4-amino-N'-[(Z)-(2-chlorophenyl)methylideneamino]-1,2,5-oxadiazole-3-carboximidamide

Formula:C10H9N6OCl Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-amino-N'-[(Z)-(2-chlorophenyl)methylideneamino]-1,2,5-oxadiazole-3-carboximidamide is a drug-like molecule.

MolName4-amino-N'-[(Z)-(2-chlorophenyl)methylideneamino]-1,2,5-oxadiazole-3-carboximidamide
MolecularFormulaC10H9N6OCl
SmilesN/C(/c1nonc1N)=N/N=C\c(cccc1)c1Cl
InChIInChI=1S/C10H9ClN6O/c11-7-4-2-1-3-6(7)5-14-15-9(12)8-10(13)17-18-16-8/h1-5H,(H2,12,15)(H2,13,17)
InChIKBSLCZKAFEKNPDD-UHFFFAOYSA-N
TotalMolweight264.675
Molweight264.675
MonoisotopicMass264.052636
CLogP2.785
CLogS-3.501
H Acceptors7
H Donors2
TotalSurfaceArea200.42
Relative PSA0.44711
PolarSurfaceArea115.68
Druglikeness2.574
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsdimethylene-hydrazine; imine/hydrazone of aldehyde
Shape Index0.61111
Fragments1
Non HAtoms18
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond3
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms11
Aromatic Nitrogens2
StereoCon

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