smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc2nc3c(=O)[n-]c(=O)nc-3n(C[C@H](O)[C@H](O)[C@@H](O)CO)c2cc1N	ZINC000001617078	209333305	/nfs/dbraw/zinc/33/33/05/209333305.db2.gz	BZHBNLOEUZEUOA-GVXVVHGQSA-N	-1	0	377.357	-2.450	1	5		GABFRM
CN(C)c1ccc2nc3c(=O)[n-]c(=O)nc-3n(C[C@@H](O)[C@H](O)[C@@H](O)CO)c2c1	ZINC000002770040	209383706	/nfs/dbraw/zinc/38/37/06/209383706.db2.gz	POFQIYPMXBAUKU-DYEKYZERSA-N	-1	0	391.384	-2.274	1	5		GABFRM
CN(C)c1ccc2nc3c(=O)[n-]c(=O)nc-3n(C[C@@H](O)[C@H](O)[C@H](O)CO)c2c1	ZINC000006136022	204167566	/nfs/dbraw/zinc/16/75/66/204167566.db2.gz	POFQIYPMXBAUKU-BZPMIXESSA-N	-1	0	391.384	-2.274	1	5		GABFRM
CN(C)c1ccc2nc3c(=O)[n-]c(=O)nc-3n(C[C@@H](O)[C@@H](O)[C@@H](O)CO)c2c1	ZINC000013151524	210054396	/nfs/dbraw/zinc/05/43/96/210054396.db2.gz	POFQIYPMXBAUKU-MBNYWOFBSA-N	-1	0	391.384	-2.274	1	5		GABFRM
O=C([O-])CNC(=O)CNC(=O)CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000015261963	221334354	/nfs/dbraw/zinc/33/43/54/221334354.db2.gz	UAFHQCJHLOZNKP-UHFFFAOYSA-N	-1	0	383.273	-1.450	1	5		GABFRM
Cc1cc2nc3c(=O)[n-]c(=O)nc-3n(CC[C@@H](O)[C@H](O)[C@@H](O)CO)c2cc1C	ZINC000085541692	291092438	/nfs/dbraw/zinc/09/24/38/291092438.db2.gz	OIYSVGBCXPFZHF-IPYPFGDCSA-N	-1	0	390.396	-1.333	1	5	biogenic,in-vitro	GABFRM
Cc1cc2cc3c(=O)[n-]c(=O)nc-3n(C[C@H](O)[C@H](O)[C@@H](O)CO)c2cc1C	ZINC000017425054	221383447	/nfs/dbraw/zinc/38/34/47/221383447.db2.gz	XHELUUHUHSGXOC-KKUMJFAQSA-N	-1	0	375.381	-1.119	3	5		GABFRM