11-[(5Z)-5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid

Formula:C21H26NO3ClS2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 11-[(5Z)-5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid is not a drug-like molecule.

MolName	11-[(5Z)-5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid
MolecularFormula	C21H26NO3ClS2
Smiles	OC(CCCCCCCCCCN(C(/C(/S1)=C/c(cc2)ccc2Cl)=O)C1=S)=O
InChI	InChI=1S/C21H26ClNO3S2/c22-17-12-10-16(11-13-17)15-18-20(26)23(21(27)28-18)14-8-6-4-2-1-3-5-7-9-19(24)25/h10-13,15H,1-9,14H2,(H,24,25)
InChIK	QUSZZJKYNCWHHJ-UHFFFAOYSA-N
TotalMolweight	440.026
Molweight	440.026
MonoisotopicMass	439.104261
CLogP	5.2227
CLogS	-6.079
H Acceptors	4
H Donors	1
TotalSurfaceArea	339.84
Relative PSA	0.25959
PolarSurfaceArea	115
Druglikeness	-6.677
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.75
Fragments	1
Non HAtoms	28
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	12
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	13
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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