Molecule ID: mol16443
SMILES: O=C(CCN(CCO)CCO)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)CCN(CCO)CCO)cc1C2=O
InChI: InChI=1S/C28H36N4O8/c33-13-9-31(10-14-34)7-5-25(37)29-19-1-3-21-23(17-19)28(40)22-4-2-20(18-24(22)27(21)39)30-26(38)6-8-32(11-15-35)12-16-36/h1-4,17-18,33-36H,5-16H2,(H,29,37)(H,30,38)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.00 | Baltruschat ChEMBL | 1 » 0 |