Molecule ID: mol29650

SMILES: CC(=O)Nc1ccc(C(=O)Nn2cnnc2)cc1

InChI: InChI=1S/C11H11N5O2/c1-8(17)14-10-4-2-9(3-5-10)11(18)15-16-6-12-13-7-16/h2-7H,1H3,(H,14,17)(H,15,18)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization