Nc3ccccc3)nc(Nc3ccccc3)n2)c2)c2Br)cc1
InChI	InChI=1S/C29H21Br2Cl2N7O/c30-23-13-18(14-24(31)26(23)41-17-19-11-12-20(32)15-25(19)33)16-34-40-29-38-27(35-21-7-3-1-4-8-21)37-28(39-29)36-22-9-5-2-6-10-22/h1-16H,17H2,(H3,35,36,37,38,39,40)
InChIK	AKPZBVZSCAQSAI-UHFFFAOYSA-N
TotalMolweight	714.248
Molweight	714.248
MonoisotopicMass	710.955134
CLogP	11.334
CLogS	-10.972
H Acceptors	8
H Donors	3
TotalSurfaceArea	459.58
Relative PSA	0.19322
PolarSurfaceArea	96.35
Druglikeness	0.070985
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.53659
Fragments	1
Non HAtoms	41
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	10
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	30
Sp3Atoms	2
Symmetricatoms	14
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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1 - 2-N-[(Z)-[3,5-dibromo-4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-4-N,6-N-diphenyl-1,3,5-triazine-2,4,6-triamine | 2 - 2-N-[(Z)-[3,5-dibromo-4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-4-N,6-N-diphenyl-1,3,5-triazine-2,4,6-triamine

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