pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.2	Baltruschat ChEMBL	1	0	CCN(CC)CCCNc1c2ccc(Cl)cc2[n+](C)c2c1[nH]c1ccccc12	CCN(CC)CCCNc1c2ccc(Cl)cc2[n+](C)c2c1[n-]c1ccccc12	mol20276	CCN(CC)CCCNc1c2ccc(Cl)cc2[n+](C)c2c1[nH]c1ccccc12
