Molecule ID: mol20491

SMILES: CCN(CC)CCS/C(=N\O)c1nnc(-c2ccccc2)o1

InChI: InChI=1S/C15H20N4O2S/c1-3-19(4-2)10-11-22-15(18-20)14-17-16-13(21-14)12-8-6-5-7-9-12/h5-9,20H,3-4,10-11H2,1-2H3/b18-15-

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
6.35 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization