Molecule ID: mol26718

SMILES: Cc1cc(C)c2nc3c(C)cc(C)c(C)c3cc2c1C

InChI: InChI=1S/C19H21N/c1-10-7-12(3)18-16(14(10)5)9-17-15(6)11(2)8-13(4)19(17)20-18/h7-9H,1-6H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
3.50 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization