(5Z)-5-[[5-(2,5-dichlorophenyl)furan-2-yl]methylidene]-3-(1,1-dioxothiolan-3-yl)-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C18H13NO4Cl2S3 Mutagenic:high Tumorigenic:high Reproductive Effective:high (5Z)-5-[[5-(2,5-dichlorophenyl)furan-2-yl]methylidene]-3-(1,1-dioxothiolan-3-yl)-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5Z)-5-[[5-(2,5-dichlorophenyl)furan-2-yl]methylidene]-3-(1,1-dioxothiolan-3-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C18H13NO4Cl2S3
Smiles	O=C(/C(/S1)=C/c2ccc(-c(cc(cc3)Cl)c3Cl)o2)N(C(CC2)CS2(=O)=O)C1=S
InChI	InChI=1S/C18H13Cl2NO4S3/c19-10-1-3-14(20)13(7-10)15-4-2-12(25-15)8-16-17(22)21(18(26)27-16)11-5-6-28(23,24)9-11/h1-4,7-8,11H,5-6,9H2/t11-/m0/s1
InChIK	DOUQKYLTTXTXEA-NSHDSACASA-N
TotalMolweight	474.408
Molweight	474.408
MonoisotopicMass	472.938373
CLogP	2.9117
CLogS	-6.614
H Acceptors	5
TotalSurfaceArea	311.87
Relative PSA	0.33594
PolarSurfaceArea	133.36
Druglikeness	1.7211
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.53571
Fragments	1
Non HAtoms	28
NonCHAtoms	10
Electronegative Atoms	10
StereoCenters	1
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	7
Symmetricatoms	1
Amides	1
StereoCon	racemate

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1 - (5Z)-5-[[5-(2,5-dichlorophenyl)furan-2-yl]methylidene]-3-(1,1-dioxothiolan-3-yl)-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-5-[[5-(2,5-dichlorophenyl)furan-2-yl]methylidene]-3-(1,1-dioxothiolan-3-yl)-2-sulfanylidene-1,3-thiazolidin-4-one

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