pKahub
About
Molecules
Datasets
Molecule ID:
mol15874
SMILES:
CCNC(N)=O
InChI:
InChI=1S/C3H8N2O/c1-2-5-3(4)6/h2H2,1H3,(H3,4,5,6)
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
1.19
Datawarrior
1 » 0
1.19
QSARToolbox
1 » 0
1.19
OCHEM
1 » 0
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization