Molecule ID: mol8125

SMILES: Nc1nc(N)c2c(n1)NCCN2C(=O)CCl

InChI: InChI=1S/C8H11ClN6O/c9-3-4(16)15-2-1-12-7-5(15)6(10)13-8(11)14-7/h1-3H2,(H5,10,11,12,13,14)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization