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-])c1nc(-c2cscc2NC(=O)[N-]S(=O)(=O)c2ccccc2Cl)[nH]c(=O)c1O	ZINC000003582325	562927266	/nfs/dbraw/zinc/92/72/66/562927266.db2.gz	YTELTTQMHNMWPW-UHFFFAOYSA-N	-2	2	470.872	2.066	1	0		JEAFLL
O=C([O-])c1nc(-c2cscc2NC(=O)[N-]S(=O)(=O)c2ccc(Cl)cc2)[nH]c(=O)c1O	ZINC000003582091	562927199	/nfs/dbraw/zinc/92/71/99/562927199.db2.gz	OUOJKLCLNSIIGC-UHFFFAOYSA-N	-2	2	470.872	2.066	1	0		JEAFLL
O=P([O-])(O)C(CCCCCCc1ccccc1)(O[C@@H]1CC[C@@H](O)C[C@@H]1O)[P@@](=O)([O-])O	ZINC000029230487	563099012	/nfs/dbraw/zinc/09/90/12/563099012.db2.gz	USKRCTVHUUUFMN-FGTMMUONSA-N	-2	2	466.404	2.480	1	0		JEAFLL
O=P([O-])(O)C(CCCCCCc1ccccc1)(O[C@@H]1CC[C@@H](O)C[C@@H]1O)[P@](=O)([O-])O	ZINC000029230487	563099013	/nfs/dbraw/zinc/09/90/13/563099013.db2.gz	USKRCTVHUUUFMN-FGTMMUONSA-N	-2	2	466.404	2.480	1	0		JEAFLL
O=C([O-])c1cccc(O)c1C(=O)c1c(O)cc(C(=O)O[C@@H]2C[NH2+]C[C@@H]2Cc2ccc(O)cc2)cc1O	ZINC000029464507	563104017	/nfs/dbraw/zinc/10/40/17/563104017.db2.gz	MKPSMRQVGPTYRL-YCRPNKLZSA-N	-3	2	493.468	2.426	1	0		JEAFLL
O=C([O-])c1cccc(O)c1C(=O)c1c(O)cc(C(=O)O[C@H]2C[NH2+]C[C@H]2Cc2ccc(O)cc2)cc1O	ZINC000029464516	563104066	/nfs/dbraw/zinc/10/40/66/563104066.db2.gz	MKPSMRQVGPTYRL-VFNWGFHPSA-N	-3	2	493.468	2.426	1	0		JEAFLL
CNc1nc(Cl)nc2c1ncn2CC(CCCP(=O)([O-])O)CCC[P@@](=O)([O-])O	ZINC000027638913	563047905	/nfs/dbraw/zinc/04/79/05/563047905.db2.gz	IPUPQMAWWVYUDG-UHFFFAOYSA-N	-2	2	455.776	2.053	1	0		JEAFLL
CNc1nc(Cl)nc2c1ncn2CC(CCCP(=O)([O-])O)CCC[P@](=O)([O-])O	ZINC000027638913	563047906	/nfs/dbraw/zinc/04/79/06/563047906.db2.gz	IPUPQMAWWVYUDG-UHFFFAOYSA-N	-2	2	455.776	2.053	1	0		JEAFLL