Molecule ID: mol37275
SMILES: C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)CN)C(=O)O
InChI: InChI=1S/C11H18N4O7/c1-5(11(21)22)14-10(20)6(2-9(18)19)15-8(17)4-13-7(16)3-12/h5-6H,2-4,12H2,1H3,(H,13,16)(H,14,20)(H,15,17)(H,18,19)(H,21,22)/t5-,6-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.90 | QSARToolbox | 0 » -1 |