(Z)-1-(2-iodophenyl)-N-(1,2,4-triazol-4-yl)methanimine

Formula:C9H7N4I Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-(2-iodophenyl)-N-(1,2,4-triazol-4-yl)methanimine is a drug-like molecule.

MolName	(Z)-1-(2-iodophenyl)-N-(1,2,4-triazol-4-yl)methanimine
MolecularFormula	C9H7N4I
Smiles	Ic1c(/C=N\n2cnnc2)cccc1
InChI	InChI=1S/C9H7IN4/c10-9-4-2-1-3-8(9)5-13-14-6-11-12-7-14/h1-7H
InChIK	FTPOCJSHZFZTKJ-UHFFFAOYSA-N
TotalMolweight	298.083
Molweight	298.083
MonoisotopicMass	297.971544
CLogP	1.6654
CLogS	-5.326
H Acceptors	4
TotalSurfaceArea	170.78
Relative PSA	0.23609
PolarSurfaceArea	43.07
Druglikeness	4.3064
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.64286
Fragments	1
Non HAtoms	14
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	2
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Symmetricatoms	2
Aromatic Nitrogens	3
StereoCon

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