pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.91	Baltruschat ChEMBL	1	0	CC[C@@H](C(=O)Nc1c(C)cccc1C)[NH+](CC)CC	CC[C@@H](C(=O)Nc1c(C)cccc1C)N(CC)CC	mol16750	CCC(C(=O)Nc1c(C)cccc1C)N(CC)CC