(Z)-1-[3,5-dibromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine

Formula:C16H10N4OBr2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:high (Z)-1-[3,5-dibromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine is not a drug-like molecule.

MolName	(Z)-1-[3,5-dibromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine
MolecularFormula	C16H10N4OBr2Cl2
Smiles	Clc1cc(Cl)c(COc(c(/C=N\n2cnnc2)cc(Br)c2)c2Br)cc1
InChI	InChI=1S/C16H10Br2Cl2N4O/c17-12-3-11(6-23-24-8-21-22-9-24)16(14(18)4-12)25-7-10-1-2-13(19)5-15(10)20/h1-6,8-9H,7H2
InChIK	JZIRTDVOMPMDPR-UHFFFAOYSA-N
TotalMolweight	504.996
Molweight	504.996
MonoisotopicMass	501.859837
CLogP	5.2388
CLogS	-8.791
H Acceptors	5
TotalSurfaceArea	296.12
Relative PSA	0.16993
PolarSurfaceArea	52.3
Druglikeness	1.2885
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.56
Fragments	1
Non HAtoms	25
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Symmetricatoms	2
Aromatic Nitrogens	3
StereoCon

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