Molecule ID: mol17739

SMILES: COc1ccc(-c2nnc(C(=O)N3CC(Oc4ccc(CN5CCCC5)cc4)C3)o2)cc1

InChI: InChI=1S/C24H26N4O4/c1-30-19-10-6-18(7-11-19)22-25-26-23(32-22)24(29)28-15-21(16-28)31-20-8-4-17(5-9-20)14-27-12-2-3-13-27/h4-11,21H,2-3,12-16H2,1H3

Experimental Macro pKa Values

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