N-hydroxy-3-nitro-N'-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)benzenecarboximidamide

Formula:C14H10N6O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-hydroxy-3-nitro-N'-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)benzenecarboximidamide is a drug-like molecule.

MolName	N-hydroxy-3-nitro-N'-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)benzenecarboximidamide
MolecularFormula	C14H10N6O3S
Smiles	[O-][N+](c1cccc(/C(/NO)=N/c2nnc(-c3cnccc3)s2)c1)=O
InChI	InChI=1S/C14H10N6O3S/c21-19-12(9-3-1-5-11(7-9)20(22)23)16-14-18-17-13(24-14)10-4-2-6-15-8-10/h1-8,21H,(H,16,18,19)
InChIK	IIWHPZYOQUYGPO-UHFFFAOYSA-N
TotalMolweight	342.338
Molweight	342.338
MonoisotopicMass	342.053509
CLogP	0.9772
CLogS	-3.291
H Acceptors	9
H Donors	2
TotalSurfaceArea	249.45
Relative PSA	0.4801
PolarSurfaceArea	157.35
Druglikeness	-2.4265
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.58333
Fragments	1
Non HAtoms	24
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Aromatic Nitrogens	3
BasicNitrogens	1
AcidicOxygens	1
StereoCon

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