Molecule ID: mol3039

SMILES: CC1=CCN2CCC[C@@H]12

InChI: InChI=1S/C8H13N/c1-7-4-6-9-5-2-3-8(7)9/h4,8H,2-3,5-6H2,1H3/t8-/m0/s1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization