4-amino-N'-[(Z)-naphthalen-1-ylmethylideneamino]-1,2,5-oxadiazole-3-carboximidamide

Formula:C14H12N6O Mutagenic:none Tumorigenic:high Reproductive Effective:low 4-amino-N'-[(Z)-naphthalen-1-ylmethylideneamino]-1,2,5-oxadiazole-3-carboximidamide is a drug-like molecule.

MolName	4-amino-N'-[(Z)-naphthalen-1-ylmethylideneamino]-1,2,5-oxadiazole-3-carboximidamide
MolecularFormula	C14H12N6O
Smiles	N/C(/c1nonc1N)=N/N=C\c1cccc2ccccc12
InChI	InChI=1S/C14H12N6O/c15-13(12-14(16)20-21-19-12)18-17-8-10-6-3-5-9-4-1-2-7-11(9)10/h1-8H,(H2,15,18)(H2,16,20)
InChIK	NFIOFVQEQLYSNI-UHFFFAOYSA-N
TotalMolweight	280.29
Molweight	280.29
MonoisotopicMass	280.107259
CLogP	3.3734
CLogS	-4.371
H Acceptors	7
H Donors	2
TotalSurfaceArea	219.6
Relative PSA	0.40806
PolarSurfaceArea	115.68
Druglikeness	2.5525
Mutagenic	none
Tumorigenic	high
Reproductive Effective	low
Irritant	none
Nasty Functions	dimethylene-hydrazine; imine/hydrazone of aldehyde
Shape Index	0.57143
Fragments	1
Non HAtoms	21
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	15
Aromatic Nitrogens	2
StereoCon

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