2-[4-(4,5-dihydro-1,3-thiazol-2-yl)phenoxy]-N'-hydroxyethanimidamide

Formula:C11H13N3O2S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[4-(4,5-dihydro-1,3-thiazol-2-yl)phenoxy]-N'-hydroxyethanimidamide is a drug-like molecule.

MolName2-[4-(4,5-dihydro-1,3-thiazol-2-yl)phenoxy]-N'-hydroxyethanimidamide
MolecularFormulaC11H13N3O2S
SmilesN/C(/COc(cc1)ccc1C1=NCCS1)=N/O
InChIInChI=1S/C11H13N3O2S/c12-10(14-15)7-16-9-3-1-8(2-4-9)11-13-5-6-17-11/h1-4,15H,5-7H2,(H2,12,14)
InChIKXTOPDTAGTUIJTD-UHFFFAOYSA-N
TotalMolweight251.309
Molweight251.309
MonoisotopicMass251.072847
CLogP1.7367
CLogS-3.314
H Acceptors5
H Donors2
TotalSurfaceArea189.34
Relative PSA0.41661
PolarSurfaceArea105.5
Druglikeness0.9885
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.70588
Fragments1
Non HAtoms17
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond4
Rings Closures2
Small Rings2
Aromatic Rings1
Aromatic Atoms6
Sp3Atoms6
Symmetricatoms2
StereoCon

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