Molecule ID: mol16997
SMILES: CCN(CC)CCCN1c2cc(F)ccc2CCc2ccc(F)cc21
InChI: InChI=1S/C21H26F2N2/c1-3-24(4-2)12-5-13-25-20-14-18(22)10-8-16(20)6-7-17-9-11-19(23)15-21(17)25/h8-11,14-15H,3-7,12-13H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.60 | OCHEM | 1 » 0 |
| 7.60 | Baltruschat ChEMBL | 1 » 0 |
| 7.70 | OCHEM | 1 » 0 |
| 7.70 | Baltruschat ChEMBL | 1 » 0 |