Molecule ID: mol19307
SMILES: Cc1cccc(C)c1CNc1cc(C(=O)N(C)C)nc2c(C)c(C)[nH]c12
InChI: InChI=1S/C21H26N4O/c1-12-8-7-9-13(2)16(12)11-22-17-10-18(21(26)25(5)6)24-19-14(3)15(4)23-20(17)19/h7-10,23H,11H2,1-6H3,(H,22,24)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.56 | QSARToolbox | 1 » 0 |
| 7.56 | OCHEM | 1 » 0 |
| 7.56 | Baltruschat ChEMBL | 1 » 0 |