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-])c1cc(NS(=O)(=O)c2cccs2)ccc1O	ZINC000000207340	355896667	/nfs/dbraw/zinc/89/66/67/355896667.db2.gz	AVIOICZIPMVMFG-UHFFFAOYSA-N	-1	2	299.329	1.953	50	10		CDCALM
[NH3+][C@H](c1cc(Cl)cc([N+](=O)[O-])c1[O-])[P@@](=O)([O-])O	ZINC000012541295	368640338	/nfs/dbraw/zinc/64/03/38/368640338.db2.gz	FJULKUPVKOWXQP-ZETCQYMHSA-N	-1	2	282.576	1.089	50	10		CDCALM
[NH3+][C@H](c1cc(Cl)cc([N+](=O)[O-])c1[O-])[P@](=O)([O-])O	ZINC000012541295	368640341	/nfs/dbraw/zinc/64/03/41/368640341.db2.gz	FJULKUPVKOWXQP-ZETCQYMHSA-N	-1	2	282.576	1.089	50	10		CDCALM
[NH3+][C@@H](c1cc(Cl)cc([N+](=O)[O-])c1[O-])[P@@](=O)([O-])O	ZINC000012541293	368639086	/nfs/dbraw/zinc/63/90/86/368639086.db2.gz	FJULKUPVKOWXQP-SSDOTTSWSA-N	-1	2	282.576	1.089	50	10		CDCALM
[NH3+][C@@H](c1cc(Cl)cc([N+](=O)[O-])c1[O-])[P@](=O)([O-])O	ZINC000012541293	368639091	/nfs/dbraw/zinc/63/90/91/368639091.db2.gz	FJULKUPVKOWXQP-SSDOTTSWSA-N	-1	2	282.576	1.089	50	10		CDCALM