Molecule ID: mol195
SMILES: CN1CCCCC1
InChI: InChI=1S/C6H13N/c1-7-5-3-2-4-6-7/h2-6H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.10 | Baltruschat ChEMBL | 1 » 0 |
| 9.42 | IUPAC digitized pKa | 1 » 0 |
| 10.07 | IUPAC digitized pKa | 1 » 0 |
| 10.08 | IUPAC digitized pKa | 1 » 0 |
| 10.08 | Datawarrior | 1 » 0 |
| 10.08 | Organic Oxygen Acids and Nitrogen Bases | 1 » 0 |
| 10.08 | OCHEM | 1 » 0 |
| 10.08 | OCHEM | 1 » 0 |
| 10.08 | OCHEM | 1 » 0 |
| 10.08 | AttenGpKa training set | 1 » 0 |
| 10.10 | OCHEM | 1 » 0 |
| 10.10 | OCHEM | 1 » 0 |
| 10.10 | Hunt | 1 » 0 |
| 10.10 | Settimo | 1 » 0 |
| 10.14 | OCHEM | 1 » 0 |
| 10.19 | IUPAC digitized pKa | 1 » 0 |
| 10.19 | OCHEM | 1 » 0 |
| 10.19 | OCHEM | 1 » 0 |
| 10.38 | IUPAC digitized pKa | 1 » 0 |