smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Oc1c(Br)cc(C=NN2CN=NC2=S)c(O)c1Br	ZINC000103763770	526322328	/nfs/dbraw/zinc/32/23/28/526322328.db2.gz	LQYMLHDJUGHEAH-SILLCRNTSA-N	0	2	394.048	2.385	10	30		GEEELN
O=[N+]([O-])c1ccc(O)c(/C=N\c2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000083328244	527369280	/nfs/dbraw/zinc/36/92/80/527369280.db2.gz	FZPKRLVAYCWBDT-PDGQHHTCSA-N	0	2	391.405	2.072	10	30		GEEELN
CC1=CC(=[NH+]Nc2ccc(S(=O)(=O)[N-]c3ccccn3)cc2)C(N)=CC1=O	ZINC000583650541	570804212	/nfs/dbraw/zinc/80/42/12/570804212.db2.gz	BBJDRANVVNBXAR-UHFFFAOYSA-N	0	2	383.433	2.022	10	30		GEEELN
N#Cc1ccccc1NC(=O)CSc1nc(O)c(-c2ccccc2)c(=O)[nH]1	ZINC000005737971	570913162	/nfs/dbraw/zinc/91/31/62/570913162.db2.gz	IQXCNMDGUZOPMX-UHFFFAOYSA-N	0	2	378.413	2.026	10	30		GEEELN