N'-(7-chloro-2H-1,4-benzothiazin-3-yl)-5-nitrofuran-2-carbohydrazide

Formula:C13H9N4O4ClS Mutagenic:none Tumorigenic:none Reproductive Effective:none N'-(7-chloro-2H-1,4-benzothiazin-3-yl)-5-nitrofuran-2-carbohydrazide is a drug-like molecule.

MolName	N'-(7-chloro-2H-1,4-benzothiazin-3-yl)-5-nitrofuran-2-carbohydrazide
MolecularFormula	C13H9N4O4ClS
Smiles	[O-][N+](c1ccc(C(NNC2=Nc(ccc(Cl)c3)c3SC2)=O)o1)=O
InChI	InChI=1S/C13H9ClN4O4S/c14-7-1-2-8-10(5-7)23-6-11(15-8)16-17-13(19)9-3-4-12(22-9)18(20)21/h1-5H,6H2,(H,15,16)(H,17,19)
InChIK	BGTGHBVMCOFDCK-UHFFFAOYSA-N
TotalMolweight	352.757
Molweight	352.757
MonoisotopicMass	352.003303
CLogP	-0.0025001
CLogS	-5.387
H Acceptors	8
H Donors	2
TotalSurfaceArea	243.19
Relative PSA	0.45022
PolarSurfaceArea	137.75
Druglikeness	-0.21098
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.65217
Fragments	1
Non HAtoms	23
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
BasicNitrogens	1
AcidicOxygens	1
StereoCon

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