Molecule ID: mol21023

SMILES: Nc1noc(C2CN3CCN2CC3)n1

InChI: InChI=1S/C8H13N5O/c9-8-10-7(14-11-8)6-5-12-1-3-13(6)4-2-12/h6H,1-5H2,(H2,9,11)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization