2-[5-(4-fluorophenyl)tetrazol-2-yl]-N'-hydroxyethanimidamide

Formula:C9H9N6OF Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[5-(4-fluorophenyl)tetrazol-2-yl]-N'-hydroxyethanimidamide is a drug-like molecule.

MolName2-[5-(4-fluorophenyl)tetrazol-2-yl]-N'-hydroxyethanimidamide
MolecularFormulaC9H9N6OF
SmilesN/C(/Cn1nnc(-c(cc2)ccc2F)n1)=N/O
InChIInChI=1S/C9H9FN6O/c10-7-3-1-6(2-4-7)9-12-15-16(13-9)5-8(11)14-17/h1-4,17H,5H2,(H2,11,14)
InChIKFDEUCBJXFWJXFT-UHFFFAOYSA-N
TotalMolweight236.209
Molweight236.209
MonoisotopicMass236.082187
CLogP0.7804
CLogS-2.462
H Acceptors7
H Donors2
TotalSurfaceArea176.45
Relative PSA0.45146
PolarSurfaceArea102.21
Druglikeness-3.6652
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.70588
Fragments1
Non HAtoms17
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond3
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms2
Symmetricatoms2
Aromatic Nitrogens4
StereoCon

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