Molecule ID: mol21540
SMILES: CCCCCCCCCCCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)OC
InChI: InChI=1S/C25H50N6O4/c1-3-4-5-6-7-8-9-10-11-17-22(32)30-20(16-14-19-29-25(27)28)23(33)31-21(24(34)35-2)15-12-13-18-26/h20-21H,3-19,26H2,1-2H3,(H,30,32)(H,31,33)(H4,27,28,29)/t20-,21-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.00 | Baltruschat ChEMBL | 2 » 1 |