pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.01000022888184	QSARToolbox	1	0	COc1ccccc1C(=O)NCC[NH+](CCNC(=O)c1ccccc1OC)CCNC(=O)c1ccccc1OC	COc1ccccc1C(=O)NCCN(CCNC(=O)c1ccccc1OC)CCNC(=O)c1ccccc1OC	mol34858	COc1ccccc1C(=O)NCCN(CCNC(=O)c1ccccc1OC)CCNC(=O)c1ccccc1OC