[(E)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino] 2,1,3-benzothiadiazole-5-carboxylate

Formula:C10H7N7O3S Mutagenic:high Tumorigenic:none Reproductive Effective:low [(E)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino] 2,1,3-benzothiadiazole-5-carboxylate is a drug-like molecule.

MolName	[(E)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino] 2,1,3-benzothiadiazole-5-carboxylate
MolecularFormula	C10H7N7O3S
Smiles	N/C(/c1nonc1N)=N/OC(c1cc2nsnc2cc1)=O
InChI	InChI=1S/C10H7N7O3S/c11-8(7-9(12)15-20-13-7)14-19-10(18)4-1-2-5-6(3-4)17-21-16-5/h1-3H,(H2,11,14)(H2,12,15)
InChIK	PUADOVDTPCOIMX-UHFFFAOYSA-N
TotalMolweight	305.278
Molweight	305.278
MonoisotopicMass	305.033108
CLogP	1.8281
CLogS	0.964
H Acceptors	10
H Donors	2
TotalSurfaceArea	216.05
Relative PSA	0.66392
PolarSurfaceArea	183.64
Druglikeness	-0.91461
Mutagenic	high
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.57143
Fragments	1
Non HAtoms	21
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	14
Sp3Atoms	1
Aromatic Nitrogens	4
StereoCon

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1 - [(E)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino] 2,1,3-benzothiadiazole-5-carboxylate | 2 - [(E)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino] 2,1,3-benzothiadiazole-5-carboxylate

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