2-[(5Z)-5-(1,2-oxazol-3-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid

Formula:C9H6N2O4S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(5Z)-5-(1,2-oxazol-3-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid is a drug-like molecule.

MolName	2-[(5Z)-5-(1,2-oxazol-3-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
MolecularFormula	C9H6N2O4S2
Smiles	OC(CN(C(/C(/S1)=C/c2nocc2)=O)C1=S)=O
InChI	InChI=1S/C9H6N2O4S2/c12-7(13)4-11-8(14)6(17-9(11)16)3-5-1-2-15-10-5/h1-3H,4H2,(H,12,13)
InChIK	JRZKLNUWPUKBIO-UHFFFAOYSA-N
TotalMolweight	270.289
Molweight	270.289
MonoisotopicMass	269.976898
CLogP	-1.0086
CLogS	-2.034
H Acceptors	6
H Donors	1
TotalSurfaceArea	189.03
Relative PSA	0.59938
PolarSurfaceArea	141.03
Druglikeness	-0.63464
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.58824
Fragments	1
Non HAtoms	17
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	5
Sp3Atoms	4
Amides	1
Aromatic Nitrogens	1
AcidicOxygens	1
StereoCon

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