Molecule ID: mol15102
SMILES: CCCCN(CCCC)c1nnc(-c2ccccc2)cc1C
InChI: InChI=1S/C19H27N3/c1-4-6-13-22(14-7-5-2)19-16(3)15-18(20-21-19)17-11-9-8-10-12-17/h8-12,15H,4-7,13-14H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.88 | Datawarrior | 1 » 0 |
| 4.88 | OCHEM | 1 » 0 |
| 4.88 | QSARToolbox | 1 » 0 |