(2E)-2-[(2E)-4-oxo-2-(2-oxo-2-pyrrolidin-1-ylethylidene)-1,3-thiazolidin-5-ylidene]acetic acid

Formula:C11H12N2O4S Mutagenic:none Tumorigenic:none Reproductive Effective:none (2E)-2-[(2E)-4-oxo-2-(2-oxo-2-pyrrolidin-1-ylethylidene)-1,3-thiazolidin-5-ylidene]acetic acid is a drug-like molecule.

MolName	(2E)-2-[(2E)-4-oxo-2-(2-oxo-2-pyrrolidin-1-ylethylidene)-1,3-thiazolidin-5-ylidene]acetic acid
MolecularFormula	C11H12N2O4S
Smiles	OC(/C=C(\C(N1)=O)/S/C1=C/C(N1CCCC1)=O)=O
InChI	InChI=1S/C11H12N2O4S/c14-9(13-3-1-2-4-13)6-8-12-11(17)7(18-8)5-10(15)16/h5-6H,1-4H2,(H,12,17)(H,15,16)
InChIK	BMFFVXYIYNKHTF-UHFFFAOYSA-N
TotalMolweight	268.292
Molweight	268.292
MonoisotopicMass	268.051778
CLogP	0.0705
CLogS	-1.622
H Acceptors	6
H Donors	2
TotalSurfaceArea	189.81
Relative PSA	0.44634
PolarSurfaceArea	112.01
Druglikeness	4.3334
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	polar activated DB
Shape Index	0.61111
Fragments	1
Non HAtoms	18
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	2
Rings Closures	2
Small Rings	2
Sp3Atoms	6
Symmetricatoms	2
Amides	2
AcidicOxygens	1
StereoCon

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