smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cn1nnc(NC(=O)c2ccc([N+](=O)[O-])o2)n1	ZINC000002394714	398308736	/nfs/dbraw/zinc/30/87/36/398308736.db2.gz	PXTLENVWEGXFFZ-UHFFFAOYSA-N	0	1	238.163	-0.036	40	5		BBBBMN
C[C@@H](O)CNc1nc(N)[nH]c(=O)c1[N+](=O)[O-]	ZINC000017040221	363002425	/nfs/dbraw/zinc/00/24/25/363002425.db2.gz	KBJYQEBVHGEJRW-GSVOUGTGSA-N	0	1	229.196	-0.947	40	5		BBBBMN
C[C@H](O)CNc1nc(N)[nH]c(=O)c1[N+](=O)[O-]	ZINC000017040223	363002219	/nfs/dbraw/zinc/00/22/19/363002219.db2.gz	KBJYQEBVHGEJRW-VKHMYHEASA-N	0	1	229.196	-0.947	40	5		BBBBMN
Cn1nc([N+](=O)[O-])cc1CNCCO	ZINC000408716973	384354005	/nfs/dbraw/zinc/35/40/05/384354005.db2.gz	UFKYNIRGHJSTFD-UHFFFAOYSA-N	0	1	200.198	-0.590	40	5		BBBBMN
CCCCNC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000409418951	385955834	/nfs/dbraw/zinc/95/58/34/385955834.db2.gz	ITVFBLPILGDHJA-LURJTMIESA-N	0	1	212.209	-0.012	40	5		BBBBMN
CCCCNC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000409418953	384490836	/nfs/dbraw/zinc/49/08/36/384490836.db2.gz	ITVFBLPILGDHJA-ZCFIWIBFSA-N	0	1	212.209	-0.012	40	5		BBBBMN