Molecule ID: mol10697

SMILES: CCNc1nc(=O)n(C)cc1C

InChI: InChI=1S/C8H13N3O/c1-4-9-7-6(2)5-11(3)8(12)10-7/h5H,4H2,1-3H3,(H,9,10,12)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.58 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization