Molecule ID: mol32804
SMILES: COc1cc(S(N)(=O)=O)cc(C(=O)NC2CC3CCC(C2)N3Cc2ccccc2)c1OC
InChI: InChI=1S/C23H29N3O5S/c1-30-21-13-19(32(24,28)29)12-20(22(21)31-2)23(27)25-16-10-17-8-9-18(11-16)26(17)14-15-6-4-3-5-7-15/h3-7,12-13,16-18H,8-11,14H2,1-2H3,(H,25,27)(H2,24,28,29)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.87 | OCHEM | 1 » 0 |