smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(C)c1ccc2c(c1)[nH+]c1cc(N(C)C)ccc1c2SCC[N@@H+](C)Cc1ccccc1	ZINC000071767291	556887559	/nfs/dbraw/zinc/88/75/59/556887559.db2.gz	NHXIJTZAOBAALE-UHFFFAOYSA-N	2	1	444.648	5.744	50	5		IKBAMP
O=[N+]([O-])c1ccccc1C[N@@H+]1C[C@H](C[NH+]2CCCCC2)[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000169679901	556689440	/nfs/dbraw/zinc/68/94/40/556689440.db2.gz	ZJGJKBMKZICZAM-RBBKRZOGSA-N	2	1	447.501	5.315	50	5		IKBAMP
O=[N+]([O-])c1ccccc1C[N@H+]1C[C@H](C[NH+]2CCCCC2)[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000169679901	556689443	/nfs/dbraw/zinc/68/94/43/556689443.db2.gz	ZJGJKBMKZICZAM-RBBKRZOGSA-N	2	1	447.501	5.315	50	5		IKBAMP
O=[N+]([O-])c1ccccc1C[N@@H+]1C[C@@H](C[NH+]2CCCCC2)[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000034723304	568734133	/nfs/dbraw/zinc/73/41/33/568734133.db2.gz	ZJGJKBMKZICZAM-IRLDBZIGSA-N	2	1	447.501	5.315	50	5		IKBAMP
O=[N+]([O-])c1ccccc1C[N@H+]1C[C@@H](C[NH+]2CCCCC2)[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000034723304	568734134	/nfs/dbraw/zinc/73/41/34/568734134.db2.gz	ZJGJKBMKZICZAM-IRLDBZIGSA-N	2	1	447.501	5.315	50	5		IKBAMP
O=[N+]([O-])c1ccccc1C[N@H+]1C[C@@H](c2cccc(C(F)(F)F)c2)[C@@H](C[NH+]2CCCCC2)C1	ZINC000034723302	568734152	/nfs/dbraw/zinc/73/41/52/568734152.db2.gz	ZJGJKBMKZICZAM-UNMCSNQZSA-N	2	1	447.501	5.315	50	5		IKBAMP
O=[N+]([O-])c1ccccc1C[N@@H+]1C[C@@H](c2cccc(C(F)(F)F)c2)[C@@H](C[NH+]2CCCCC2)C1	ZINC000034723302	568734153	/nfs/dbraw/zinc/73/41/53/568734153.db2.gz	ZJGJKBMKZICZAM-UNMCSNQZSA-N	2	1	447.501	5.315	50	5		IKBAMP
O=[N+]([O-])c1ccccc1C[N@@H+]1C[C@@H](C[NH+]2CCCCC2)[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000105047219	557473455	/nfs/dbraw/zinc/47/34/55/557473455.db2.gz	ZJGJKBMKZICZAM-IFMALSPDSA-N	2	1	447.501	5.315	50	5		IKBAMP
O=[N+]([O-])c1ccccc1C[N@H+]1C[C@@H](C[NH+]2CCCCC2)[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000105047219	557473458	/nfs/dbraw/zinc/47/34/58/557473458.db2.gz	ZJGJKBMKZICZAM-IFMALSPDSA-N	2	1	447.501	5.315	50	5		IKBAMP