Molecule ID: mol18337
SMILES: c1cc(NC2=NCCN2)ccc1Cc1ccc(NC2=NCCN2)cc1
InChI: InChI=1S/C19H22N6/c1-5-16(24-18-20-9-10-21-18)6-2-14(1)13-15-3-7-17(8-4-15)25-19-22-11-12-23-19/h1-8H,9-13H2,(H2,20,21,24)(H2,22,23,25)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.80 | OCHEM | 1 » 0 |
| 9.80 | Baltruschat ChEMBL | 1 » 0 |