Molecule ID: mol37335

SMILES: O=C(O)[C@H]1O[C@@H](Oc2ccc3nc(O)ccc3c2)[C@H](O)[C@@H](O)[C@@H]1O

InChI: InChI=1S/C15H15NO8/c17-9-4-1-6-5-7(2-3-8(6)16-9)23-15-12(20)10(18)11(19)13(24-15)14(21)22/h1-5,10-13,15,18-20H,(H,16,17)(H,21,22)/t10-,11-,12+,13-,15+/m0/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.07 QSARToolbox 0 » -1
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Charge States and Microspecies Visualization