Molecule ID: mol8103
SMILES: CC1=Nc2c(O)nc(O)nc2N(Cc2ccccc2)C1C
InChI: InChI=1S/C15H16N4O2/c1-9-10(2)19(8-11-6-4-3-5-7-11)13-12(16-9)14(20)18-15(21)17-13/h3-7,10H,8H2,1-2H3,(H2,17,18,20,21)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 0.25 | IUPAC digitized pKa | 2 » 1 |
| 9.04 | IUPAC digitized pKa | -1 » -2 |