Molecule ID: mol19308
SMILES: CCc1cccc(C)c1CNc1cc(C(=O)N(C)C)nc2c(C)c(C)[nH]c12
InChI: InChI=1S/C22H28N4O/c1-7-16-10-8-9-13(2)17(16)12-23-18-11-19(22(27)26(5)6)25-20-14(3)15(4)24-21(18)20/h8-11,24H,7,12H2,1-6H3,(H,23,25)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.57 | OCHEM | 1 » 0 |
| 7.57 | Baltruschat ChEMBL | 1 » 0 |
| 7.57 | QSARToolbox | 1 » 0 |