(2E)-2-[(2-chlorophenyl)methylidene]-5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-one

Formula:C12H9N2OClS Mutagenic:none Tumorigenic:high Reproductive Effective:none (2E)-2-[(2-chlorophenyl)methylidene]-5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-one is a drug-like molecule.

MolName(2E)-2-[(2-chlorophenyl)methylidene]-5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-one
MolecularFormulaC12H9N2OClS
SmilesO=C(/C(/S1)=C\c(cccc2)c2Cl)N2C1=NCC2
InChIInChI=1S/C12H9ClN2OS/c13-9-4-2-1-3-8(9)7-10-11(16)15-6-5-14-12(15)17-10/h1-4,7H,5-6H2
InChIKQMUXVUWKUDKJLK-UHFFFAOYSA-N
TotalMolweight264.735
Molweight264.735
MonoisotopicMass264.01241
CLogP2.329
CLogS-3.725
H Acceptors3
TotalSurfaceArea182.42
Relative PSA0.24992
PolarSurfaceArea57.97
Druglikeness5.5681
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.58824
Fragments1
Non HAtoms17
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond1
Rings Closures3
Small Rings3
Aromatic Rings1
Aromatic Atoms6
Sp3Atoms3
Amides1
StereoCon

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