smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(=O)OC[C@H]1O[C@H](n2ncc(=O)[nH]c2=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O	ZINC000011677473	207318354	/nfs/dbraw/zinc/31/83/54/207318354.db2.gz	QQOBRRFOVWGIMD-XEZLXBQYSA-N	0	2	371.302	-1.745	1	0		FAAFLN
O=C([O-])[C@@H]1Cc2c3ccccc3[nH]c2[C@H]([C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)[NH2+]1	ZINC000085588727	571783747	/nfs/dbraw/zinc/78/37/47/571783747.db2.gz	LCHFAYIGHOVWSA-MLAMDLQDSA-N	0	2	366.370	-1.756	1	0	endogenous,in-man	FAAFLN
O=C([O-])[C@@H]1Cc2c3ccccc3[nH]c2[C@H]([C@H](O)[C@H](O)[C@H](O)[C@@H](O)CO)[NH2+]1	ZINC000100770451	571813021	/nfs/dbraw/zinc/81/30/21/571813021.db2.gz	LCHFAYIGHOVWSA-BQAALJAISA-N	0	2	366.370	-1.756	1	0	endogenous,in-man	FAAFLN
O=C([O-])[C@@H]1Cc2c3ccccc3[nH]c2[C@H]([C@H](O)[C@H](O)[C@@H](O)[C@H](O)CO)[NH2+]1	ZINC000100770452	571813101	/nfs/dbraw/zinc/81/31/01/571813101.db2.gz	LCHFAYIGHOVWSA-BWWHORKDSA-N	0	2	366.370	-1.756	1	0	endogenous,in-man	FAAFLN
O=C([O-])[C@@H]1Cc2c3ccccc3[nH]c2[C@H]([C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)[NH2+]1	ZINC000100770453	571813010	/nfs/dbraw/zinc/81/30/10/571813010.db2.gz	LCHFAYIGHOVWSA-HPYGTKAVSA-N	0	2	366.370	-1.756	1	0	endogenous,in-man	FAAFLN