pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.43	Baltruschat ChEMBL	2	1	c1ccc2c(c1)CCc1cc3ccn4cc[nH+]c4c3[nH+]c1-2	c1ccc2c(c1)CCc1cc3ccn4cc[nH+]c4c3nc1-2,c1ccc2c(c1)CCc1cc3ccn4ccnc4c3[nH+]c1-2	mol17986	c1ccc2c(c1)CCc1cc3ccn4ccnc4c3nc1-2