2-[(E)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino]oxy-N-benzylacetamide

Formula:C12H14N6O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(E)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino]oxy-N-benzylacetamide is a drug-like molecule.

MolName	2-[(E)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino]oxy-N-benzylacetamide
MolecularFormula	C12H14N6O3
Smiles	N/C(/c1nonc1N)=N/OCC(NCc1ccccc1)=O
InChI	InChI=1S/C12H14N6O3/c13-11(10-12(14)18-21-16-10)17-20-7-9(19)15-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,13,17)(H2,14,18)(H,15,19)
InChIK	MZSNMBREPSFVDI-UHFFFAOYSA-N
TotalMolweight	290.282
Molweight	290.282
MonoisotopicMass	290.112739
CLogP	0.3128
CLogS	-2.042
H Acceptors	9
H Donors	3
TotalSurfaceArea	226.97
Relative PSA	0.4961
PolarSurfaceArea	141.65
Druglikeness	3.1877
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.66667
Fragments	1
Non HAtoms	21
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	2
StereoCon

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1 - 2-[(E)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino]oxy-N-benzylacetamide | 2 - 2-[(E)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino]oxy-N-benzylacetamide

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