pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
12.7	Baltruschat ChEMBL	1	0	C(CCCCCCNC1=[NH+]CCCC1)CCCCCNC1=NCCCC1	C(CCCCCCNC1=NCCCC1)CCCCCNC1=NCCCC1	mol16772	C(CCCCCCNC1=NCCCC1)CCCCCNC1=NCCCC1