(5Z)-2-amino-5-[(2-hydroxy-3,5-diiodophenyl)methylidene]-1,3-thiazol-4-one

Formula:C10H6N2O2I2S Mutagenic:none Tumorigenic:none Reproductive Effective:low (5Z)-2-amino-5-[(2-hydroxy-3,5-diiodophenyl)methylidene]-1,3-thiazol-4-one is a drug-like molecule.

MolName(5Z)-2-amino-5-[(2-hydroxy-3,5-diiodophenyl)methylidene]-1,3-thiazol-4-one
MolecularFormulaC10H6N2O2I2S
SmilesNC(S/C1=C\c2cc(I)cc(I)c2O)=NC1=O
InChIInChI=1S/C10H6I2N2O2S/c11-5-1-4(8(15)6(12)3-5)2-7-9(16)14-10(13)17-7/h1-3,15H,(H2,13,14,16)
InChIKDKMMLKFALAWXKC-UHFFFAOYSA-N
TotalMolweight472.036
Molweight472.036
MonoisotopicMass471.823944
CLogP1.5265
CLogS-5.025
H Acceptors4
H Donors2
TotalSurfaceArea210.11
Relative PSA0.33511
PolarSurfaceArea100.98
Druglikeness2.7613
Mutagenicnone
Tumorigenicnone
Reproductive Effectivelow
Irritantnone
Nasty Functions
Shape Index0.52941
Fragments1
Non HAtoms17
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond1
Rings Closures2
Small Rings2
Aromatic Rings1
Aromatic Atoms6
Sp3Atoms2
BasicNitrogens1
StereoCon

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