Molecule ID: mol4703

SMILES: COc1nc(NC(C)=O)nc2nccnc12

InChI: InChI=1S/C9H9N5O2/c1-5(15)12-9-13-7-6(8(14-9)16-2)10-3-4-11-7/h3-4H,1-2H3,(H,11,12,13,14,15)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
1.95 IUPAC digitized pKa 1 » 0
1.95 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization