(5Z)-2-imino-5-[(4-nitrophenyl)methylidene]-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-4-one

Formula:C13H8N4O3S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-2-imino-5-[(4-nitrophenyl)methylidene]-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5Z)-2-imino-5-[(4-nitrophenyl)methylidene]-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-4-one
MolecularFormula	C13H8N4O3S2
Smiles	N=C(N(C1=O)c2nccs2)S/C1=C\c(cc1)ccc1[N+]([O-])=O
InChI	InChI=1S/C13H8N4O3S2/c14-12-16(13-15-5-6-21-13)11(18)10(22-12)7-8-1-3-9(4-2-8)17(19)20/h1-7,14H
InChIK	DCVRFHCCEBHFPF-UHFFFAOYSA-N
TotalMolweight	332.364
Molweight	332.364
MonoisotopicMass	332.003781
CLogP	1.5422
CLogS	-4.005
H Acceptors	7
H Donors	1
TotalSurfaceArea	228.45
Relative PSA	0.48777
PolarSurfaceArea	156.41
Druglikeness	-1.0483
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.59091
Fragments	1
Non HAtoms	22
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	2
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	1
AcidicOxygens	1
StereoCon

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