Molecule ID: mol18098
SMILES: O=C(CNC(=O)c1nccc(O)c1O)NCc1ccccc1
InChI: InChI=1S/C15H15N3O4/c19-11-6-7-16-13(14(11)21)15(22)18-9-12(20)17-8-10-4-2-1-3-5-10/h1-7,21H,8-9H2,(H,16,19)(H,17,20)(H,18,22)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.20 | OCHEM | 0 » -1 |
| 6.20 | Baltruschat ChEMBL | 0 » -1 |