[(E)-1,3-benzodioxol-5-ylmethylideneamino]urea

Formula:C9H9N3O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none [(E)-1,3-benzodioxol-5-ylmethylideneamino]urea is a drug-like molecule.

MolName	[(E)-1,3-benzodioxol-5-ylmethylideneamino]urea
MolecularFormula	C9H9N3O3
Smiles	NC(N/N=C/c(cc1)cc2c1OCO2)=O
InChI	InChI=1S/C9H9N3O3/c10-9(13)12-11-4-6-1-2-7-8(3-6)15-5-14-7/h1-4H,5H2,(H3,10,12,13)
InChIK	UXJOKOHHCILTGL-UHFFFAOYSA-N
TotalMolweight	207.188
Molweight	207.188
MonoisotopicMass	207.064392
CLogP	1.2467
CLogS	-3.525
H Acceptors	6
H Donors	2
TotalSurfaceArea	156.01
Relative PSA	0.45689
PolarSurfaceArea	85.94
Druglikeness	4.0965
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.66667
Fragments	1
Non HAtoms	15
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	2
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	3
Amides	1
StereoCon

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