Molecule ID: mol35343

SMILES: Cc1cc(C)c2c(O)c(N=Nc3ccc([N+](=O)[O-])cc3)sc2n1

InChI: InChI=1S/C15H12N4O3S/c1-8-7-9(2)16-14-12(8)13(20)15(23-14)18-17-10-3-5-11(6-4-10)19(21)22/h3-7,20H,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization