Molecule ID: mol486
SMILES: CCN(CC)CCNC(=O)c1ccc(NC(C)=O)cc1
InChI: InChI=1S/C15H23N3O2/c1-4-18(5-2)11-10-16-15(20)13-6-8-14(9-7-13)17-12(3)19/h6-9H,4-5,10-11H2,1-3H3,(H,16,20)(H,17,19)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.14 | OCHEM | 1 » 0 |
| 9.14 | Hunt | 1 » 0 |