Molecule ID: mol18316
SMILES: Nc1c2ccccc2nc2c(C(=O)NCCN3CCOCC3)cccc12
InChI: InChI=1S/C20H22N4O2/c21-18-14-4-1-2-7-17(14)23-19-15(18)5-3-6-16(19)20(25)22-8-9-24-10-12-26-13-11-24/h1-7H,8-13H2,(H2,21,23)(H,22,25)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.70 | OCHEM | 2 » 1 |
| 6.70 | Baltruschat ChEMBL | 2 » 1 |