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)O[C@]12CC=C(C)C(=O)C[C@@]13CC[C@@H]2[C@@](C)(C=CC=C(C)C(=O)[O-])OC3=O	ZINC000015117008	291216328	/nfs/dbraw/zinc/21/63/28/291216328.db2.gz	UBHOILGODYTXTA-UVGVEFFYSA-N	-1	0	402.443	2.897	1	30	biogenic,in-vitro	HFEFRM
CC(C)[C@H](S)C(=O)NC1(C(=O)N[C@@H](CCc2ccccc2)C(=O)[O-])CCCC1	ZINC000013745115	581093488	/nfs/dbraw/zinc/09/34/88/581093488.db2.gz	PCDCZPAQESZGLI-IRXDYDNUSA-N	-1	0	406.548	2.572	1	30		HFEFRM
CO[C@H]1C2C(=O)C(=C(C)COC(C)=O)C(=O)C(=O)C2[C@@]2(C)CCCC(C)(C)[C@@H]2[C@@H]1O	ZINC000095913323	291222305	/nfs/dbraw/zinc/22/23/05/291222305.db2.gz	BFNZTROYCRMMRA-AJUWASLKSA-N	-1	0	420.502	2.668	1	30	biogenic,in-vitro	HFEFRM
C=C1CC[C@@H]2[C@](C)(CO)[C@H](OS(=O)(=O)[O-])CC[C@@]2(C)[C@@H]1CCC1=CCOC1=O	ZINC000095910424	291214940	/nfs/dbraw/zinc/21/49/40/291214940.db2.gz	BCVNNJVVLOBWDE-YSDSKTICSA-N	-1	0	414.520	2.819	1	30	biogenic,in-vitro	HFEFRM
CCC[C@H]1CCC[C@H](NC(=O)[C@@H](S)Cc2ccccc2)C(=O)N1[C@@H](C)C(=O)[O-]	ZINC000011688536	581093403	/nfs/dbraw/zinc/09/34/03/581093403.db2.gz	RFJYTIBPBPKSAN-DKIMLUQUSA-N	-1	0	406.548	2.667	1	30		HFEFRM