6-N-(4-fluorophenyl)-5-N-[(Z)-furan-2-ylmethylideneamino]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine

Formula:C15H10N7O2F Mutagenic:none Tumorigenic:none Reproductive Effective:none 6-N-(4-fluorophenyl)-5-N-[(Z)-furan-2-ylmethylideneamino]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine is a drug-like molecule.

MolName6-N-(4-fluorophenyl)-5-N-[(Z)-furan-2-ylmethylideneamino]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
MolecularFormulaC15H10N7O2F
SmilesFc(cc1)ccc1Nc1nc2nonc2nc1N/N=C\c1ccco1
InChIInChI=1S/C15H10FN7O2/c16-9-3-5-10(6-4-9)18-12-13(20-15-14(19-12)22-25-23-15)21-17-8-11-2-1-7-24-11/h1-8H,(H,18,19,22)(H,20,21,23)
InChIKWLMSHBGICXOWNZ-UHFFFAOYSA-N
TotalMolweight339.289
Molweight339.289
MonoisotopicMass339.088001
CLogP4.8783
CLogS-5.512
H Acceptors9
H Donors2
TotalSurfaceArea255.83
Relative PSA0.41641
PolarSurfaceArea114.26
Druglikeness1.8325
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.56
Fragments1
Non HAtoms25
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms20
Symmetricatoms2
Aromatic Nitrogens4
StereoCon

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