Molecule ID: mol19536

SMILES: O=[N+]([O-])c1c(NC2CC2)nc(C2CC2)nc1N1CCCCCC1

InChI: InChI=1S/C16H23N5O2/c22-21(23)13-15(17-12-7-8-12)18-14(11-5-6-11)19-16(13)20-9-3-1-2-4-10-20/h11-12H,1-10H2,(H,17,18,19)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.64 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization