Molecule ID: mol17928
SMILES: Oc1cc(Cl)c(N=C2NCCN2)c(Cl)c1
InChI: InChI=1S/C9H9Cl2N3O/c10-6-3-5(15)4-7(11)8(6)14-9-12-1-2-13-9/h3-4,15H,1-2H2,(H2,12,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.95 | OCHEM | 0 » -1 |
| 7.95 | Baltruschat ChEMBL | 0 » -1 |