N'-[2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]-4-nitrobenzohydrazide

Formula:C17H14N6O4S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N'-[2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]-4-nitrobenzohydrazide is a drug-like molecule.

MolName	N'-[2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]-4-nitrobenzohydrazide
MolecularFormula	C17H14N6O4S2
Smiles	[O-][N+](c(cc1)ccc1C(NNC(CSc1nnc(Nc2ccccc2)s1)=O)=O)=O
InChI	InChI=1S/C17H14N6O4S2/c24-14(19-20-15(25)11-6-8-13(9-7-11)23(26)27)10-28-17-22-21-16(29-17)18-12-4-2-1-3-5-12/h1-9H,10H2,(H,18,21)(H,19,24)(H,20,25)
InChIK	SABKLQAYZDDHFB-UHFFFAOYSA-N
TotalMolweight	430.468
Molweight	430.468
MonoisotopicMass	430.051794
CLogP	1.7769
CLogS	-5.669
H Acceptors	10
H Donors	3
TotalSurfaceArea	311.04
Relative PSA	0.48441
PolarSurfaceArea	195.37
Druglikeness	-1.389
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.68966
Fragments	1
Non HAtoms	29
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	4
Aromatic Nitrogens	2
AcidicOxygens	1
StereoCon

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1 - N'-[2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]-4-nitrobenzohydrazide | 2 - N'-[2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]-4-nitrobenzohydrazide

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