| MolName | N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-[1,2,4]triazolo[4,3-b]pyridazin-6-amine |
| MolecularFormula | C15H14N6 |
| Smiles | C(Cc1c2cccc1)C/C2=N/Nc(cc1)nn2c1nnc2 |
| InChI | InChI=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) |
| InChIK | IUJWHACGARWGJW-UHFFFAOYSA-N |
| TotalMolweight | 278.318 |
| Molweight | 278.318 |
| MonoisotopicMass | 278.127994 |
| CLogP | 3.3774 |
| CLogS | -4.58 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 216.76 |
| Relative PSA | 0.29447 |
| PolarSurfaceArea | 67.47 |
| Druglikeness | 0.53927 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57143 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 2 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 15 |
| Sp3Atoms | 3 |
| Aromatic Nitrogens | 4 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-[1,2,4]triazolo[4,3-b]pyridazin-6-amine | 2 - N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-[1,2,4]triazolo[4,3-b]pyridazin-6-amine