smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccnc([N-]S(=O)(=O)c2ccc(N=Nc3c(N)[nH]c(=O)[n-]c3=O)cc2)n1	ZINC000018098358	558831134	/nfs/dbraw/zinc/83/11/34/558831134.db2.gz	WBCQMIOWOGTBRI-QURGRASLSA-N	-2	3	402.396	0.960	40	10		HCCBHL
Cc1cc([O-])c2c(c1)C(=O)c1cc(O[C@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)cc([O-])c1C2=O	ZINC000031425373	291181742	/nfs/dbraw/zinc/18/17/42/291181742.db2.gz	DTTVUKLWJFJOHO-CQYCCUBQSA-N	-2	3	416.382	0.388	40	10	biogenic,in-vitro	HCCBHL
Cc1cc([O-])c2c(c1)C(=O)c1cc(O[C@H]3OC[C@](O)(CO)[C@H]3O)cc([O-])c1C2=O	ZINC000079669766	559017879	/nfs/dbraw/zinc/01/78/79/559017879.db2.gz	AEQMIFRODRFTJF-XUVXKRRUSA-N	-2	3	402.355	0.001	40	10		HCCBHL