smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1[N-]C(=O)/C(=N\c2nccs2)C(=O)N1	ZINC000001958911	359591228	/nfs/dbraw/zinc/59/12/28/359591228.db2.gz	BZYODKMXMAAGNO-UHFFFAOYSA-N	-1	2	224.201	-0.418	50	30		BBEALM
O=C1[N-]C(=O)/C(=N/c2nccs2)C(=O)N1	ZINC000001958911	359591224	/nfs/dbraw/zinc/59/12/24/359591224.db2.gz	BZYODKMXMAAGNO-UHFFFAOYSA-N	-1	2	224.201	-0.418	50	30		BBEALM
CC(=NNc1nnc(C)c(=O)[nH]1)C(=O)[O-]	ZINC000003945047	188332796	/nfs/dbraw/zinc/33/27/96/188332796.db2.gz	NZSYRPJMGWWXKA-WMZJFQQLSA-N	-1	2	211.181	-0.654	50	30		BBEALM
CCC(=NNc1nnc(C)c(=O)[nH]1)C(=O)[O-]	ZINC000004480011	384378041	/nfs/dbraw/zinc/37/80/41/384378041.db2.gz	XQOIZQYTZQWPLG-VZUCSPMQSA-N	-1	2	225.208	-0.264	50	30		BBEALM
CC(=NNc1nnc(C)c(=O)[nH]1)C(=O)[O-]	ZINC000008672492	398329211	/nfs/dbraw/zinc/32/92/11/398329211.db2.gz	NZSYRPJMGWWXKA-ONNFQVAWSA-N	-1	2	211.181	-0.242	50	30		BBEALM
Cc1cc(O)n(CC(=O)[O-])c(=O)c1C#N	ZINC000018996884	178200430	/nfs/dbraw/zinc/20/04/30/178200430.db2.gz	ZNEOZWHWBWZONP-UHFFFAOYSA-N	-1	2	208.173	-0.181	50	30		BBEALM
CC(=O)ON[C@@H](Cc1c[nH]c[nH+]1)C(=O)[O-]	ZINC000025628715	188356472	/nfs/dbraw/zinc/35/64/72/188356472.db2.gz	UZPURUBLTOVTLR-ZETCQYMHSA-N	-1	2	213.193	-0.527	50	30		BBEALM