Molecule ID: mol37392
SMILES: CNC(=O)CNC(=O)CNC(=O)C[C@H](NC(=O)CNC(C)=O)C(=O)O
InChI: InChI=1S/C13H21N5O7/c1-7(19)15-6-12(23)18-8(13(24)25)3-9(20)16-5-11(22)17-4-10(21)14-2/h8H,3-6H2,1-2H3,(H,14,21)(H,15,19)(H,16,20)(H,17,22)(H,18,23)(H,24,25)/t8-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.40 | QSARToolbox | 0 » -1 |