Molecule ID: mol34951

SMILES: CC1=NN(c2nc(C)c(C)c(C#N)n2)C(=O)C1

InChI: InChI=1S/C11H11N5O/c1-6-4-10(17)16(15-6)11-13-8(3)7(2)9(5-12)14-11/h4H2,1-3H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
8.12 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization