smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)OCCCn1c2ccc(S(=O)(=O)N3CCOCC3)cc2nc1-c1ccc(O)c([N+](=O)[O-])c1	ZINC000514296527	1059214028	/nfs/dbraw/zinc/21/40/28/1059214028.db2.gz	IOESDCXWEOGEMI-UHFFFAOYSA-N	0	2	504.565	3.153	20	5		KGBDLN
CCN(CC)S(=O)(=O)c1ccc(OC(C)C)c(NS(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)c1	ZINC000514298069	1059222002	/nfs/dbraw/zinc/22/20/02/1059222002.db2.gz	UFDPFSZALGPPEO-UHFFFAOYSA-N	0	2	501.583	3.222	20	5		KGBDLN