Molecule ID: mol30267

SMILES: NC(=O)C1COC(c2ccccc2)=N1

InChI: InChI=1S/C10H10N2O2/c11-9(13)8-6-14-10(12-8)7-4-2-1-3-5-7/h1-5,8H,6H2,(H2,11,13)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization