N-[(Z)-(5-nitrothiophen-2-yl)methylideneamino]-2-[4-(tetrazol-1-yl)phenoxy]acetamide

Formula:C14H11N7O4S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(5-nitrothiophen-2-yl)methylideneamino]-2-[4-(tetrazol-1-yl)phenoxy]acetamide is not a drug-like molecule.

MolName	N-[(Z)-(5-nitrothiophen-2-yl)methylideneamino]-2-[4-(tetrazol-1-yl)phenoxy]acetamide
MolecularFormula	C14H11N7O4S
Smiles	[O-][N+](c1ccc(/C=N\NC(COc(cc2)ccc2-n2nnnc2)=O)s1)=O
InChI	InChI=1S/C14H11N7O4S/c22-13(17-15-7-12-5-6-14(26-12)21(23)24)8-25-11-3-1-10(2-4-11)20-9-16-18-19-20/h1-7,9H,8H2,(H,17,22)
InChIK	AOEURURYZYXZAA-UHFFFAOYSA-N
TotalMolweight	373.352
Molweight	373.352
MonoisotopicMass	373.059323
CLogP	0.8097
CLogS	-4.42
H Acceptors	11
H Donors	1
TotalSurfaceArea	275.6
Relative PSA	0.49554
PolarSurfaceArea	168.35
Druglikeness	-0.80577
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.69231
Fragments	1
Non HAtoms	26
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	3
Symmetricatoms	2
Aromatic Nitrogens	4
AcidicOxygens	1
StereoCon

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