smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)c2c(c1)C(=O)c1cccc(O)c1C2=O	ZINC000015063143	574413748	/nfs/dbraw/zinc/41/37/48/574413748.db2.gz	QKPDYSSHOSPOKH-LNETUDSMSA-N	0	0	416.382	-0.345	10	10	endogenous,in-man	HBCERN
Cc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(c1)C(=O)c1cccc(O)c1C2=O	ZINC000026990660	291168325	/nfs/dbraw/zinc/16/83/25/291168325.db2.gz	QKPDYSSHOSPOKH-JNHRPPPUSA-N	0	0	416.382	-0.345	10	10	biogenic,in-vitro	HBCERN
CC1(C)OCC([N+](=O)[O-])([N+](=O)[N-]C(=O)OCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])CO1	ZINC000103534816	559156108	/nfs/dbraw/zinc/15/61/08/559156108.db2.gz	MOPZXCPCUVVXSP-KHPPLWFESA-N	0	0	412.224	-0.675	10	10		HBCERN