Molecule ID: mol12576

SMILES: NC(=S)C(N)Cc1ccccc1

InChI: InChI=1S/C9H12N2S/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H2,11,12)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization