Molecule ID: mol34324

SMILES: O=C(O)CNc1cccc2cccnc12

InChI: InChI=1S/C11H10N2O2/c14-10(15)7-13-9-5-1-3-8-4-2-6-12-11(8)9/h1-6,13H,7H2,(H,14,15)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.99 QSARToolbox 1 » 0
2.99 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization