smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cc(C=O)c2c(c1[O-])O[C@]1(C)O[C@@]2(C)C(=O)c2cc(OC)c(O)c(O)c21	ZINC000003933352	560191571	/nfs/dbraw/zinc/19/15/71/560191571.db2.gz	PECRJLBPKXQZDC-WOJBJXKFSA-N	-1	0	402.355	2.327	1	10	in-vitro	HECFRM
CC[C@](Cc1ccc(O)c(O)c1CO)(OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)[O-]	ZINC000085510835	291204875	/nfs/dbraw/zinc/20/48/75/291204875.db2.gz	DEPFUSZWYIBEGU-FAZYEBOESA-N	-1	0	418.398	2.034	1	10	biogenic,in-vitro	HECFRM
O=C(CCc1ccc(O)c(O)c1)C[C@@H](CCc1ccc(O)c(O)c1)S(=O)(=O)[O-]	ZINC000013377951	291211493	/nfs/dbraw/zinc/21/14/93/291211493.db2.gz	IMDXRLLSWYZMEN-OAHLLOKOSA-N	-1	0	410.444	2.290	1	10	biogenic,in-vitro	HECFRM
C[C@@H](O)Cc1oc2cc([O-])c3c(c2c(=O)c1O)O[C@@H](c1ccc(O)c(O)c1)CC3=O	ZINC000085487617	291210170	/nfs/dbraw/zinc/21/01/70/291210170.db2.gz	LMNBPHAQJURIET-XLKFXECMSA-N	-1	0	414.366	2.245	1	10	biogenic,in-vitro	HECFRM