Molecule ID: mol37715
SMILES: N[C@H](CCC[C@H](N)C(=O)O)C(=O)NNC(=O)Oc1ccccc1
InChI: InChI=1S/C14H20N4O5/c15-10(7-4-8-11(16)13(20)21)12(19)17-18-14(22)23-9-5-2-1-3-6-9/h1-3,5-6,10-11H,4,7-8,15-16H2,(H,17,19)(H,18,22)(H,20,21)/t10-,11+/m1/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.10 | QSARToolbox | 2 » 1 |