pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.74	AttenGpKa training set	0	-1	CC(C)(C)c1n[nH]c(C(C)(C)C)c1N=O	CC(C)(C)c1n[n-]c(C(C)(C)C)c1N=O	mol25522	CC(C)(C)c1n[nH]c(C(C)(C)C)c1N=O
