Molecule ID: mol25496

SMILES: N#Cc1nc(Br)[nH]c1C#N

InChI: InChI=1S/C5HBrN4/c6-5-9-3(1-7)4(2-8)10-5/h(H,9,10)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization