Molecule ID: mol19108
SMILES: Cc1ccc(Oc2cc(NCc3ccccc3)nc(N)n2)cc1
InChI: InChI=1S/C18H18N4O/c1-13-7-9-15(10-8-13)23-17-11-16(21-18(19)22-17)20-12-14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H3,19,20,21,22)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.82 | Baltruschat ChEMBL | 1 » 0 |