Molecule ID: mol18745

SMILES: NC1=NCC(C(=O)O)CC1

InChI: InChI=1S/C6H10N2O2/c7-5-2-1-4(3-8-5)6(9)10/h4H,1-3H2,(H2,7,8)(H,9,10)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization