smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[C@H]1CCCCN1C(=O)c1cnc2ccc(S(=O)(=O)Nc3cccc(OC)c3)cc2c1O	ZINC000008583484	562940230	/nfs/dbraw/zinc/94/02/30/562940230.db2.gz	VXBCHAFKZUTFHE-KRWDZBQOSA-N	-2	2	469.563	3.742	50	0		JHAALL
CC[C@H]1CCCCN1C(=O)c1c[nH]c2ccc(S(=O)(=O)Nc3cccc(OC)c3)cc2c1=O	ZINC000008583484	562940232	/nfs/dbraw/zinc/94/02/32/562940232.db2.gz	VXBCHAFKZUTFHE-KRWDZBQOSA-N	-2	2	469.563	3.742	50	0		JHAALL
COc1cccc(NS(=O)(=O)c2ccc3ncc(C(=O)N(C)C4CCCCC4)c(O)c3c2)c1	ZINC000008583487	562940274	/nfs/dbraw/zinc/94/02/74/562940274.db2.gz	RDTLWUFIPZWJPW-UHFFFAOYSA-N	-2	2	469.563	3.742	50	0		JHAALL
COc1cccc(NS(=O)(=O)c2ccc3[nH]cc(C(=O)N(C)C4CCCCC4)c(=O)c3c2)c1	ZINC000008583487	562940276	/nfs/dbraw/zinc/94/02/76/562940276.db2.gz	RDTLWUFIPZWJPW-UHFFFAOYSA-N	-2	2	469.563	3.742	50	0		JHAALL
O=C([O-])[C@H](Cc1ccc(O[P@](=O)([O-])O)cc1)NC(=O)OCC1c2ccccc2-c2ccccc21	ZINC000002560017	554235993	/nfs/dbraw/zinc/23/59/93/554235993.db2.gz	AMXUJIHSMANWDW-QFIPXVFZSA-N	-2	2	483.413	3.693	50	0		JHAALL
O=C([O-])[C@H](Cc1ccc(O[P@@](=O)([O-])O)cc1)NC(=O)OCC1c2ccccc2-c2ccccc21	ZINC000002560017	554235996	/nfs/dbraw/zinc/23/59/96/554235996.db2.gz	AMXUJIHSMANWDW-QFIPXVFZSA-N	-2	2	483.413	3.693	50	0		JHAALL
Cc1ccc(S(=O)(=O)[N-]c2nc3ccccc3nc2Nc2ccc(O)c(C(=O)[O-])c2)cc1	ZINC000002269661	554126135	/nfs/dbraw/zinc/12/61/35/554126135.db2.gz	BZOPIXHIHBEHNK-UHFFFAOYSA-N	-2	2	450.476	3.886	50	0		JHAALL