Molecule ID: mol28126

SMILES: CN(C)C(=Nc1ccc(Br)cn1)N(C)C

InChI: InChI=1S/C10H15BrN4/c1-14(2)10(15(3)4)13-9-6-5-8(11)7-12-9/h5-7H,1-4H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization