smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCOC(=O)[C@]12O[C@@]1(CC(CO)=C(C)C)C(=O)c1ccccc1C2=O	ZINC000085592720	291233998	/nfs/dbraw/zinc/23/39/98/291233998.db2.gz	KDCJXNBVABJZSZ-GOTSBHOMSA-N	0	0	400.471	3.416	1	10	biogenic,in-vitro	HGCFRN
COc1cc([C@@H]2C[C@H](O)[C@H]3CC[C@@H](c4ccc(O)cc4)C[C@@H]3O2)c(CO)c(O)c1O	ZINC000085596392	291238515	/nfs/dbraw/zinc/23/85/15/291238515.db2.gz	RQOPWZDSWFQBKU-BAPHQFHRSA-N	0	0	416.470	3.079	1	10	biogenic,in-vitro	HGCFRN
COc1cc(CCC(=O)C[C@H](O)CCc2ccc(O)c3c2CCCO3)cc(O)c1O	ZINC000085625919	291238341	/nfs/dbraw/zinc/23/83/41/291238341.db2.gz	SDDOKAHBIBWZJH-QGZVFWFLSA-N	0	0	416.470	3.023	1	10	biogenic,in-vitro	HGCFRN
CCCCOC(=O)[C@@H](Cc1ccc(O)c(O)c1)OC(=O)/C=C\c1ccc(O)c(O)c1	ZINC000013341244	291234002	/nfs/dbraw/zinc/23/40/02/291234002.db2.gz	QACLUURODSWXLR-QKWWCAPFSA-N	0	0	416.426	3.020	1	10	biogenic,in-vitro	HGCFRN