Molecule ID: mol12304

SMILES: O=C(Cc1ccccc1)C1C(=O)N(c2ccccc2)N(c2ccc(O)cc2)C1=O

InChI: InChI=1S/C23H18N2O4/c26-19-13-11-18(12-14-19)25-23(29)21(20(27)15-16-7-3-1-4-8-16)22(28)24(25)17-9-5-2-6-10-17/h1-14,21,26H,15H2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.00 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization