Molecule ID: mol2126
SMILES: CN(C)CC[C@@H](c1ccc(Cl)cc1)c1ccccn1
InChI: InChI=1S/C16H19ClN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3/t15-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.26 | Hunt | 1 » 0 |