pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.3	Novartis	1	0	CC(C)Nc1nc(Nc2ccc(C(N)=O)cc2)c2sccc2[nH+]1,CC(C)Nc1nc([NH2+]c2ccc(C(N)=O)cc2)c2sccc2n1,CC(C)[NH2+]c1nc(Nc2ccc(C(N)=O)cc2)c2sccc2n1,CC(C)Nc1nc2ccsc2c(Nc2ccc(C(N)=O)cc2)[nH+]1	CC(C)Nc1nc(Nc2ccc(C(N)=O)cc2)c2sccc2n1	mol2794	CC(C)Nc1nc(Nc2ccc(C(N)=O)cc2)c2sccc2n1