N-[(Z)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino]pyridine-4-carboxamide

Formula:C9H9N7O2 Mutagenic:none Tumorigenic:high Reproductive Effective:high N-[(Z)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino]pyridine-4-carboxamide is a drug-like molecule.

MolNameN-[(Z)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino]pyridine-4-carboxamide
MolecularFormulaC9H9N7O2
SmilesN/C(/c1nonc1N)=N\NC(c1ccncc1)=O
InChIInChI=1S/C9H9N7O2/c10-7(6-8(11)16-18-15-6)13-14-9(17)5-1-3-12-4-2-5/h1-4H,(H2,10,13)(H2,11,16)(H,14,17)
InChIKBQUOMUNCQFWIQU-UHFFFAOYSA-N
TotalMolweight247.217
Molweight247.217
MonoisotopicMass247.081773
CLogP-0.4059
CLogS-1.559
H Acceptors9
H Donors3
TotalSurfaceArea188.21
Relative PSA0.60342
PolarSurfaceArea145.31
Druglikeness4.0145
Mutagenicnone
Tumorigenichigh
Reproductive Effectivehigh
Irritantnone
Nasty Functionsacyl-hydrazone
Shape Index0.61111
Fragments1
Non HAtoms18
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond3
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms11
Symmetricatoms2
Aromatic Nitrogens3
StereoCon

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