(5Z)-3-benzyl-5-[[5-chloro-2-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C28H24NO3ClS2 Mutagenic:none Tumorigenic:none Reproductive Effective:high (5Z)-3-benzyl-5-[[5-chloro-2-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one is not a drug-like molecule.

MolName	(5Z)-3-benzyl-5-[[5-chloro-2-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C28H24NO3ClS2
Smiles	C=CCc(cccc1)c1OCCOc(cc1)c(/C=C(/C(N2Cc3ccccc3)=O)\SC2=S)cc1Cl
InChI	InChI=1S/C28H24ClNO3S2/c1-2-8-21-11-6-7-12-24(21)32-15-16-33-25-14-13-23(29)17-22(25)18-26-27(31)30(28(34)35-26)19-20-9-4-3-5-10-20/h2-7,9-14,17-18H,1,8,15-16,19H2
InChIK	KWRJFZPKIVANFI-UHFFFAOYSA-N
TotalMolweight	522.088
Molweight	522.088
MonoisotopicMass	521.088611
CLogP	5.8046
CLogS	-7.177
H Acceptors	4
TotalSurfaceArea	397.24
Relative PSA	0.20663
PolarSurfaceArea	96.16
Druglikeness	-5.7984
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.57143
Fragments	1
Non HAtoms	35
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	10
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	8
Symmetricatoms	2
Amides	1
StereoCon

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1 - (5Z)-3-benzyl-5-[[5-chloro-2-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-3-benzyl-5-[[5-chloro-2-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

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