smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=S(=O)([N-]c1ccc([O-])c(Cl)c1)c1cc2ccccc2s1	ZINC001185459913	1052243535	/nfs/dbraw/zinc/24/35/35/1052243535.db2.gz	LULLWHVRZILDIC-UHFFFAOYSA-N	-2	1	339.825	4.061	20	10		EICDML
CC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc([O-])c(Cl)c2)s1	ZINC000776748812	1053828534	/nfs/dbraw/zinc/82/85/34/1053828534.db2.gz	JBSOOJVHBNSVLE-UHFFFAOYSA-N	-2	1	345.873	4.205	20	10		EICDML
O=S(=O)([N-]c1ccc(O)c(F)c1)c1ccc(-c2cccs2)cc1	ZINC001194161579	1052091844	/nfs/dbraw/zinc/09/18/44/1052091844.db2.gz	FRZRIJDZICIMON-UHFFFAOYSA-N	-2	1	349.408	4.061	20	10		EICDML
C=Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)c([O-])c(Cl)c2)cc1	ZINC000821192560	1049608563	/nfs/dbraw/zinc/60/85/63/1049608563.db2.gz	VLNPDPSPWOBNNS-UHFFFAOYSA-N	-2	1	344.219	4.143	20	10		EICDML