(Z)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1,2,4-triazol-4-yl)methanimine

Formula:C11H10N4O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1,2,4-triazol-4-yl)methanimine is a drug-like molecule.

MolName	(Z)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1,2,4-triazol-4-yl)methanimine
MolecularFormula	C11H10N4O2
Smiles	C1Oc(ccc(/C=N\n2cnnc2)c2)c2OC1
InChI	InChI=1S/C11H10N4O2/c1-2-10-11(17-4-3-16-10)5-9(1)6-14-15-7-12-13-8-15/h1-2,5-8H,3-4H2
InChIK	UKBOOMXZEDFIRX-UHFFFAOYSA-N
TotalMolweight	230.226
Molweight	230.226
MonoisotopicMass	230.080376
CLogP	1.2071
CLogS	-4.492
H Acceptors	6
TotalSurfaceArea	178.52
Relative PSA	0.33789
PolarSurfaceArea	61.53
Druglikeness	-3.8214
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.64706
Fragments	1
Non HAtoms	17
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	4
Symmetricatoms	2
Aromatic Nitrogens	3
StereoCon

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1 - (Z)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1,2,4-triazol-4-yl)methanimine | 2 - (Z)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1,2,4-triazol-4-yl)methanimine

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