smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])[C@@H](NC(=O)Nc1cccc(S(=O)(=O)[N-]c2nccs2)c1)[C@H]1CCCOC1	ZINC000562434263	939329830	/nfs/dbraw/zinc/32/98/30/939329830.db2.gz	RKPBZQCHICXGNW-FZMZJTMJSA-N	-2	0	440.503	1.945	20	0		IDADRL
Cn1ccc([C@H](NC(=O)Nc2cccc(S(=O)(=O)[N-]c3nccs3)c2)C(=O)[O-])n1	ZINC000684749528	939051848	/nfs/dbraw/zinc/05/18/48/939051848.db2.gz	PDXLILIMJQGUIT-ZDUSSCGKSA-N	-2	0	436.475	1.625	20	0		IDADRL
Cn1ccc([C@@H](NC(=O)Nc2cccc(S(=O)(=O)[N-]c3nccs3)c2)C(=O)[O-])n1	ZINC000684749527	939051947	/nfs/dbraw/zinc/05/19/47/939051947.db2.gz	PDXLILIMJQGUIT-CYBMUJFWSA-N	-2	0	436.475	1.625	20	0		IDADRL
O=C([O-])[C@@H](NC(=O)Nc1cccc(S(=O)(=O)[N-]c2nccs2)c1)[C@@H]1CCCOC1	ZINC000562434264	939329697	/nfs/dbraw/zinc/32/96/97/939329697.db2.gz	RKPBZQCHICXGNW-RISCZKNCSA-N	-2	0	440.503	1.945	20	0		IDADRL
O=C([O-])[C@H](NC(=O)Nc1cccc(S(=O)(=O)[N-]c2nccs2)c1)[C@H]1CCCOC1	ZINC000562434265	939329862	/nfs/dbraw/zinc/32/98/62/939329862.db2.gz	RKPBZQCHICXGNW-SMDDNHRTSA-N	-2	0	440.503	1.945	20	0		IDADRL
O=C([O-])[C@H](NC(=O)Nc1cccc(S(=O)(=O)[N-]c2nccs2)c1)[C@@H]1CCCOC1	ZINC000562434262	939329835	/nfs/dbraw/zinc/32/98/35/939329835.db2.gz	RKPBZQCHICXGNW-BXUZGUMPSA-N	-2	0	440.503	1.945	20	0		IDADRL
O=C([O-])[C@@H](NC(=O)Nc1cccc(S(=O)(=O)[N-]c2nccs2)c1)C1CCOCC1	ZINC000581526525	939778778	/nfs/dbraw/zinc/77/87/78/939778778.db2.gz	XHPROELJWCMQOZ-AWEZNQCLSA-N	-2	0	440.503	1.945	20	0		IDADRL
O=C([O-])[C@H](NC(=O)Nc1cccc(S(=O)(=O)[N-]c2nccs2)c1)C1CCOCC1	ZINC000581526526	939778898	/nfs/dbraw/zinc/77/88/98/939778898.db2.gz	XHPROELJWCMQOZ-CQSZACIVSA-N	-2	0	440.503	1.945	20	0		IDADRL
COc1ccc(C(=O)N[C@]2(C(=O)[O-])CCOC2)cc1S(=O)(=O)[N-]c1ccc(C)cc1	ZINC000538513106	939279448	/nfs/dbraw/zinc/27/94/48/939279448.db2.gz	VHOWTGQGSKGSHS-HXUWFJFHSA-N	-2	0	434.470	1.778	20	0		IDADRL
COc1ccc(C(=O)N[C@@]2(C(=O)[O-])CCOC2)cc1S(=O)(=O)[N-]c1ccc(C)cc1	ZINC000538513105	939279495	/nfs/dbraw/zinc/27/94/95/939279495.db2.gz	VHOWTGQGSKGSHS-FQEVSTJZSA-N	-2	0	434.470	1.778	20	0		IDADRL