Molecule ID: mol19093

SMILES: NC(Cc1cc(I)c(Oc2ccc(O)c(O)c2)c(I)c1)C(=O)O

InChI: InChI=1S/C15H13I2NO5/c16-9-3-7(5-11(18)15(21)22)4-10(17)14(9)23-8-1-2-12(19)13(20)6-8/h1-4,6,11,19-20H,5,18H2,(H,21,22)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
9.34 Baltruschat ChEMBL -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization