Molecule ID: mol20384

SMILES: CCN(CC)c1ccc(OC)c2nc(-c3c(OC)cc(COC)cc3OC)c(C)cc12

InChI: InChI=1S/C25H32N2O4/c1-8-27(9-2)19-10-11-20(29-5)25-18(19)12-16(3)24(26-25)23-21(30-6)13-17(15-28-4)14-22(23)31-7/h10-14H,8-9,15H2,1-7H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
6.01 Baltruschat ChEMBL 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization