Molecule ID: mol19310
SMILES: Cc1cccc(C)c1CNc1cc(C(=O)N(C)C)nc2c(CO)c(C)[nH]c12
InChI: InChI=1S/C21H26N4O2/c1-12-7-6-8-13(2)15(12)10-22-17-9-18(21(27)25(4)5)24-19-16(11-26)14(3)23-20(17)19/h6-9,23,26H,10-11H2,1-5H3,(H,22,24)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.20 | QSARToolbox | 1 » 0 |
| 7.20 | OCHEM | 1 » 0 |
| 7.20 | Baltruschat ChEMBL | 1 » 0 |