Molecule ID: mol19351
SMILES: Cc1cccc(C)c1NC(=O)CCCC(C)N
InChI: InChI=1S/C14H22N2O/c1-10-6-4-7-11(2)14(10)16-13(17)9-5-8-12(3)15/h4,6-7,12H,5,8-9,15H2,1-3H3,(H,16,17)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.79 | OCHEM | 1 » 0 |
| 9.79 | Baltruschat ChEMBL | 1 » 0 |