N-[(Z)-[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-2,3,5,6-tetrafluoro-4-(trifluoromethyl)aniline

Formula:C21H10N2OBrCl2F7 Mutagenic:high Tumorigenic:none Reproductive Effective:none N-[(Z)-[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-2,3,5,6-tetrafluoro-4-(trifluoromethyl)aniline is not a drug-like molecule.

MolName	N-[(Z)-[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-2,3,5,6-tetrafluoro-4-(trifluoromethyl)aniline
MolecularFormula	C21H10N2OBrCl2F7
Smiles	FC(c(c(F)c(c(N/N=C\c(cc(cc1)Br)c1OCc(ccc(Cl)c1)c1Cl)c1F)F)c1F)(F)F
InChI	InChI=1S/C21H10BrCl2F7N2O/c22-11-2-4-14(34-8-9-1-3-12(23)6-13(9)24)10(5-11)7-32-33-20-18(27)16(25)15(21(29,30)31)17(26)19(20)28/h1-7,33H,8H2
InChIK	GHWFOOWEBSNKDG-UHFFFAOYSA-N
TotalMolweight	590.119
Molweight	590.119
MonoisotopicMass	587.924174
CLogP	9.3777
CLogS	-8.83
H Acceptors	3
H Donors	1
TotalSurfaceArea	357.09
Relative PSA	0.09233
PolarSurfaceArea	33.62
Druglikeness	-7.3075
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde; polyhalo aromatic ring
Shape Index	0.52941
Fragments	1
Non HAtoms	34
NonCHAtoms	13
Electronegative Atoms	13
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	4
Symmetricatoms	6
StereoCon

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1 - N-[(Z)-[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-2,3,5,6-tetrafluoro-4-(trifluoromethyl)aniline | 2 - N-[(Z)-[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-2,3,5,6-tetrafluoro-4-(trifluoromethyl)aniline

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