Molecule ID: mol36808
SMILES: O=C(NCCN(CCNC(=O)c1cccnc1O)CCNC(=O)c1cccnc1O)c1cccnc1O
InChI: InChI=1S/C24H27N7O6/c32-19-16(4-1-7-25-19)22(35)28-10-13-31(14-11-29-23(36)17-5-2-8-26-20(17)33)15-12-30-24(37)18-6-3-9-27-21(18)34/h1-9H,10-15H2,(H,25,32)(H,26,33)(H,27,34)(H,28,35)(H,29,36)(H,30,37)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.00 | QSARToolbox | 0 » -1 |