Molecule ID: mol16789
SMILES: N=c1sc(-c2cccs2)nn1CCCCCCCCCCCCn1nc(-c2cccs2)sc1=N
InChI: InChI=1S/C24H32N6S4/c25-23-29(27-21(33-23)19-13-11-17-31-19)15-9-7-5-3-1-2-4-6-8-10-16-30-24(26)34-22(28-30)20-14-12-18-32-20/h11-14,17-18,25-26H,1-10,15-16H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.80 | Baltruschat ChEMBL | 1 » 0 |