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-])c1ccc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1O	ZINC000003884700	210083690	/nfs/dbraw/zinc/08/36/90/210083690.db2.gz	WSPXQWPMWCYBPS-UHFFFAOYSA-N	-2	1	338.297	1.799	50	5		EDBAML
O=C([O-])c1cc2n[n-]c(I)c2c([N+](=O)[O-])c1	ZINC000014983798	304229841	/nfs/dbraw/zinc/22/98/41/304229841.db2.gz	WKDVSUTUYUODKD-UHFFFAOYSA-N	-2	1	333.041	1.774	50	5		EDBAML
COc1cc(C=Cc2nc([O-])c([N+](=O)[O-])c(=O)[n-]2)cc(Cl)c1O	ZINC000009010348	211032070	/nfs/dbraw/zinc/03/20/70/211032070.db2.gz	ASKVJLICKAETDZ-NSCUHMNNSA-N	-2	1	339.691	1.922	50	5		EDBAML
NC(=O)c1ccc([N-]S(=O)(=O)c2ccc([O-])c([N+](=O)[O-])c2)cc1	ZINC000033048514	441586227	/nfs/dbraw/zinc/58/62/27/441586227.db2.gz	AYPMBUKYTKWVDX-UHFFFAOYSA-N	-2	1	337.313	1.200	50	5		EDBAML