smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COC(=O)[C@](O)(CO)[C@@H]1Cc2c(cc(=O)c3c([O-])c4ccccc4n(C)c2-3)O1	ZINC000014686464	291100928	/nfs/dbraw/zinc/10/09/28/291100928.db2.gz	AKJQUGNUJATZNP-YWZLYKJASA-N	-1	3	385.372	0.597	1	5	biogenic,in-vitro	GCBFHM
COC(=O)[C@](O)(CO)[C@@H]1Cc2c(cc([O-])c3c(=O)c4ccccc4n(C)c23)O1	ZINC000014686464	291100929	/nfs/dbraw/zinc/10/09/29/291100929.db2.gz	AKJQUGNUJATZNP-YWZLYKJASA-N	-1	3	385.372	0.597	1	5	biogenic,in-vitro	GCBFHM
COC(=O)[C@@](O)(CO)[C@H]1Cc2c(cc(=O)c3c([O-])c4ccccc4n(C)c2-3)O1	ZINC000014686466	291100924	/nfs/dbraw/zinc/10/09/24/291100924.db2.gz	AKJQUGNUJATZNP-FOIQADDNSA-N	-1	3	385.372	0.597	1	5	biogenic,in-vitro	GCBFHM
COC(=O)[C@@](O)(CO)[C@H]1Cc2c(cc([O-])c3c(=O)c4ccccc4n(C)c23)O1	ZINC000014686466	291100925	/nfs/dbraw/zinc/10/09/25/291100925.db2.gz	AKJQUGNUJATZNP-FOIQADDNSA-N	-1	3	385.372	0.597	1	5	biogenic,in-vitro	GCBFHM
O=c1[n-]c(=O)n([C@H]2C[C@H](O)[C@H](CO)O2)c2nc3cc4ccccc4cc3nc12	ZINC000005822359	204153471	/nfs/dbraw/zinc/15/34/71/204153471.db2.gz	VLALGVDYALURRM-SOUVJXGZSA-N	-1	3	380.360	0.427	1	5		GCBFHM
O=C(Cc1nc(N2CCOCC2)cc(=O)[n-]1)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000095573041	136182254	/nfs/dbraw/zinc/18/22/54/136182254.db2.gz	ZHUGIRWYGVFSFO-UHFFFAOYSA-N	-1	3	377.332	0.835	1	5		GCBFHM
O=c1[n-]c(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)c2nc3cc4ccccc4cc3nc12	ZINC000001857645	212258296	/nfs/dbraw/zinc/25/82/96/212258296.db2.gz	VLALGVDYALURRM-RRFJBIMHSA-N	-1	3	380.360	0.427	1	5		GCBFHM
O=c1[n-]c(=O)n([C@H]2C[C@H](O)[C@H](CO)O2)c2nc3ccc4ccccc4c3nc12	ZINC000001857646	212259368	/nfs/dbraw/zinc/25/93/68/212259368.db2.gz	JHXMHXNXWGYMMR-MELADBBJSA-N	-1	3	380.360	0.427	1	5		GCBFHM