smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(CCN2C(=O)N[C@@H](CC(=O)NC[C@@H]3CCC[N@@H+]4CCCC[C@H]34)C2=O)cc1OC	ZINC000217726004	569881231	/nfs/dbraw/zinc/88/12/31/569881231.db2.gz	REQQXXMYGWINDI-SLFFLAALSA-N	1	0	472.586	1.938	50	70	biogenic	JDIARO
O=C(CC[C@@H]1NC(=O)N(Cc2ccc3c(c2)OCO3)C1=O)NC[C@@H]1CCC[N@@H+]2CCCC[C@H]12	ZINC000217743639	569881342	/nfs/dbraw/zinc/88/13/42/569881342.db2.gz	WSGKEUMMWFYOAF-GBESFXJTSA-N	1	0	456.543	1.997	50	70	biogenic	JDIARO
COc1ccc(S(=O)(=O)N2CCN(Cc3c(O)c(=O)cc(C[NH+]4CCCCC4)n3C)CC2)cc1	ZINC000218535739	569883460	/nfs/dbraw/zinc/88/34/60/569883460.db2.gz	WUGWTDLYHSGYGR-UHFFFAOYSA-N	1	0	490.626	1.592	50	70		JDIARO
COc1ccc(CN2C(=O)N[C@@H](CC(=O)NC[C@@H]3CCC[N@@H+]4CCCC[C@H]34)C2=O)cc1OC	ZINC000217631508	569880743	/nfs/dbraw/zinc/88/07/43/569880743.db2.gz	JJOKBCSPXZBUFP-GBESFXJTSA-N	1	0	458.559	1.895	50	70	biogenic	JDIARO