Molecule ID: mol14613

SMILES: C=CCN(CC=C)CCCNC(=O)/C=N/O

InChI: InChI=1S/C11H19N3O2/c1-3-7-14(8-4-2)9-5-6-12-11(15)10-13-16/h3-4,10,16H,1-2,5-9H2,(H,12,15)/b13-10+

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.14 Datawarrior 1 » 0
9.34 Datawarrior 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization