N-[(5Z)-5-[(5-iodofuran-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]adamantane-1-carboxamide

Formula:C19H19N2O3IS2 Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(5Z)-5-[(5-iodofuran-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]adamantane-1-carboxamide is not a drug-like molecule.

MolName	N-[(5Z)-5-[(5-iodofuran-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]adamantane-1-carboxamide
MolecularFormula	C19H19N2O3IS2
Smiles	O=C(C1(CC(C2)C3)CC3CC2C1)NN(C(/C(/S1)=C/c(o2)ccc2I)=O)C1=S
InChI	InChI=1S/C19H19IN2O3S2/c20-15-2-1-13(25-15)6-14-16(23)22(18(26)27-14)21-17(24)19-7-10-3-11(8-19)5-12(4-10)9-19/h1-2,6,10-12H,3-5,7-9H2,(H,21,24)
InChIK	AAIXOZPHFITWDN-UHFFFAOYSA-N
TotalMolweight	514.403
Molweight	514.403
MonoisotopicMass	513.988181
CLogP	1.6477
CLogS	-6.13
H Acceptors	5
H Donors	1
TotalSurfaceArea	297.87
Relative PSA	0.33803
PolarSurfaceArea	119.94
Druglikeness	6.1364
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.51852
Fragments	1
Non HAtoms	27
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	5
Small Rings	6
Aromatic Rings	1
Aromatic Atoms	5
Sp3Atoms	12
Symmetricatoms	6
StereoCon

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