[(Z)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino] 3-nitrobenzoate

Formula:C10H8N6O5 Mutagenic:high Tumorigenic:high Reproductive Effective:none [(Z)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino] 3-nitrobenzoate is not a drug-like molecule.

MolName	[(Z)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino] 3-nitrobenzoate
MolecularFormula	C10H8N6O5
Smiles	N/C(/c1nonc1N)=N\OC(c1cccc([N+]([O-])=O)c1)=O
InChI	InChI=1S/C10H8N6O5/c11-8(7-9(12)15-21-13-7)14-20-10(17)5-2-1-3-6(4-5)16(18)19/h1-4H,(H2,11,14)(H2,12,15)
InChIK	STWPOHZRFOBBCN-UHFFFAOYSA-N
TotalMolweight	292.211
Molweight	292.211
MonoisotopicMass	292.055619
CLogP	0.3899
CLogS	-2.864
H Acceptors	11
H Donors	2
TotalSurfaceArea	211.66
Relative PSA	0.62156
PolarSurfaceArea	175.44
Druglikeness	-7.5587
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.57143
Fragments	1
Non HAtoms	21
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	2
Aromatic Nitrogens	2
AcidicOxygens	1
StereoCon

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