Molecule ID: mol21624
SMILES: Cc1nc2c3c(c(C(=O)N(C)C)cc2n1C)CC[C@@H](c1ccccc1C1CC1)O3
InChI: InChI=1S/C24H27N3O2/c1-14-25-22-20(27(14)4)13-19(24(28)26(2)3)18-11-12-21(29-23(18)22)17-8-6-5-7-16(17)15-9-10-15/h5-8,13,15,21H,9-12H2,1-4H3/t21-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.63 | Baltruschat ChEMBL | 1 » 0 |