pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.6	Baltruschat ChEMBL	1	0	C[NH+](C)CCCCc1ccc(C2(O)COC2)cc1	CN(C)CCCCc1ccc(C2(O)COC2)cc1	mol20795	CN(C)CCCCc1ccc(C2(O)COC2)cc1