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

Formula:C10H6N2O2Cl2S Mutagenic:none Tumorigenic:high Reproductive Effective:high (5Z)-2-amino-5-[(3,5-dichloro-2-hydroxyphenyl)methylidene]-1,3-thiazol-4-one is a drug-like molecule.

MolName(5Z)-2-amino-5-[(3,5-dichloro-2-hydroxyphenyl)methylidene]-1,3-thiazol-4-one
MolecularFormulaC10H6N2O2Cl2S
SmilesNC(S/C1=C\c2cc(Cl)cc(Cl)c2O)=NC1=O
InChIInChI=1S/C10H6Cl2N2O2S/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)
InChIKKZLDGGVCSCOJPN-UHFFFAOYSA-N
TotalMolweight289.142
Molweight289.142
MonoisotopicMass287.952702
CLogP1.8643
CLogS-4.465
H Acceptors4
H Donors2
TotalSurfaceArea188.39
Relative PSA0.37375
PolarSurfaceArea100.98
Druglikeness2.304
Mutagenicnone
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
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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