smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCc1nnc([N-]N=C2C(=O)[N-]C(=O)NC2=O)s1	ZINC000109716267	351798093	/nfs/dbraw/zinc/79/80/93/351798093.db2.gz	WPAHWPJJCMWVRV-UHFFFAOYSA-N	-2	1	268.258	-0.766	40	30		CBEBML
N#Cc1cn([C@H](Cc2cnc[nH]2)C(=O)[O-])c(=O)[n-]c1=O	ZINC000585090168	570322280	/nfs/dbraw/zinc/32/22/80/570322280.db2.gz	XHDJLVSLZQIQQB-MRVPVSSYSA-N	-2	1	275.224	-0.588	40	30		CBEBML
O=c1[n-]c(=S)[nH]c([O-])c1N=Nc1nccs1	ZINC000038311293	419419127	/nfs/dbraw/zinc/41/91/27/419419127.db2.gz	FFVBVGXCJRGRCY-UHFFFAOYSA-N	-2	1	255.284	0.282	40	30		CBEBML
N#Cc1cn([C@@H](Cc2cnc[nH]2)C(=O)[O-])c(=O)[n-]c1=O	ZINC000585090169	570322273	/nfs/dbraw/zinc/32/22/73/570322273.db2.gz	XHDJLVSLZQIQQB-QMMMGPOBSA-N	-2	1	275.224	-0.588	40	30		CBEBML