pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.34	Datawarrior	1	0	CC(C)C[NH2+][C@H](c1ccccc1)[C@H](O)c1ccccc1	CC(C)CN[C@H](c1ccccc1)[C@H](O)c1ccccc1	mol14756	CC(C)CN[C@H](c1ccccc1)[C@H](O)c1ccccc1