Molecule ID: mol17165
SMILES: CCN(CC)CCCn1c2ccccc2c(=O)c2cc(Cl)ccc21
InChI: InChI=1S/C20H23ClN2O/c1-3-22(4-2)12-7-13-23-18-9-6-5-8-16(18)20(24)17-14-15(21)10-11-19(17)23/h5-6,8-11,14H,3-4,7,12-13H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.37 | OCHEM | 2 » 1 |
| 5.37 | Baltruschat ChEMBL | 2 » 1 |