pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.9	Baltruschat ChEMBL	2	1	C[NH2+]CCc1ccc2c(c1)[NH+]=C(N)[C@]1(F)CCC[C@H]21	CNCCc1ccc2c(c1)[NH+]=C(N)[C@]1(F)CCC[C@H]21,C[NH2+]CCc1ccc2c(c1)N=C(N)[C@]1(F)CCC[C@H]21	mol20441	CNCCc1ccc2c(c1)N=C(N)[C@]1(F)CCC[C@H]21