N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-[1,2,4]triazolo[4,3-b]pyridazin-6-amine

Formula:C15H14N6 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-[1,2,4]triazolo[4,3-b]pyridazin-6-amine is a drug-like molecule.

MolNameN-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
MolecularFormulaC15H14N6
SmilesC(Cc1c2cccc1)C/C2=N/Nc(cc1)nn2c1nnc2
InChIInChI=1S/C15H14N6/c1-2-6-12-11(4-1)5-3-7-13(12)17-18-14-8-9-15-19-16-10-21(15)20-14/h1-2,4,6,8-10H,3,5,7H2,(H,18,20)
InChIKIUJWHACGARWGJW-UHFFFAOYSA-N
TotalMolweight278.318
Molweight278.318
MonoisotopicMass278.127994
CLogP3.3774
CLogS-4.58
H Acceptors6
H Donors1
TotalSurfaceArea216.76
Relative PSA0.29447
PolarSurfaceArea67.47
Druglikeness0.53927
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.57143
Fragments1
Non HAtoms21
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond2
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms15
Sp3Atoms3
Aromatic Nitrogens4
BasicNitrogens1
StereoCon

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