pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.86	Baltruschat ChEMBL	1	0	NCCCCCCNc1c2ccccc2[nH+]c2ccccc12,NCCCCCC[NH2+]c1c2ccccc2nc2ccccc12,[NH3+]CCCCCCNc1c2ccccc2nc2ccccc12	NCCCCCCNc1c2ccccc2nc2ccccc12	mol20429	NCCCCCCNc1c2ccccc2nc2ccccc12