Molecule ID: mol16436
SMILES: O=C(CCN1CCC(CCO)CC1)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)CCN3CCC(CCO)CC3)cc1C2=O
InChI: InChI=1S/C34H44N4O6/c39-19-11-23-5-13-37(14-6-23)17-9-31(41)35-25-1-3-27-29(21-25)34(44)28-4-2-26(22-30(28)33(27)43)36-32(42)10-18-38-15-7-24(8-16-38)12-20-40/h1-4,21-24,39-40H,5-20H2,(H,35,41)(H,36,42)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.00 | Baltruschat ChEMBL | 1 » 0 |