Molecule ID: mol2691

SMILES: Cc1cc(C(=O)C2C(=O)C(C)(C)C(=O)C(C)(C)C2=O)c(=O)n(-c2ccccc2)n1

InChI: InChI=1S/C22H22N2O5/c1-12-11-14(19(28)24(23-12)13-9-7-6-8-10-13)16(25)15-17(26)21(2,3)20(29)22(4,5)18(15)27/h6-11,15H,1-5H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization