Molecule ID: mol21682

SMILES: O=C(c1ccc(Cl)cc1NS(=O)(=O)c1cccc2nsnc12)N1CCCCC1

InChI: InChI=1S/C18H17ClN4O3S2/c19-12-7-8-13(18(24)23-9-2-1-3-10-23)15(11-12)22-28(25,26)16-6-4-5-14-17(16)21-27-20-14/h4-8,11,22H,1-3,9-10H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.47 Baltruschat ChEMBL 0 » -1
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Charge States and Microspecies Visualization