2-[2-[(E)-(3-benzamido-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid

Formula:C19H14N2O5S2 Mutagenic:none Tumorigenic:none Reproductive Effective:high 2-[2-[(E)-(3-benzamido-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid is a drug-like molecule.

MolName	2-[2-[(E)-(3-benzamido-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid
MolecularFormula	C19H14N2O5S2
Smiles	OC(COc1c(/C=C(\C(N2NC(c3ccccc3)=O)=O)/SC2=S)cccc1)=O
InChI	InChI=1S/C19H14N2O5S2/c22-16(23)11-26-14-9-5-4-8-13(14)10-15-18(25)21(19(27)28-15)20-17(24)12-6-2-1-3-7-12/h1-10H,11H2,(H,20,24)(H,22,23)
InChIK	KTNQDOMOQIMZMR-UHFFFAOYSA-N
TotalMolweight	414.461
Molweight	414.461
MonoisotopicMass	414.034413
CLogP	0.5312
CLogS	-4.477
H Acceptors	7
H Donors	2
TotalSurfaceArea	299.55
Relative PSA	0.40968
PolarSurfaceArea	153.33
Druglikeness	4.0824
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.57143
Fragments	1
Non HAtoms	28
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	2
AcidicOxygens	1
StereoCon

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