Molecule ID: mol5851
SMILES: CC1CCCCC1NCCNCCNC1CCCCC1C
InChI: InChI=1S/C18H37N3/c1-15-7-3-5-9-17(15)20-13-11-19-12-14-21-18-10-6-4-8-16(18)2/h15-21H,3-14H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.50 | IUPAC digitized pKa | 3 » 2 |
| 3.50 | IUPAC digitized pKa | 3 » 2 |
| 9.10 | IUPAC digitized pKa | 2 » 1 |
| 9.10 | IUPAC digitized pKa | 2 » 1 |
| 10.10 | IUPAC digitized pKa | 1 » 0 |
| 10.10 | IUPAC digitized pKa | 1 » 0 |