smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1c(=O)cc2oc3c(O)c([C@H](C)[C@H](C)O)c(C)c(O)c3c3c-2c1[C@H](C)[C@@H](C)O3	ZINC000040862937	205074149	/nfs/dbraw/zinc/07/41/49/205074149.db2.gz	HESPWWKIRCFDQL-MNUQUWEESA-N	0	2	398.455	4.295	1	5		GIBFLN
O=C(c1n[nH]c(=S)o1)n1c2[nH]c3ccc(Cl)cc3c2c2ccccc2c1=O	ZINC000098082245	208368250	/nfs/dbraw/zinc/36/82/50/208368250.db2.gz	QBMSTNXJMNVNJK-UHFFFAOYSA-N	0	2	396.815	4.023	1	5		GIBFLN
CC(C)=CCc1c(=O)cc2oc3c(O)ccc(CCC(C)(C)O)c3c(O)c-2c1O	ZINC000014781083	207029311	/nfs/dbraw/zinc/02/93/11/207029311.db2.gz	ZPJQIAIELUCBCV-UHFFFAOYSA-N	0	2	398.455	4.275	1	5	biogenic,in-vitro	GIBFLN
CC(C)=CCc1c(O)cc2oc3c(O)ccc(CCC(C)(C)O)c3c(=O)c2c1O	ZINC000014781083	207029316	/nfs/dbraw/zinc/02/93/16/207029316.db2.gz	ZPJQIAIELUCBCV-UHFFFAOYSA-N	0	2	398.455	4.275	1	5	biogenic,in-vitro	GIBFLN
COc1c(C)cc2c([nH]c3c2sc2c3c(=O)c(C(=O)O)cn2C2CC2)c1C	ZINC000071318804	211044881	/nfs/dbraw/zinc/04/48/81/211044881.db2.gz	LMSWOQIBAAPWOK-UHFFFAOYSA-N	0	2	382.441	4.356	1	5		GIBFLN