smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1[nH]c(=S)[n-]c(=O)c1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000018203345	201369054	/nfs/dbraw/zinc/36/90/54/201369054.db2.gz	HCQSBSMYZOJTJZ-UHFFFAOYSA-N	-2	3	343.346	0.350	10	5		ECBEHL
C[C@@H](O)[C@@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000021011792	436113966	/nfs/dbraw/zinc/11/39/66/436113966.db2.gz	ZJSYZGCLHVVQPL-MLUIRONXSA-N	-2	3	338.725	0.361	10	5		ECBEHL
C[C@@H](O)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000021010121	212198962	/nfs/dbraw/zinc/19/89/62/212198962.db2.gz	ILVCJLFYAKXEGA-MLUIRONXSA-N	-2	3	338.725	0.361	10	5		ECBEHL
O=C([O-])CCn1c(=O)c2ccc3c(=O)[n-]c(=O)c4ccc(c1=O)c2c34	ZINC000026438370	304064745	/nfs/dbraw/zinc/06/47/45/304064745.db2.gz	BQYAKJFCMVYOHC-UHFFFAOYSA-N	-2	3	338.275	0.067	10	5		ECBEHL