Molecule ID: mol13402
SMILES: CN(C)c1ccnc2c(O)cccc12
InChI: InChI=1S/C11H12N2O/c1-13(2)9-6-7-12-11-8(9)4-3-5-10(11)14/h3-7,14H,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.05 | Datawarrior | 1 » 0 |
| 7.05 | QSARToolbox | 1 » 0 |
| 7.05 | OCHEM | 1 » 0 |