pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.7	Baltruschat ChEMBL	1	0	c1ccc(CN2CC[NH+](Cc3nc(-c4ccccc4)no3)CC2)cc1,c1ccc(C[NH+]2CCN(Cc3nc(-c4ccccc4)no3)CC2)cc1	c1ccc(CN2CCN(Cc3nc(-c4ccccc4)no3)CC2)cc1	mol21413	c1ccc(CN2CCN(Cc3nc(-c4ccccc4)no3)CC2)cc1