smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc(-c2cc([N+](=O)[O-])ccc2O)cc1	ZINC000034108740	345817026	/nfs/dbraw/zinc/81/70/26/345817026.db2.gz	KGJXEJPTFXHNRT-UHFFFAOYSA-N	0	1	229.235	3.276	10	5		BGBEMN
Cc1cc(O)cc(-c2ccccc2)c1[N+](=O)[O-]	ZINC000039111123	388407222	/nfs/dbraw/zinc/40/72/22/388407222.db2.gz	SIIZYHMFKZAAMQ-UHFFFAOYSA-N	0	1	229.235	3.276	10	5		BGBEMN
CC/C(=C\c1ccc(O)c(Cl)c1)[N+](=O)[O-]	ZINC000043477206	343087766	/nfs/dbraw/zinc/08/77/66/343087766.db2.gz	GSGQPFMRXUUOLM-VMPITWQZSA-N	0	1	227.647	3.073	10	5		BGBEMN
O=[N+]([O-])c1ccc2c(c1)[nH]nc2-c1ccccc1	ZINC000059638295	347229463	/nfs/dbraw/zinc/22/94/63/347229463.db2.gz	MXIWPBDHLNPTQI-UHFFFAOYSA-N	0	1	239.234	3.138	10	5		BGBEMN
Cc1cc([N+](=O)[O-])c(-c2ccccc2)cc1O	ZINC000095922427	178269690	/nfs/dbraw/zinc/26/96/90/178269690.db2.gz	WKSBMNORPKPVAE-UHFFFAOYSA-N	0	1	229.235	3.276	10	5		BGBEMN
O=[N+]([O-])C(F)c1ccc2ccccc2c1	ZINC000584622278	358290119	/nfs/dbraw/zinc/29/01/19/358290119.db2.gz	CXVJIYSWNJQGBT-LLVKDONJSA-N	0	1	205.188	3.085	10	5		BGBEMN
O=[N+]([O-])C(F)c1ccc2ccccc2c1	ZINC000584622279	358290177	/nfs/dbraw/zinc/29/01/77/358290177.db2.gz	CXVJIYSWNJQGBT-NSHDSACASA-N	0	1	205.188	3.085	10	5		BGBEMN
CCN(c1ccncc1)c1ccc([N+](=O)[O-])cc1	ZINC000584636622	358320978	/nfs/dbraw/zinc/32/09/78/358320978.db2.gz	GPDILNLSZZXBDB-UHFFFAOYSA-N	0	1	243.266	3.148	10	5		BGBEMN