Molecule ID: mol18903

SMILES: O=[N+]([O-])c1ncn(CCCN(Cc2ccc3ccc(Cl)cc3n2)Cc2ccc3ccc(Cl)cc3n2)n1

InChI: InChI=1S/C25H21Cl2N7O2/c26-19-6-2-17-4-8-21(29-23(17)12-19)14-32(10-1-11-33-16-28-25(31-33)34(35)36)15-22-9-5-18-3-7-20(27)13-24(18)30-22/h2-9,12-13,16H,1,10-11,14-15H2

Experimental Macro pKa Values

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