pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.7	Baltruschat ChEMBL	1	0	Cc1cc(COc2cc(C)[nH+]n2C2CCCC2)n(-c2ccccc2)n1,Cc1cc(OCc2cc(C)[nH+]n2-c2ccccc2)n(C2CCCC2)n1	Cc1cc(COc2cc(C)nn2C2CCCC2)n(-c2ccccc2)n1	mol18648	Cc1cc(COc2cc(C)nn2C2CCCC2)n(-c2ccccc2)n1