smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc([N-]S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000013029687	562961170	/nfs/dbraw/zinc/96/11/70/562961170.db2.gz	MHUXYLWVGFPYNI-UHFFFAOYSA-N	-3	3	464.496	3.434	1	10		JGCFHL
O=C([O-])Cc1cccc(-c2ccccc2NC(=O)CCCNC(=O)c2cc(O)c([O-])c(O)c2)c1	ZINC000035275861	563119858	/nfs/dbraw/zinc/11/98/58/563119858.db2.gz	POXVEIKQTLMBDN-UHFFFAOYSA-N	-2	3	464.474	3.246	1	10		JGCFHL
CO[C@H]1c2cc3c(c([O-])c2-c2c([O-])c4c(=O)[nH]c(C)cc4cc2[C@@H]1O)C(=O)c1ccc(C)c(O)c1C3=O	ZINC000015202981	560229174	/nfs/dbraw/zinc/22/91/74/560229174.db2.gz	AYAYSZMHAWZBCX-IGKIAQTJSA-N	-2	3	499.475	3.439	1	10	in-vitro	JGCFHL
CO[C@H]1c2cc3c(c([O-])c2-c2c([O-])c4c(=O)[nH]c(C)cc4cc2[C@@H]1O)C(=O)c1ccc(C)c([O-])c1C3=O	ZINC000015202981	560229176	/nfs/dbraw/zinc/22/91/76/560229176.db2.gz	AYAYSZMHAWZBCX-IGKIAQTJSA-N	-3	3	499.475	3.439	1	10	in-vitro	JGCFHL
C[C@H](NC(=O)OC(C)(C)C)C(=O)Oc1c(=O)c2c([O-])cc([O-])cc2oc1-c1ccc(O)c(O)c1	ZINC000043023906	563165315	/nfs/dbraw/zinc/16/53/15/563165315.db2.gz	DWQACXURLMKHAH-JTQLQIEISA-N	-2	3	473.434	3.101	1	10		JGCFHL