Molecule ID: mol28110

SMILES: COc1ccc(N=C(N(C)C)N(C)C)c(OC)c1

InChI: InChI=1S/C13H21N3O2/c1-15(2)13(16(3)4)14-11-8-7-10(17-5)9-12(11)18-6/h7-9H,1-6H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization