pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.02	IUPAC digitized pKa	1	0	CC[NH+](CC)CCN,CCN(CC)CC[NH3+]	CCN(CC)CCN	mol3095	CCN(CC)CCN
9.93	IUPAC digitized pKa	1	0	CC[NH+](CC)CCN,CCN(CC)CC[NH3+]	CCN(CC)CCN	mol3095	CCN(CC)CCN
10.46	OCHEM	1	0	CC[NH+](CC)CCN,CCN(CC)CC[NH3+]	CCN(CC)CCN	mol3095	CCN(CC)CCN
9.9300003	OCHEM	1	0	CC[NH+](CC)CCN,CCN(CC)CC[NH3+]	CCN(CC)CCN	mol3095	CCN(CC)CCN
9.975	OCHEM	1	0	CC[NH+](CC)CCN,CCN(CC)CC[NH3+]	CCN(CC)CCN	mol3095	CCN(CC)CCN
7.07	IUPAC digitized pKa	2	1	CC[NH+](CC)CC[NH3+]	CC[NH+](CC)CCN,CCN(CC)CC[NH3+]	mol3095	CCN(CC)CCN
6.513	IUPAC digitized pKa	2	1	CC[NH+](CC)CC[NH3+]	CC[NH+](CC)CCN,CCN(CC)CC[NH3+]	mol3095	CCN(CC)CCN
6.76	Datawarrior	2	1	CC[NH+](CC)CC[NH3+]	CC[NH+](CC)CCN,CCN(CC)CC[NH3+]	mol3095	CCN(CC)CCN
7.4	OCHEM	2	1	CC[NH+](CC)CC[NH3+]	CC[NH+](CC)CCN,CCN(CC)CC[NH3+]	mol3095	CCN(CC)CCN