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-])c1ccccc1[N-]S(=O)(=O)c1ccc(NNC(=S)NC[C@H]2CCCO2)c([N+](=O)[O-])c1	ZINC000009631562	194829375	/nfs/dbraw/zinc/82/93/75/194829375.db2.gz	DQRVVVNHKFTPEU-GFCCVEGCSA-N	-2	1	495.539	2.064	50	5		JEBAML
O=C([O-])c1ccccc1[N-]S(=O)(=O)c1ccc(NNC(=S)NC2CC2)c([N+](=O)[O-])c1	ZINC000009631549	555460514	/nfs/dbraw/zinc/46/05/14/555460514.db2.gz	LXUUZEMKHMBUAS-UHFFFAOYSA-N	-2	1	451.486	2.047	50	5		JEBAML
O=C([O-])c1ccccc1[N-]S(=O)(=O)c1ccc(NNC(=S)NC[C@@H]2CCCO2)c([N+](=O)[O-])c1	ZINC000009631561	555460504	/nfs/dbraw/zinc/46/05/04/555460504.db2.gz	DQRVVVNHKFTPEU-LBPRGKRZSA-N	-2	1	495.539	2.064	50	5		JEBAML
COc1cc([N-]S(=O)(=O)c2ccc([N-]c3ncc([N+](=O)[O-])cc3[N+](=O)[O-])cc2)nc(OC)n1	ZINC000004417476	522756674	/nfs/dbraw/zinc/75/66/74/522756674.db2.gz	QIGXGHFLGZVQAO-UHFFFAOYSA-N	-2	1	477.415	2.250	50	5		JEBAML