Molecule ID: mol28016

SMILES: N=C(N)NCCCCN

InChI: InChI=1S/C5H14N4/c6-3-1-2-4-9-5(7)8/h1-4,6H2,(H4,7,8,9)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
9.00 AttenGpKa training set 2 » 1
12.50 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization