pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.73000001907349	QSARToolbox	3	2	C[NH+](C)CCNC1=[NH+]C(C)(C)[NH+]([O])C1(C)C	C[NH+](C)CCNC1=NC(C)(C)[NH+]([O])C1(C)C,CN(C)CCNC1=[NH+]C(C)(C)[NH+]([O])C1(C)C,C[NH+](C)CCNC1=[NH+]C(C)(C)N([O])C1(C)C	mol36247	CN(C)CCNC1=NC(C)(C)N([O])C1(C)C
