Molecule ID: mol3135
SMILES: NCCN
InChI: InChI=1S/C2H8N2/c3-1-2-4/h1-4H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.87 | QSARToolbox | 2 » 1 |
| 5.99 | QSARToolbox | 2 » 1 |
| 5.99 | IUPAC digitized pKa | 2 » 1 |
| 6.22 | IUPAC digitized pKa | 2 » 1 |
| 6.46 | IUPAC digitized pKa | 2 » 1 |
| 6.50 | IUPAC digitized pKa | 2 » 1 |
| 6.50 | QSARToolbox | 2 » 1 |
| 6.66 | QSARToolbox | 2 » 1 |
| 6.72 | IUPAC digitized pKa | 2 » 1 |
| 6.79 | IUPAC digitized pKa | 2 » 1 |
| 6.80 | IUPAC digitized pKa | 2 » 1 |
| 6.84 | IUPAC digitized pKa | 2 » 1 |
| 6.84 | QSARToolbox | 2 » 1 |
| 6.85 | IUPAC digitized pKa | 2 » 1 |
| 6.86 | IUPAC digitized pKa | 2 » 1 |
| 6.86 | QSARToolbox | 2 » 1 |
| 6.90 | QSARToolbox | 2 » 1 |
| 6.91 | QSARToolbox | 2 » 1 |
| 6.96 | QSARToolbox | 2 » 1 |
| 6.98 | QSARToolbox | 2 » 1 |
| 6.99 | IUPAC digitized pKa | 2 » 1 |
| 7.00 | IUPAC digitized pKa | 2 » 1 |
| 7.03 | IUPAC digitized pKa | 2 » 1 |
| 7.05 | QSARToolbox | 2 » 1 |
| 7.06 | QSARToolbox | 2 » 1 |
| 7.08 | QSARToolbox | 2 » 1 |
| 7.10 | OCHEM | 2 » 1 |
| 7.12 | QSARToolbox | 2 » 1 |
| 7.14 | Datawarrior | 2 » 1 |
| 7.15 | AttenGpKa training set | 2 » 1 |
| 7.23 | QSARToolbox | 2 » 1 |
| 7.23 | QSARToolbox | 2 » 1 |
| 7.27 | IUPAC digitized pKa | 2 » 1 |
| 7.28 | IUPAC digitized pKa | 2 » 1 |
| 7.28 | IUPAC digitized pKa | 2 » 1 |
| 7.28 | QSARToolbox | 2 » 1 |
| 7.30 | QSARToolbox | 2 » 1 |
| 7.41 | QSARToolbox | 2 » 1 |
| 7.43 | QSARToolbox | 2 » 1 |
| 7.44 | QSARToolbox | 2 » 1 |
| 7.47 | QSARToolbox | 2 » 1 |
| 7.47 | IUPAC digitized pKa | 2 » 1 |
| 7.56 | IUPAC digitized pKa | 2 » 1 |
| 7.98 | IUPAC digitized pKa | 2 » 1 |
| 9.00 | QSARToolbox | 1 » 0 |
| 9.01 | IUPAC digitized pKa | 1 » 0 |
| 9.25 | IUPAC digitized pKa | 1 » 0 |
| 9.40 | QSARToolbox | 1 » 0 |
| 9.51 | IUPAC digitized pKa | 1 » 0 |
| 9.53 | QSARToolbox | 1 » 0 |
| 9.53 | IUPAC digitized pKa | 1 » 0 |
| 9.70 | QSARToolbox | 1 » 0 |
| 9.70 | QSARToolbox | 1 » 0 |
| 9.76 | OCHEM | 1 » 0 |
| 9.78 | IUPAC digitized pKa | 1 » 0 |
| 9.81 | IUPAC digitized pKa | 1 » 0 |
| 9.87 | IUPAC digitized pKa | 1 » 0 |
| 9.89 | QSARToolbox | 1 » 0 |
| 9.90 | QSARToolbox | 1 » 0 |
| 9.92 | AttenGpKa training set | 1 » 0 |
| 9.92 | QSARToolbox | 1 » 0 |
| 9.92 | IUPAC digitized pKa | 1 » 0 |
| 9.92 | Organic Oxygen Acids and Nitrogen Bases | 1 » 0 |
| 9.93 | IUPAC digitized pKa | 1 » 0 |
| 9.93 | QSARToolbox | 1 » 0 |
| 9.93 | IUPAC digitized pKa | 1 » 0 |
| 9.96 | QSARToolbox | 1 » 0 |
| 9.98 | OCHEM | 1 » 0 |
| 9.98 | QSARToolbox | 1 » 0 |
| 9.98 | QSARToolbox | 1 » 0 |
| 9.98 | IUPAC digitized pKa | 1 » 0 |
| 9.98 | Datawarrior | 1 » 0 |
| 10.05 | QSARToolbox | 1 » 0 |
| 10.06 | QSARToolbox | 1 » 0 |
| 10.07 | QSARToolbox | 1 » 0 |
| 10.07 | QSARToolbox | 1 » 0 |
| 10.08 | IUPAC digitized pKa | 1 » 0 |
| 10.09 | IUPAC digitized pKa | 1 » 0 |
| 10.17 | QSARToolbox | 1 » 0 |
| 10.18 | IUPAC digitized pKa | 1 » 0 |
| 10.18 | QSARToolbox | 1 » 0 |
| 10.19 | QSARToolbox | 1 » 0 |
| 10.24 | IUPAC digitized pKa | 1 » 0 |
| 10.38 | IUPAC digitized pKa | 1 » 0 |
| 10.39 | IUPAC digitized pKa | 1 » 0 |
| 10.69 | QSARToolbox | 1 » 0 |
| 10.71 | IUPAC digitized pKa | 1 » 0 |
| 10.73 | IUPAC digitized pKa | 1 » 0 |