Molecule ID: mol18055
SMILES: CCCCCCCCCn1cc(CN[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]2O)nn1
InChI: InChI=1S/C18H34N4O5/c1-2-3-4-5-6-7-8-9-22-11-12(20-21-22)10-19-13-14(23)16(25)18(27)17(26)15(13)24/h11,13-19,23-27H,2-10H2,1H3/t13-,14-,15+,16+,17-,18-
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.10 | Baltruschat ChEMBL | 1 » 0 |