Molecule ID: mol19008

SMILES: CN(Cc1ccccc1)Cc1ccccc1CNc1ccnc2cc(Cl)ccc12

InChI: InChI=1S/C25H24ClN3/c1-29(17-19-7-3-2-4-8-19)18-21-10-6-5-9-20(21)16-28-24-13-14-27-25-15-22(26)11-12-23(24)25/h2-15H,16-18H2,1H3,(H,27,28)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
7.57 Baltruschat ChEMBL 2 » 1
9.85 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization