Molecule ID: mol35432

SMILES: CCCN(CCC)C(=O)CNc1c(C(=O)OCC)cnc2ccc(C)cc12

InChI: InChI=1S/C21H29N3O3/c1-5-10-24(11-6-2)19(25)14-23-20-16-12-15(4)8-9-18(16)22-13-17(20)21(26)27-7-3/h8-9,12-13H,5-7,10-11,14H2,1-4H3,(H,22,23)

Experimental Macro pKa Values

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