2-[4-[(Z)-(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy]acetic acid

Formula:C12H10N2O4S Mutagenic:none Tumorigenic:none Reproductive Effective:high 2-[4-[(Z)-(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy]acetic acid is a drug-like molecule.

MolName	2-[4-[(Z)-(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy]acetic acid
MolecularFormula	C12H10N2O4S
Smiles	OC(COc1ccc(/C=C(/C(N2)=O)\NC2=S)cc1)=O
InChI	InChI=1S/C12H10N2O4S/c15-10(16)6-18-8-3-1-7(2-4-8)5-9-11(17)14-12(19)13-9/h1-5H,6H2,(H,15,16)(H2,13,14,17,19)
InChIK	BQOKIKAEUHGYRD-UHFFFAOYSA-N
TotalMolweight	278.287
Molweight	278.287
MonoisotopicMass	278.036128
CLogP	0.2888
CLogS	-2.613
H Acceptors	6
H Donors	3
TotalSurfaceArea	205.71
Relative PSA	0.48661
PolarSurfaceArea	119.75
Druglikeness	2.4067
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.68421
Fragments	1
Non HAtoms	19
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	4
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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