Molecule ID: mol31466

SMILES: CN(O)C(=O)CCCNC(=O)CCC(=O)N(C)O

InChI: InChI=1S/C10H19N3O5/c1-12(17)9(15)4-3-7-11-8(14)5-6-10(16)13(2)18/h17-18H,3-7H2,1-2H3,(H,11,14)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
8.39 AttenGpKa training set -1 » -2
9.28 AttenGpKa training set -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization