pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.47	OCHEM	1	0	CCOC(=O)N1CCC2(CC1)N=C(N)c1sccc1[NH2+]2,CCOC(=O)N1CCC2(CC1)Nc1ccsc1C(N)=[NH+]2	CCOC(=O)N1CCC2(CC1)N=C(N)c1sccc1N2	mol2280	CCOC(=O)N1CCC2(CC1)N=C(N)c1sccc1N2