Molecule ID: mol17624
SMILES: CC(C)N1CCC(Oc2ccc3nc(C(=O)N4CCC[C@H]4C#N)ccc3c2)CC1
InChI: InChI=1S/C23H28N4O2/c1-16(2)26-12-9-19(10-13-26)29-20-6-8-21-17(14-20)5-7-22(25-21)23(28)27-11-3-4-18(27)15-24/h5-8,14,16,18-19H,3-4,9-13H2,1-2H3/t18-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.50 | Baltruschat ChEMBL | 1 » 0 |