Molecule ID: mol4986
SMILES: COC(=O)c1ccc2nc3cc(N)ccc3cc2c1
InChI: InChI=1S/C15H12N2O2/c1-19-15(18)10-3-5-13-11(7-10)6-9-2-4-12(16)8-14(9)17-13/h2-8H,16H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.10 | QSARToolbox | 1 » 0 |
| 7.10 | QSARToolbox | 1 » 0 |
| 7.10 | IUPAC digitized pKa | 1 » 0 |
| 7.10 | OCHEM | 1 » 0 |
| 7.10 | AttenGpKa training set | 1 » 0 |