Molecule ID: mol387

SMILES: c1cnc(N2CCN(C3CC4CCC3C4)CC2)nc1

InChI: InChI=1S/C15H22N4/c1-4-16-15(17-5-1)19-8-6-18(7-9-19)14-11-12-2-3-13(14)10-12/h1,4-5,12-14H,2-3,6-11H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization