Molecule ID: mol16133
SMILES: Cc1cccc(Nc2ccncc2S(=O)(=O)/N=C(\NC#N)N2CCCCCC2)c1
InChI: InChI=1S/C20H24N6O2S/c1-16-7-6-8-17(13-16)24-18-9-10-22-14-19(18)29(27,28)25-20(23-15-21)26-11-4-2-3-5-12-26/h6-10,13-14H,2-5,11-12H2,1H3,(H,22,24)(H,23,25)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.00 | Baltruschat ChEMBL | 0 » -1 |