Molecule ID: mol2718

SMILES: Cc1cc(C)c(C2C(=O)CC3(CCOCC3)CC2=O)c(C)c1

InChI: InChI=1S/C19H24O3/c1-12-8-13(2)17(14(3)9-12)18-15(20)10-19(11-16(18)21)4-6-22-7-5-19/h8-9,18H,4-7,10-11H2,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization