pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.85	Baltruschat ChEMBL	0	-1	CC[NH+](CC)CC/N=C(\N[O-])c1nc(-c2ccccc2)no1,CCN(CC)CC/N=C(\NO)c1nc(-c2ccccc2)no1	CCN(CC)CC/N=C(\N[O-])c1nc(-c2ccccc2)no1	mol20094	CCN(CC)CC/N=C(\NO)c1nc(-c2ccccc2)no1