4-amino-N'-[(3,4-dichlorophenyl)methoxy]-1,2,5-oxadiazole-3-carboximidamide

Formula:C10H9N5O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-amino-N'-[(3,4-dichlorophenyl)methoxy]-1,2,5-oxadiazole-3-carboximidamide is a drug-like molecule.

MolName4-amino-N'-[(3,4-dichlorophenyl)methoxy]-1,2,5-oxadiazole-3-carboximidamide
MolecularFormulaC10H9N5O2Cl2
SmilesN/C(/c1nonc1N)=N/OCc(cc1)cc(Cl)c1Cl
InChIInChI=1S/C10H9Cl2N5O2/c11-6-2-1-5(3-7(6)12)4-18-16-9(13)8-10(14)17-19-15-8/h1-3H,4H2,(H2,13,16)(H2,14,17)
InChIKXTTPIUGTWLYEOX-UHFFFAOYSA-N
TotalMolweight302.12
Molweight302.12
MonoisotopicMass301.013329
CLogP2.4411
CLogS-3.747
H Acceptors7
H Donors2
TotalSurfaceArea214.84
Relative PSA0.41007
PolarSurfaceArea112.55
Druglikeness0.93577
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.63158
Fragments1
Non HAtoms19
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond4
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms2
Aromatic Nitrogens2
StereoCon

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