pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.2	Baltruschat ChEMBL	2	1	C[NH2+]CCN(C)c1cc(-c2ccc3ccccc3c2)[nH+]c2ccccc12,C[NH2+]CC[NH+](C)c1cc(-c2ccc3ccccc3c2)nc2ccccc12	C[NH2+]CCN(C)c1cc(-c2ccc3ccccc3c2)nc2ccccc12,CNCCN(C)c1cc(-c2ccc3ccccc3c2)[nH+]c2ccccc12,CNCC[NH+](C)c1cc(-c2ccc3ccccc3c2)nc2ccccc12	mol19260	CNCCN(C)c1cc(-c2ccc3ccccc3c2)nc2ccccc12