pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.27	Baltruschat ChEMBL	1	0	Cc1cccc(Oc2cc([NH2+]Cc3ccccc3)nc(N)n2)c1,Cc1cccc(Oc2cc(NCc3ccccc3)nc([NH3+])n2)c1,Cc1cccc(Oc2cc(NCc3ccccc3)nc(N)[nH+]2)c1,Cc1cccc(Oc2cc(NCc3ccccc3)[nH+]c(N)n2)c1	Cc1cccc(Oc2cc(NCc3ccccc3)nc(N)n2)c1	mol19105	Cc1cccc(Oc2cc(NCc3ccccc3)nc(N)n2)c1