Molecule ID: mol24127

SMILES: CN(C)c1ccc(/N=N/c2ccc(C(C)(C)C)cc2)cc1

InChI: InChI=1S/C18H23N3/c1-18(2,3)14-6-8-15(9-7-14)19-20-16-10-12-17(13-11-16)21(4)5/h6-13H,1-5H3/b20-19+

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-3.55 AttenGpKa training set 3 » 2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization