smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+](C)C[C@H]1CN(CC(=O)NNC(=O)c2ccc(-c3nn[nH]n3)cc2)CCO1	ZINC000821584538	945725284	/nfs/dbraw/zinc/72/52/84/945725284.db2.gz	IKNVMRSWCYAETH-AWEZNQCLSA-N	1	0	388.432	-1.110	20	50		GAGDRO
C[NH+](C)C[C@@H]1CN(CC(=O)NNC(=O)c2ccc(-c3nn[nH]n3)cc2)CCO1	ZINC000821584539	945725416	/nfs/dbraw/zinc/72/54/16/945725416.db2.gz	IKNVMRSWCYAETH-CQSZACIVSA-N	1	0	388.432	-1.110	20	50		GAGDRO
C[NH+](C)C[C@H]1CN(CC(=O)NNC(=O)c2cccc(-c3nn[nH]n3)c2)CCO1	ZINC000821584877	945725474	/nfs/dbraw/zinc/72/54/74/945725474.db2.gz	VVFQODDXPFKOIF-AWEZNQCLSA-N	1	0	388.432	-1.110	20	50		GAGDRO
C[NH+](C)C[C@@H]1CN(CC(=O)NNC(=O)c2cccc(-c3nn[nH]n3)c2)CCO1	ZINC000821584878	945724630	/nfs/dbraw/zinc/72/46/30/945724630.db2.gz	VVFQODDXPFKOIF-CQSZACIVSA-N	1	0	388.432	-1.110	20	50		GAGDRO
O=C(C[NH2+]C1(CO)CCOCC1)NNC(=O)c1cccc(-c2nn[nH]n2)c1	ZINC000826412478	607923011	/nfs/dbraw/zinc/92/30/11/607923011.db2.gz	PICLANPTNDDEOP-UHFFFAOYSA-N	1	0	375.389	-1.241	20	50		GAGDRO