smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N=C1NC(=O)[C@@H](CC(=O)NNC(=O)CCCNC(=O)[O-])S1	ZINC000833986268	605978696	/nfs/dbraw/zinc/97/86/96/605978696.db2.gz	MPEWVQZXBDXSBN-RXMQYKEDSA-N	-1	2	317.327	-1.262	20	50		DAGDLM
N=C1NC(=O)[C@H](CC(=O)NNC(=O)CCCNC(=O)[O-])S1	ZINC000833986269	605979011	/nfs/dbraw/zinc/97/90/11/605979011.db2.gz	MPEWVQZXBDXSBN-YFKPBYRVSA-N	-1	2	317.327	-1.262	20	50		DAGDLM
Cc1ccc(C(=O)[N-]NC(=O)Cn2cnc(-c3nn[nH]n3)n2)o1	ZINC000822226190	946004224	/nfs/dbraw/zinc/00/42/24/946004224.db2.gz	GWYBLGCUIZMCSQ-UHFFFAOYSA-N	-1	2	317.269	-1.179	20	50		DAGDLM
O=C([O-])NCC(=O)NNC(=O)Cn1[nH]cc2c(=O)ncnc1-2	ZINC000834202085	605466961	/nfs/dbraw/zinc/46/69/61/605466961.db2.gz	ORSHTQRJXMQCLH-UHFFFAOYSA-N	-1	2	309.242	-2.514	20	50		DAGDLM