Molecule ID: mol31522

SMILES: Cn1cc[n+](C)c1/C=N/O

InChI: InChI=1S/C6H9N3O/c1-8-3-4-9(2)6(8)5-7-10/h3-5H,1-2H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization