Molecule ID: mol7445

SMILES: CCC1(c2ccccc2)C(=O)N(CCN2CCOCC2)C(=O)N(CCN2CCOCC2)C1=O

InChI: InChI=1S/C24H34N4O5/c1-2-24(20-6-4-3-5-7-20)21(29)27(10-8-25-12-16-32-17-13-25)23(31)28(22(24)30)11-9-26-14-18-33-19-15-26/h3-7H,2,8-19H2,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.91 IUPAC digitized pKa 1 » 0
5.90 IUPAC digitized pKa 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization