Molecule ID: mol36985
SMILES: O=C1CCC(=O)N(O)CCSCCNC(=O)CCC(=O)N(O)CCSCCNC(=O)CCC(=O)N(O)CCSCCN1
InChI: InChI=1S/C24H42N6O9S3/c31-19-1-4-22(34)28(37)10-16-41-14-8-26-20(32)3-6-24(36)30(39)12-18-42-15-9-27-21(33)2-5-23(35)29(38)11-17-40-13-7-25-19/h37-39H,1-18H2,(H,25,31)(H,26,32)(H,27,33)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.49 | QSARToolbox | 0 » -1 |