Molecule ID: mol32043

SMILES: CN1CCN=C1N/N=C/[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/C24H40N4O2/c1-22-9-7-18(29)14-16(22)4-5-20-19(22)8-10-23(2)17(6-11-24(20,23)30)15-26-27-21-25-12-13-28(21)3/h15-20,29-30H,4-14H2,1-3H3,(H,25,27)/b26-15+/t16-,17-,18+,19+,20-,22+,23-,24+/m1/s1

Experimental Macro pKa Values

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