Molecule ID: mol30940

SMILES: CN(C)c1ccc(N=C2c3ccccc3C(=O)c3ccccc32)cc1

InChI: InChI=1S/C22H18N2O/c1-24(2)16-13-11-15(12-14-16)23-21-17-7-3-5-9-19(17)22(25)20-10-6-4-8-18(20)21/h3-14H,1-2H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
4.34 AttenGpKa training set 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization