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@@H]1O[C@H](Oc2cc3oc(-c4ccccc4)cc([O-])c-3c(=O)c2O)[C@@H](O)[C@H](O)[C@H]1O	ZINC000001531663	562922400	/nfs/dbraw/zinc/92/24/00/562922400.db2.gz	IKIIZLYTISPENI-YRIDSSQKSA-N	-2	3	446.364	0.142	50	10		ICCAHL
O=C([O-])[C@H]1O[C@@H](Oc2cc3oc(-c4ccccc4)cc([O-])c-3c(=O)c2O)[C@H](O)[C@@H](O)[C@@H]1O	ZINC000003943903	291317102	/nfs/dbraw/zinc/31/71/02/291317102.db2.gz	IKIIZLYTISPENI-ZFORQUDYSA-N	-2	3	446.364	0.142	50	10	biogenic,in-vitro	ICCAHL
Cc1cc(C)nc([N-]S(=O)(=O)c2ccc(NC=C3C(=O)[N-]C(=S)NC3=O)cc2)n1	ZINC000018058325	557234058	/nfs/dbraw/zinc/23/40/58/557234058.db2.gz	SIMGYQILNWUXOO-UHFFFAOYSA-N	-2	3	432.487	0.721	50	10		ICCAHL
CCc1nnc([N-]S(=O)(=O)c2ccc(NC=C3C(=O)[N-]C(=S)NC3=O)cc2)s1	ZINC000023114574	557064128	/nfs/dbraw/zinc/06/41/28/557064128.db2.gz	HEKUTZKBOPYQCI-UHFFFAOYSA-N	-2	3	438.516	0.728	50	10		ICCAHL
O=C([O-])[C@H]1O[C@H](Oc2cc3oc(-c4ccccc4)cc([O-])c-3c(=O)c2O)[C@H](O)[C@@H](O)[C@@H]1O	ZINC000034114798	569587493	/nfs/dbraw/zinc/58/74/93/569587493.db2.gz	IKIIZLYTISPENI-UNJWAJPSSA-N	-2	3	446.364	0.142	50	10	world	ICCAHL
O=C([O-])[C@@H]1O[C@@H](Oc2cc3oc(-c4ccccc4)cc([O-])c-3c(=O)c2O)[C@@H](O)[C@H](O)[C@H]1O	ZINC000199027146	569261620	/nfs/dbraw/zinc/26/16/20/569261620.db2.gz	IKIIZLYTISPENI-GQUPQBGVSA-N	-2	3	446.364	0.142	50	10		ICCAHL