Molecule ID: mol32703
SMILES: COc1cc(S(C)(=O)=O)cc(C(=O)NC2CC3CCC(C2)N3Cc2ccccc2)c1OC
InChI: InChI=1S/C24H30N2O5S/c1-30-22-14-20(32(3,28)29)13-21(23(22)31-2)24(27)25-17-11-18-9-10-19(12-17)26(18)15-16-7-5-4-6-8-16/h4-8,13-14,17-19H,9-12,15H2,1-3H3,(H,25,27)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.92 | OCHEM | 1 » 0 |