smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1[C@@H]2[C@H](c3cc([N+](=O)[O-])ccc3O)N(c3ccccc3)O[C@@H]2C(=O)N1c1ccc(F)cc1	ZINC000102731411	557306490	/nfs/dbraw/zinc/30/64/90/557306490.db2.gz	CXIGYYIIAPOMCB-HKBOAZHASA-N	-2	2	449.394	3.491	40	10		IGCBLL
CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Br)ccc3O)C2=O)cc1	ZINC000408885854	556877934	/nfs/dbraw/zinc/87/79/34/556877934.db2.gz	FZDKXHNUJVIYIM-XNTDXEJSSA-N	-2	2	431.242	3.220	40	10		IGCBLL
O=C1[C@H]2ON(c3ccccc3)[C@@H](c3cc([N+](=O)[O-])ccc3O)[C@@H]2C(=O)N1c1ccc(F)cc1	ZINC000102731405	557306513	/nfs/dbraw/zinc/30/65/13/557306513.db2.gz	CXIGYYIIAPOMCB-ACRUOGEOSA-N	-2	2	449.394	3.491	40	10		IGCBLL