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-])[C@@]1(NC(=O)Nc2cccc(S(=O)(=O)Nc3nccs3)c2)CCSC1	ZINC000565400736	939348402	/nfs/dbraw/zinc/34/84/02/939348402.db2.gz	NUQXKRQAJWJXKF-OAHLLOKOSA-N	-1	2	428.517	2.026	20	0		IEADLM
O=C([O-])[C@]1(NC(=O)Nc2cccc(S(=O)(=O)Nc3nccs3)c2)CCSC1	ZINC000565400731	939348229	/nfs/dbraw/zinc/34/82/29/939348229.db2.gz	NUQXKRQAJWJXKF-HNNXBMFYSA-N	-1	2	428.517	2.026	20	0		IEADLM
O=C([O-])[C@H](NC(=O)Nc1cccc(S(=O)(=O)Nc2nccs2)c1)c1ccccn1	ZINC000797756502	939210804	/nfs/dbraw/zinc/21/08/04/939210804.db2.gz	HSNNDQSRTGTSCV-CQSZACIVSA-N	-1	2	433.471	2.286	20	0		IEADLM
NC(=O)C1CCN(C(=O)c2ccccc2[N-]S(=O)(=O)c2cccc(Cl)c2O)CC1	ZINC000550106097	569966335	/nfs/dbraw/zinc/96/63/35/569966335.db2.gz	AIOXJFCAVYSSCH-UHFFFAOYSA-N	-1	2	437.905	2.184	20	0		IEADLM
O=C([O-])[C@@H](NC(=O)Nc1cccc(S(=O)(=O)Nc2nccs2)c1)c1cccnc1	ZINC000797749041	939209461	/nfs/dbraw/zinc/20/94/61/939209461.db2.gz	UQFASUHPVOIKNR-AWEZNQCLSA-N	-1	2	433.471	2.286	20	0		IEADLM
O=C([O-])[C@@H](NC(=O)Nc1cccc(S(=O)(=O)Nc2nccs2)c1)c1ccccn1	ZINC000797756501	939210913	/nfs/dbraw/zinc/21/09/13/939210913.db2.gz	HSNNDQSRTGTSCV-AWEZNQCLSA-N	-1	2	433.471	2.286	20	0		IEADLM
O=C([O-])C1(NC(=O)Nc2cccc(S(=O)(=O)Nc3nccs3)c2)CCSCC1	ZINC000571008568	939387910	/nfs/dbraw/zinc/38/79/10/939387910.db2.gz	SLFWWILLJMUFRZ-UHFFFAOYSA-N	-1	2	442.544	2.416	20	0		IEADLM
O=C([O-])[C@H](NC(=O)Nc1cccc(S(=O)(=O)Nc2nccs2)c1)c1cccnc1	ZINC000797749042	939209429	/nfs/dbraw/zinc/20/94/29/939209429.db2.gz	UQFASUHPVOIKNR-CQSZACIVSA-N	-1	2	433.471	2.286	20	0		IEADLM