smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])N[N-]C(=O)c1csc(-c2ccc(F)c(F)c2)n1	ZINC000834251947	605774133	/nfs/dbraw/zinc/77/41/33/605774133.db2.gz	WNAQOIWDKHMPAH-UHFFFAOYSA-N	-2	0	299.258	2.001	20	50		CEGDRL
O=C([O-])NNC(=O)c1cc(Cl)c2ccccc2c1[O-]	ZINC000832748616	603472055	/nfs/dbraw/zinc/47/20/55/603472055.db2.gz	NMODDSOFDYGVRR-UHFFFAOYSA-N	-2	0	280.667	2.111	20	50		CEGDRL
O=C([O-])N[N-]C(=O)c1cnc(-c2ccc(F)c(F)c2)s1	ZINC000834251387	605774064	/nfs/dbraw/zinc/77/40/64/605774064.db2.gz	OFIVVDPVWHISAP-UHFFFAOYSA-N	-2	0	299.258	2.001	20	50		CEGDRL
CC(=NNC(=O)[O-])c1cc(Br)c(F)cc1[O-]	ZINC000833385476	604870528	/nfs/dbraw/zinc/87/05/28/604870528.db2.gz	ZXIJNILYCBVJQG-UHFFFAOYSA-N	-2	0	291.076	2.285	20	50		CEGDRL
O=C([O-])N[N-]C(=O)c1csc(-c2ccc(Cl)cc2)n1	ZINC000832748730	605188897	/nfs/dbraw/zinc/18/88/97/605188897.db2.gz	RWNHUPJJOINQQI-UHFFFAOYSA-N	-2	0	297.723	2.376	20	50		CEGDRL
Cc1ccc(-c2nc(C(=O)[N-]NC(=O)[O-])cs2)cc1	ZINC000830154984	605186287	/nfs/dbraw/zinc/18/62/87/605186287.db2.gz	LMIYTHYSEYVZJL-UHFFFAOYSA-N	-2	0	277.305	2.031	20	50		CEGDRL
CCc1ccc(-c2ccc(C(=O)[N-]NC(=O)[O-])o2)cc1	ZINC000827569352	603218186	/nfs/dbraw/zinc/21/81/86/603218186.db2.gz	MNBNQGMKCPECHU-UHFFFAOYSA-N	-2	0	274.276	2.421	20	50		CEGDRL
CC(=NNC(=O)[O-])c1cc(Br)cc(F)c1[O-]	ZINC000833384368	605323712	/nfs/dbraw/zinc/32/37/12/605323712.db2.gz	HUZHKEJNKXNYMD-UHFFFAOYSA-N	-2	0	291.076	2.285	20	50		CEGDRL