(5E)-5-[[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene]-3-(3-chlorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C20H10N2O4Cl2S2 Mutagenic:high Tumorigenic:high Reproductive Effective:none (5E)-5-[[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene]-3-(3-chlorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5E)-5-[[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene]-3-(3-chlorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C20H10N2O4Cl2S2
Smiles	[O-][N+](c(cc1)cc(-c2ccc(/C=C(\C(N3c4cc(Cl)ccc4)=O)/SC3=S)o2)c1Cl)=O
InChI	InChI=1S/C20H10Cl2N2O4S2/c21-11-2-1-3-12(8-11)23-19(25)18(30-20(23)29)10-14-5-7-17(28-14)15-9-13(24(26)27)4-6-16(15)22/h1-10H
InChIK	DVQKVGFIXBPGQN-UHFFFAOYSA-N
TotalMolweight	477.347
Molweight	477.347
MonoisotopicMass	475.945902
CLogP	4.1216
CLogS	-8.375
H Acceptors	6
TotalSurfaceArea	326.44
Relative PSA	0.32658
PolarSurfaceArea	136.66
Druglikeness	-1.1835
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Amides	1
AcidicOxygens	1
StereoCon

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