Molecule ID: mol27267

SMILES: Cc1cc(NC(=O)C2CCCCC2)sn1

InChI: InChI=1S/C11H16N2OS/c1-8-7-10(15-13-8)12-11(14)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3,(H,12,14)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization