Molecule ID: mol17708

SMILES: COC1CN(c2nc(C3CC3)nc(N3CCCCCC3)c2C)C1

InChI: InChI=1S/C18H28N4O/c1-13-17(21-9-5-3-4-6-10-21)19-16(14-7-8-14)20-18(13)22-11-15(12-22)23-2/h14-15H,3-12H2,1-2H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
6.80 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization