Molecule ID: mol32044

SMILES: C/C(=N\N=C(N)N)[C@H]1CC[C@]2(O)[C@@H]3CC[C@@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

InChI: InChI=1S/C22H38N4O2/c1-13(25-26-19(23)24)16-8-11-22(28)18-5-4-14-12-15(27)6-9-20(14,2)17(18)7-10-21(16,22)3/h14-18,27-28H,4-12H2,1-3H3,(H4,23,24,26)/b25-13+/t14-,15+,16-,17+,18-,20+,21-,22+/m1/s1

Experimental Macro pKa Values

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