smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1oc(-c2ccccc2)nc1COc1ccc(CO/N=C(\CCC(=O)[O-])c2ccccc2)cc1	ZINC000049756486	563203299	/nfs/dbraw/zinc/20/32/99/563203299.db2.gz	ULVDFHLHKNJICZ-QCWLDUFUSA-N	-1	0	470.525	6.015	20	30	investigational	JKEDRM
O=C1c2ccc(Br)cc2C(=O)/C1=C/c1cc(Br)c([O-])c(Br)c1	ZINC000026503301	563029266	/nfs/dbraw/zinc/02/92/66/563029266.db2.gz	SORIZGVZDRZXHJ-QDEBKDIKSA-N	-1	0	486.941	5.142	20	30		JKEDRM
C=C(CC[C@@H](C(=O)[O-])[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3)C(C)C	ZINC000004655149	290672341	/nfs/dbraw/zinc/67/23/41/290672341.db2.gz	UGMQOYZVOPASJF-OXUZYLMNSA-N	-1	0	470.738	7.790	20	30	biogenic,in-vitro	JKEDRM