smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cc(CNC(=O)c2ccccc2[N-]S(C)(=O)=O)ccc1OC(C)C	ZINC000218395515	570333417	/nfs/dbraw/zinc/33/34/17/570333417.db2.gz	ZBXBHKFVLAKFJV-UHFFFAOYSA-N	-1	0	392.477	2.784	40	70		GFIBRM
CS(=O)(=O)[N-]c1ccccc1C(=O)NCCCN1CCCc2ccccc21	ZINC000218400860	136203733	/nfs/dbraw/zinc/20/37/33/136203733.db2.gz	HKPYBSBUDATHIK-UHFFFAOYSA-N	-1	0	387.505	2.631	40	70		GFIBRM
CCOc1ccc(CNC(=O)c2ccccc2[N-]S(C)(=O)=O)cc1OCC	ZINC000218395404	570333221	/nfs/dbraw/zinc/33/32/21/570333221.db2.gz	BMNIGGIKZYVDCP-UHFFFAOYSA-N	-1	0	392.477	2.786	40	70		GFIBRM
CC[C@@H](NC(=O)c1ccccc1[N-]S(C)(=O)=O)c1ccc(OC)c(OC)c1	ZINC000218398472	570333269	/nfs/dbraw/zinc/33/32/69/570333269.db2.gz	MTFJYYRZONGPSK-OAHLLOKOSA-N	-1	0	392.477	2.956	40	70		GFIBRM
CC[C@H](NC(=O)c1ccccc1[N-]S(C)(=O)=O)c1ccc(OC)c(OC)c1	ZINC000218398560	570333226	/nfs/dbraw/zinc/33/32/26/570333226.db2.gz	MTFJYYRZONGPSK-HNNXBMFYSA-N	-1	0	392.477	2.956	40	70		GFIBRM
CCOc1ccc(CCCNC(=O)c2ccccc2[N-]S(C)(=O)=O)cc1	ZINC000218396549	570333219	/nfs/dbraw/zinc/33/32/19/570333219.db2.gz	BPDLFHNGDFUWBM-UHFFFAOYSA-N	-1	0	376.478	2.819	40	70		GFIBRM
NC(=O)c1ccccc1NC(=O)c1ccccc1[N-]S(=O)(=O)c1ccccc1	ZINC000218409761	570333575	/nfs/dbraw/zinc/33/35/75/570333575.db2.gz	IWANRFFLQDFMFV-UHFFFAOYSA-N	-1	0	395.440	2.839	40	70		GFIBRM