smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCc1nc([N-]S(=O)(=O)c2ccc(S(=O)(=O)F)cc2)sc1C(=O)[O-]	ZINC001597685666	988840118	/nfs/dbraw/zinc/84/01/18/988840118.db2.gz	VIYCXGALVPVUKR-UHFFFAOYSA-N	-2	0	394.427	1.863	20	70		GDIDRL
O=C([O-])c1ccc(F)c(S(=O)(=O)[N-]c2cccc(S(=O)(=O)F)c2)c1	ZINC000768885930	978739660	/nfs/dbraw/zinc/73/96/60/978739660.db2.gz	DSMJWWLWRPLRMK-UHFFFAOYSA-N	-2	0	377.346	1.983	20	70		GDIDRL
CCc1nc([N-]S(=O)(=O)c2cccc(S(=O)(=O)F)c2)sc1C(=O)[O-]	ZINC001597685060	988826523	/nfs/dbraw/zinc/82/65/23/988826523.db2.gz	ABGUAFJKSMRPAR-UHFFFAOYSA-N	-2	0	394.427	1.863	20	70		GDIDRL
O=C([O-])c1ccc(S(=O)(=O)[N-]c2cccc(S(=O)(=O)F)c2)c(F)c1	ZINC000768887937	978739701	/nfs/dbraw/zinc/73/97/01/978739701.db2.gz	XWFMWUHSQVHILX-UHFFFAOYSA-N	-2	0	377.346	1.983	20	70		GDIDRL
COc1c([N-]S(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cccc1C(=O)[O-]	ZINC001599344294	997975841	/nfs/dbraw/zinc/97/58/41/997975841.db2.gz	JIQZWFRKDOENAF-UHFFFAOYSA-N	-2	0	389.382	1.852	20	70		GDIDRL
COc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(S(=O)(=O)F)c1	ZINC000768891947	978740460	/nfs/dbraw/zinc/74/04/60/978740460.db2.gz	ONKPQWCAWFGKTR-UHFFFAOYSA-N	-2	0	389.382	1.852	20	70		GDIDRL
COc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(S(=O)(=O)F)cc1	ZINC001599378711	998531720	/nfs/dbraw/zinc/53/17/20/998531720.db2.gz	ZVYCTJUPVFUIOP-UHFFFAOYSA-N	-2	0	389.382	1.852	20	70		GDIDRL
CS(=O)(=O)c1cc(C(=O)[O-])ccc1NC(=O)c1cc(S(=O)(=O)F)c[n-]1	ZINC001599764906	992171235	/nfs/dbraw/zinc/17/12/35/992171235.db2.gz	DPCJSWIABHUJLD-UHFFFAOYSA-N	-2	0	390.370	1.027	20	70		GDIDRL
COc1cc(C(=O)[O-])ccc1S(=O)(=O)[N-]c1cccc(S(=O)(=O)F)c1	ZINC001599383677	996904024	/nfs/dbraw/zinc/90/40/24/996904024.db2.gz	HRMMERSGBJAVKU-UHFFFAOYSA-N	-2	0	389.382	1.852	20	70		GDIDRL
COc1ccc(C(=O)[O-])c([N-]S(=O)(=O)c2cccc(S(=O)(=O)F)c2)c1	ZINC000780380988	978790471	/nfs/dbraw/zinc/79/04/71/978790471.db2.gz	ZACXNCOZJLEXIM-UHFFFAOYSA-N	-2	0	389.382	1.852	20	70		GDIDRL
CS(=O)(=O)c1cc(NC(=O)c2cc(S(=O)(=O)F)c[n-]2)cc(C(=O)[O-])c1	ZINC001599766549	992190093	/nfs/dbraw/zinc/19/00/93/992190093.db2.gz	KPGVFJPFHJNTHD-UHFFFAOYSA-N	-2	0	390.370	1.027	20	70		GDIDRL