smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CS(=O)(=O)CC[C@@H](NC(=O)[O-])C(=O)NNC(=O)c1ccccn1	ZINC000833893683	605400958	/nfs/dbraw/zinc/40/09/58/605400958.db2.gz	CVPQUEPVNIPOER-SECBINFHSA-N	-1	2	344.349	-1.087	20	50		EAGDLM
CS(=O)(=O)CC[C@H](NC(=O)[O-])C(=O)NNC(=O)c1ccccn1	ZINC000833893684	605400875	/nfs/dbraw/zinc/40/08/75/605400875.db2.gz	CVPQUEPVNIPOER-VIFPVBQESA-N	-1	2	344.349	-1.087	20	50		EAGDLM
Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NNC(=O)CNC(=O)[O-]	ZINC000833934244	605458744	/nfs/dbraw/zinc/45/87/44/605458744.db2.gz	CYSJZBVAFUIQIM-UHFFFAOYSA-N	-1	2	334.310	-1.428	20	50		EAGDLM
O=C([O-])NCCCC(=O)NNC(=O)Cn1[nH]cc2c(=O)ncnc1-2	ZINC000834231999	605973873	/nfs/dbraw/zinc/97/38/73/605973873.db2.gz	UWEDWQKIBOMREK-UHFFFAOYSA-N	-1	2	337.296	-1.734	20	50		EAGDLM