Molecule ID: mol16186
SMILES: N[C@H]1C[C@@H](N2Cc3cnc(C(F)(F)F)nc3C2)CC[C@@H]1c1cc(F)c(F)cc1F
InChI: InChI=1S/C19H18F6N4/c20-13-5-15(22)14(21)4-12(13)11-2-1-10(3-16(11)26)29-7-9-6-27-18(19(23,24)25)28-17(9)8-29/h4-6,10-11,16H,1-3,7-8,26H2/t10-,11+,16-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.60 | Baltruschat ChEMBL | 1 » 0 |