N'-hydroxy-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethanimidamide

Formula:C11H10N4O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none N'-hydroxy-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethanimidamide is a drug-like molecule.

MolNameN'-hydroxy-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethanimidamide
MolecularFormulaC11H10N4O3S
SmilesN/C(/Cc1nc(-c2cc([N+]([O-])=O)ccc2)cs1)=N/O
InChIInChI=1S/C11H10N4O3S/c12-10(14-16)5-11-13-9(6-19-11)7-2-1-3-8(4-7)15(17)18/h1-4,6,16H,5H2,(H2,12,14)
InChIKGFNVUQSKXQZCBV-UHFFFAOYSA-N
TotalMolweight278.291
Molweight278.291
MonoisotopicMass278.047361
CLogP1.0251
CLogS-3.313
H Acceptors7
H Donors2
TotalSurfaceArea202.99
Relative PSA0.50067
PolarSurfaceArea145.56
Druglikeness-2.8505
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsaromatic nitro
Shape Index0.63158
Fragments1
Non HAtoms19
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond4
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms3
Aromatic Nitrogens1
AcidicOxygens1
StereoCon

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