Molecule ID: mol29584

SMILES: Nc1cc(N2CCCCC2)nc(N)[n+]1O

InChI: InChI=1S/C9H15N5O/c10-7-6-8(12-9(11)14(7)15)13-4-2-1-3-5-13/h6,15H,1-5H2,(H3,10,11,12)/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization