2-hydroxy-N-[(5Z)-5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide

Formula:C17H11N3O5S2 Mutagenic:none Tumorigenic:none Reproductive Effective:high 2-hydroxy-N-[(5Z)-5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide is a drug-like molecule.

MolName	2-hydroxy-N-[(5Z)-5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
MolecularFormula	C17H11N3O5S2
Smiles	[O-][N+](c1c(/C=C(/C(N2NC(c(cccc3)c3O)=O)=O)\SC2=S)cccc1)=O
InChI	InChI=1S/C17H11N3O5S2/c21-13-8-4-2-6-11(13)15(22)18-19-16(23)14(27-17(19)26)9-10-5-1-3-7-12(10)20(24)25/h1-9,21H,(H,18,22)
InChIK	ISFMLMCBDJQKPN-UHFFFAOYSA-N
TotalMolweight	401.422
Molweight	401.422
MonoisotopicMass	401.014012
CLogP	0.2039
CLogS	-4.848
H Acceptors	8
H Donors	2
TotalSurfaceArea	281.71
Relative PSA	0.46182
PolarSurfaceArea	172.85
Druglikeness	-1.104
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.51852
Fragments	1
Non HAtoms	27
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
AcidicOxygens	1
StereoCon

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