Molecule ID: mol15157
SMILES: CCCCCc1c(-c2ccccc2)n[nH]c1O
InChI: InChI=1S/C14H18N2O/c1-2-3-5-10-12-13(15-16-14(12)17)11-8-6-4-7-9-11/h4,6-9H,2-3,5,10H2,1H3,(H2,15,16,17)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.40 | OCHEM | 0 » -1 |
| 8.40 | Datawarrior | 0 » -1 |