Molecule ID: mol25851

SMILES: COCNc1nc(N(COC)COC)nc(N(COC)COC)n1

InChI: InChI=1S/C13H26N6O5/c1-20-6-14-11-15-12(18(7-21-2)8-22-3)17-13(16-11)19(9-23-4)10-24-5/h6-10H2,1-5H3,(H,14,15,16,17)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.50 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization