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

Formula:C16H11N4OCl3 Mutagenic:none Tumorigenic:high Reproductive Effective:high (Z)-1-[3,5-dichloro-2-[(4-chlorophenyl)methoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine is a drug-like molecule.

MolName	(Z)-1-[3,5-dichloro-2-[(4-chlorophenyl)methoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine
MolecularFormula	C16H11N4OCl3
Smiles	Clc1ccc(COc(c(/C=N\n2cnnc2)cc(Cl)c2)c2Cl)cc1
InChI	InChI=1S/C16H11Cl3N4O/c17-13-3-1-11(2-4-13)8-24-16-12(5-14(18)6-15(16)19)7-22-23-9-20-21-10-23/h1-7,9-10H,8H2
InChIK	QJCGUJFZAZMARY-UHFFFAOYSA-N
TotalMolweight	381.649
Molweight	381.649
MonoisotopicMass	379.999842
CLogP	4.3944
CLogS	-7.859
H Acceptors	5
TotalSurfaceArea	274.28
Relative PSA	0.18346
PolarSurfaceArea	52.3
Druglikeness	3.0785
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.58333
Fragments	1
Non HAtoms	24
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Symmetricatoms	4
Aromatic Nitrogens	3
StereoCon

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1 - (Z)-1-[3,5-dichloro-2-[(4-chlorophenyl)methoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine | 2 - (Z)-1-[3,5-dichloro-2-[(4-chlorophenyl)methoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine

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