Molecule ID: mol19315
SMILES: Cc1cc2nc(C(=O)N(C)C)cc(NCc3c(C)cccc3C)c2[nH]1
InChI: InChI=1S/C20H24N4O/c1-12-7-6-8-13(2)15(12)11-21-16-10-18(20(25)24(4)5)23-17-9-14(3)22-19(16)17/h6-10,22H,11H2,1-5H3,(H,21,23)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.30 | OCHEM | 1 » 0 |
| 7.30 | Baltruschat ChEMBL | 1 » 0 |
| 7.30 | QSARToolbox | 1 » 0 |