Molecule ID: mol29601
SMILES: CC1(Cc2ccccc2)NNC(=O)NC1=O
InChI: InChI=1S/C11H13N3O2/c1-11(7-8-5-3-2-4-6-8)9(15)12-10(16)13-14-11/h2-6,14H,7H2,1H3,(H2,12,13,15,16)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.43 | AttenGpKa training set | 0 » -1 |