Molecule ID: mol7397

SMILES: CN(C)c1ccn(C)c(=S)n1

InChI: InChI=1S/C7H11N3S/c1-9(2)6-4-5-10(3)7(11)8-6/h4-5H,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization