smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1nc(-c2ccccc2[N-]S(=O)(=O)c2ccccc2OC(F)(F)F)cs1	ZINC000218667571	568943396	/nfs/dbraw/zinc/94/33/96/568943396.db2.gz	PJSYLWGRVOHRDE-UHFFFAOYSA-N	-1	0	414.430	4.818	50	70		HJIARM
COC(=O)C[C@H](c1cccc(Oc2ccccc2)c1)c1c([O-])c2ccccc2oc1=O	ZINC000218118269	568926177	/nfs/dbraw/zinc/92/61/77/568926177.db2.gz	SNWMZUHSHAVZSH-HXUWFJFHSA-N	-1	0	416.429	4.986	50	70	biogenic	HJIARM
CC(=O)c1c([O-])c2c(C)cc(=O)oc2c2c1OC(=O)C[C@@H]2c1cccc2ccccc21	ZINC000217988850	568922300	/nfs/dbraw/zinc/92/23/00/568922300.db2.gz	SXBDVCVBYKIZRM-QGZVFWFLSA-N	-1	0	414.413	4.604	50	70	biogenic	HJIARM
CC(=O)c1c([O-])c2c(C)cc(=O)oc2c2c1OC(=O)C[C@@H]2c1ccc(C(C)C)cc1	ZINC000218067763	568925136	/nfs/dbraw/zinc/92/51/36/568925136.db2.gz	WGJWIWNMDKNKKT-MRXNPFEDSA-N	-1	0	406.434	4.574	50	70	biogenic	HJIARM
O=c1cc(-c2ccccc2)oc2c1c([O-])cc1c2[C@@H](c2cccnc2Cl)CC(=O)O1	ZINC000218059769	568924941	/nfs/dbraw/zinc/92/49/41/568924941.db2.gz	SBYCWFICGOLASX-CQSZACIVSA-N	-1	0	419.820	4.655	50	70	biogenic	HJIARM
COC(=O)C[C@@H](c1cccc(Oc2ccccc2)c1)c1c([O-])c2ccccc2oc1=O	ZINC000218118334	568926064	/nfs/dbraw/zinc/92/60/64/568926064.db2.gz	SNWMZUHSHAVZSH-FQEVSTJZSA-N	-1	0	416.429	4.986	50	70	biogenic	HJIARM
CC(=O)c1c([O-])c2c(C)cc(=O)oc2c2c1OC(=O)C[C@H]2c1cccc2ccccc21	ZINC000217988783	568922234	/nfs/dbraw/zinc/92/22/34/568922234.db2.gz	SXBDVCVBYKIZRM-KRWDZBQOSA-N	-1	0	414.413	4.604	50	70	biogenic	HJIARM
CC(=O)c1c([O-])c2c(C)cc(=O)oc2c2c1OC(=O)C[C@H]2c1ccc(C(C)C)cc1	ZINC000218067687	568925213	/nfs/dbraw/zinc/92/52/13/568925213.db2.gz	WGJWIWNMDKNKKT-INIZCTEOSA-N	-1	0	406.434	4.574	50	70	biogenic	HJIARM
O=c1cc(-c2ccccc2)oc2c1c([O-])cc1c2[C@H](c2cccnc2Cl)CC(=O)O1	ZINC000218059690	568925002	/nfs/dbraw/zinc/92/50/02/568925002.db2.gz	SBYCWFICGOLASX-AWEZNQCLSA-N	-1	0	419.820	4.655	50	70	biogenic	HJIARM