pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.42	Baltruschat ChEMBL	1	0	C[C@]12C[C@@H]3C[C@](C)(C1)C[C@@]([NH3+])(C3)C2	C[C@]12C[C@@H]3C[C@](C)(C1)C[C@@](N)(C3)C2	mol16586	CC12CC3CC(C)(C1)CC(N)(C3)C2