Molecule ID: mol18663

SMILES: Cc1nc2c3c(c(C(=O)N(C)C)cn2c1C)CCC1(Cc2ccccc2C1)O3

InChI: InChI=1S/C23H25N3O2/c1-14-15(2)26-13-19(22(27)25(3)4)18-9-10-23(28-20(18)21(26)24-14)11-16-7-5-6-8-17(16)12-23/h5-8,13H,9-12H2,1-4H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization