Molecule ID: mol21449
SMILES: COc1ccc(N(Cc2nnn[nH]2)Cc2ccc(Cl)cc2Cl)cc1
InChI: InChI=1S/C16H15Cl2N5O/c1-24-14-6-4-13(5-7-14)23(10-16-19-21-22-20-16)9-11-2-3-12(17)8-15(11)18/h2-8H,9-10H2,1H3,(H,19,20,21,22)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.29 | Baltruschat ChEMBL | 0 » -1 |