pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.35	Baltruschat ChEMBL	1	0	CC[NH+](CC)CCS/C(=N\O)c1nnc(-c2ccccc2)o1	CCN(CC)CCS/C(=N\O)c1nnc(-c2ccccc2)o1,CC[NH+](CC)CCS/C(=N\[O-])c1nnc(-c2ccccc2)o1	mol20491	CCN(CC)CCS/C(=N\O)c1nnc(-c2ccccc2)o1