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

Formula:C29H23N7OCl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-N-[(Z)-[3-[(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-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-4-N,6-N-diphenyl-1,3,5-triazine-2,4,6-triamine
MolecularFormula	C29H23N7OCl2
Smiles	Clc1cc(Cl)c(COc2cc(/C=N\Nc3nc(Nc4ccccc4)nc(Nc4ccccc4)n3)ccc2)cc1
InChI	InChI=1S/C29H23Cl2N7O/c30-22-15-14-21(26(31)17-22)19-39-25-13-7-8-20(16-25)18-32-38-29-36-27(33-23-9-3-1-4-10-23)35-28(37-29)34-24-11-5-2-6-12-24/h1-18H,19H2,(H3,33,34,35,36,37,38)
InChIK	VYCRVBTUBLGKAD-UHFFFAOYSA-N
TotalMolweight	556.456
Molweight	556.456
MonoisotopicMass	555.134112
CLogP	9.8834
CLogS	-9.304
H Acceptors	8
H Donors	3
TotalSurfaceArea	422.32
Relative PSA	0.21027
PolarSurfaceArea	96.35
Druglikeness	1.861
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.53846
Fragments	1
Non HAtoms	39
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	10
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	30
Sp3Atoms	2
Symmetricatoms	11
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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

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