Molecule ID: mol8526
SMILES: NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCC(=O)O)C(=O)O
InChI: InChI=1S/C13H19N5O6/c14-4-10(19)17-9(3-7-5-15-6-16-7)12(22)18-8(13(23)24)1-2-11(20)21/h5-6,8-9H,1-4,14H2,(H,15,16)(H,17,19)(H,18,22)(H,20,21)(H,23,24)/t8-,9-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.65 | IUPAC digitized pKa | 0 » -1 |