smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)c1ccc([C@@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2c2nccs2)cc1	ZINC000096336084	519839475	/nfs/dbraw/zinc/83/94/75/519839475.db2.gz	UDTOQQCKZMAJTD-QGZVFWFLSA-N	-1	1	394.452	4.642	10	30		GJEEMM
CC(C)c1ccc([C@H]2C(C(=O)c3ccco3)=C([O-])C(=O)N2c2nccs2)cc1	ZINC000096336085	519840322	/nfs/dbraw/zinc/84/03/22/519840322.db2.gz	UDTOQQCKZMAJTD-KRWDZBQOSA-N	-1	1	394.452	4.642	10	30		GJEEMM
COc1cc(C=Nn2cn[n-]c2=S)ccc1OCc1ccc(C(C)(C)C)cc1	ZINC000036046580	522011315	/nfs/dbraw/zinc/01/13/15/522011315.db2.gz	VQONVZFHMUSYLZ-FMCGGJTJSA-N	-1	1	396.516	4.708	10	30		GJEEMM
C=CC(C)(C)c1c(O)c2c(O)c3cc(O)c([O-])c(CC=C(C)C)c3oc-2cc1=O	ZINC000013412042	206247408	/nfs/dbraw/zinc/24/74/08/206247408.db2.gz	LVKPSBFBKBJJOB-UHFFFAOYSA-N	-1	1	396.439	4.741	10	30	biogenic,in-vivo	GJEEMM