Molecule ID: mol24645

SMILES: CCCOC1=NOC2(C1)CN1CCC2CC1

InChI: InChI=1S/C12H20N2O2/c1-2-7-15-11-8-12(16-13-11)9-14-5-3-10(12)4-6-14/h10H,2-9H2,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization