Molecule ID: mol19956
SMILES: Nc1cc(C2CCNCC2)cc(OC2CCCC2)n1
InChI: InChI=1S/C15H23N3O/c16-14-9-12(11-5-7-17-8-6-11)10-15(18-14)19-13-3-1-2-4-13/h9-11,13,17H,1-8H2,(H2,16,18)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.70 | OCHEM | 2 » 1 |
| 4.70 | Baltruschat ChEMBL | 2 » 1 |