Molecule ID: mol20840
SMILES: O=C(O)Cc1ccccc1Nc1cc(Cl)ccc1Cl
InChI: InChI=1S/C14H11Cl2NO2/c15-10-5-6-11(16)13(8-10)17-12-4-2-1-3-9(12)7-14(18)19/h1-6,8,17H,7H2,(H,18,19)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.10 | OCHEM | 0 » -1 |
| 4.10 | Baltruschat ChEMBL | 0 » -1 |