pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.69	IUPAC digitized pKa	1	0	C[C@@H](N)[C@@H](C)[NH3+]	C[C@@H](N)[C@@H](C)N	mol3217	CC(N)C(C)N
10.0	IUPAC digitized pKa	1	0	C[C@@H](N)[C@@H](C)[NH3+]	C[C@@H](N)[C@@H](C)N	mol3217	CC(N)C(C)N
10.63	IUPAC digitized pKa	1	0	C[C@@H](N)[C@@H](C)[NH3+]	C[C@@H](N)[C@@H](C)N	mol3217	CC(N)C(C)N
9.97	IUPAC digitized pKa	1	0	C[C@@H](N)[C@@H](C)[NH3+]	C[C@@H](N)[C@@H](C)N	mol3217	CC(N)C(C)N
7.6	IUPAC digitized pKa	2	1	C[C@@H]([NH3+])[C@@H](C)[NH3+]	C[C@@H](N)[C@@H](C)[NH3+]	mol3217	CC(N)C(C)N
6.91	IUPAC digitized pKa	2	1	C[C@@H]([NH3+])[C@@H](C)[NH3+]	C[C@@H](N)[C@@H](C)[NH3+]	mol3217	CC(N)C(C)N
7.55	IUPAC digitized pKa	2	1	C[C@@H]([NH3+])[C@@H](C)[NH3+]	C[C@@H](N)[C@@H](C)[NH3+]	mol3217	CC(N)C(C)N
6.92	IUPAC digitized pKa	2	1	C[C@@H]([NH3+])[C@@H](C)[NH3+]	C[C@@H](N)[C@@H](C)[NH3+]	mol3217	CC(N)C(C)N
9.8800001	OCHEM	2	1	C[C@@H]([NH3+])[C@@H](C)[NH3+]	C[C@@H](N)[C@@H](C)[NH3+]	mol3217	CC(N)C(C)N
10.0	OCHEM	2	1	C[C@@H]([NH3+])[C@@H](C)[NH3+]	C[C@@H](N)[C@@H](C)[NH3+]	mol3217	CC(N)C(C)N