smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1oc(S(=O)(=O)Nc2ccsc2C(=O)[O-])cc1C(=O)[O-]	ZINC000004297052	440914388	/nfs/dbraw/zinc/91/43/88/440914388.db2.gz	AKTXUOADADNXCL-UHFFFAOYSA-N	-2	2	331.327	1.847	50	0		EDAALL
CCOc1ccc([C@H]2CC(c3c(O)n(C)c(=S)[nH]c3=O)=NN2)cc1	ZINC000101494920	219129201	/nfs/dbraw/zinc/12/92/01/219129201.db2.gz	QVYOQGPBGHRXDX-LLVKDONJSA-N	-2	2	346.412	1.986	50	0		EDAALL
O=Nc1c(O)c2c(O)cc(S(=O)(=O)[O-])cc2cc1S(=O)(=O)[O-]	ZINC000004759155	210272401	/nfs/dbraw/zinc/27/24/01/210272401.db2.gz	ZZMSOJNZJNSCEN-UHFFFAOYSA-N	-2	2	349.298	1.142	50	0		EDAALL