Molecule ID: mol5173

SMILES: Cc1ccn2c1[C@H](O)CC2

InChI: InChI=1S/C8H11NO/c1-6-2-4-9-5-3-7(10)8(6)9/h2,4,7,10H,3,5H2,1H3/t7-/m1/s1

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
9.51 IUPAC digitized pKa 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization