Molecule ID: mol3057
SMILES: C[C@H](N)Cc1ccccc1
InChI: InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3/t8-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.94 | OCHEM | 1 » 0 |
| 9.94 | OCHEM | 1 » 0 |
| 9.94 | OCHEM | 1 » 0 |
| 9.94 | AvLiLuMoVe | 1 » 0 |