Molecule ID: mol33739

SMILES: Nc1nc(SC2CCCCC2)nc2c1ncn2C1OC(CO)C(O)C1O

InChI: InChI=1S/C16H23N5O4S/c17-13-10-14(20-16(19-13)26-8-4-2-1-3-5-8)21(7-18-10)15-12(24)11(23)9(6-22)25-15/h7-9,11-12,15,22-24H,1-6H2,(H2,17,19,20)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.09 OCHEM 1 » 0
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Charge States and Microspecies Visualization