Molecule ID: mol32894
SMILES: N[C@H](Cc1ccc(N(CCCl)CCCl)cc1)C(=O)O
InChI: InChI=1S/C13H18Cl2N2O2/c14-5-7-17(8-6-15)11-3-1-10(2-4-11)9-12(16)13(18)19/h1-4,12H,5-9,16H2,(H,18,19)/t12-/m1/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.90 | OCHEM | 1 » 0 |
| 9.30 | OCHEM | 0 » -1 |