smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[N+]([O-])c1c([O-])cc([O-])cc1OC[C@@H]1COCCOCCOCCO1	ZINC001228973180	857241647	/nfs/dbraw/zinc/24/16/47/857241647.db2.gz	HMOMWLCBUZDBJX-LBPRGKRZSA-N	-2	3	359.331	0.833	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](CC1CC1)C(=O)[O-]	ZINC000285110119	213285278	/nfs/dbraw/zinc/28/52/78/213285278.db2.gz	MPFBFNWJYOOAPQ-NSHDSACASA-N	-2	3	372.355	0.913	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@](C)(CO)CC(=O)[O-]	ZINC000275627985	212062701	/nfs/dbraw/zinc/06/27/01/212062701.db2.gz	LXTCLGZTAQWOBF-CYBMUJFWSA-N	-2	3	362.360	0.355	20	5		FCBDHL
COC(=O)CC[C@@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)[O-]	ZINC000275372381	212015043	/nfs/dbraw/zinc/01/50/43/212015043.db2.gz	YWAXOPMPFWNRDK-SECBINFHSA-N	-2	3	360.344	0.588	20	5		FCBDHL
CN1CC[C@H](C[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1=O	ZINC000424600782	247265655	/nfs/dbraw/zinc/26/56/55/247265655.db2.gz	OMTYELQZJICALA-VIFPVBQESA-N	-2	3	371.371	0.440	20	5		FCBDHL
O=C([O-])[C@@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000274946964	488746930	/nfs/dbraw/zinc/74/69/30/488746930.db2.gz	RZIFFFOASAFHBF-SSDOTTSWSA-N	-2	3	358.250	0.337	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-]CC2(C(=O)[O-])CCOCC2)c([N+](=O)[O-])c1	ZINC000274922868	488743969	/nfs/dbraw/zinc/74/39/69/488743969.db2.gz	BKRGICGNQZPKIB-UHFFFAOYSA-N	-2	3	374.371	0.763	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCSCC(=O)[O-]	ZINC000274949668	488747044	/nfs/dbraw/zinc/74/70/44/488747044.db2.gz	GDGPZZTXYIFCRX-UHFFFAOYSA-N	-2	3	350.374	0.700	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](CC(=O)[O-])C(=O)[O-])c1C	ZINC000275057472	488757318	/nfs/dbraw/zinc/75/73/18/488757318.db2.gz	YGKSEGUPPIQUEE-SECBINFHSA-N	-3	3	360.344	0.665	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@@H](CC(F)F)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000275197174	488771520	/nfs/dbraw/zinc/77/15/20/488771520.db2.gz	GHOLCTDIQHEMDL-ZETCQYMHSA-N	-2	3	354.287	0.990	20	5		FCBDHL
O=C([O-])CNC(=O)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000278171403	488804672	/nfs/dbraw/zinc/80/46/72/488804672.db2.gz	DGPISMGOLQBITA-UHFFFAOYSA-N	-2	3	365.751	0.117	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CCc2nc(=O)o[n-]2)c1	ZINC000281105370	489053615	/nfs/dbraw/zinc/05/36/15/489053615.db2.gz	FSWJBDWDWJEPDX-UHFFFAOYSA-N	-2	3	362.751	0.754	20	5		FCBDHL
C[C@@]1(C[C@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2[O-])NC(=O)[N-]C1=O	ZINC000286313514	489379022	/nfs/dbraw/zinc/37/90/22/489379022.db2.gz	UDDFIKHYXFRETL-ABKXIKBNSA-N	-2	3	362.342	0.893	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCn3ccnc3C2)c1	ZINC000414328503	489495966	/nfs/dbraw/zinc/49/59/66/489495966.db2.gz	AOXHVWUFVHAVRH-JTQLQIEISA-N	-2	3	366.355	0.783	20	5		FCBDHL
CCC(CC)([N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-])C(N)=O	ZINC000414323783	489496147	/nfs/dbraw/zinc/49/61/47/489496147.db2.gz	VAJQXDLXULPWEV-UHFFFAOYSA-N	-2	3	359.360	0.615	20	5		FCBDHL
O=C([O-])CCCCCNC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000455837556	489601542	/nfs/dbraw/zinc/60/15/42/489601542.db2.gz	VMNRSSBQUODWKB-UHFFFAOYSA-N	-2	3	373.387	0.634	20	5		FCBDHL
C[N-]S(=O)(=O)c1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])cn1	ZINC000474373215	489757701	/nfs/dbraw/zinc/75/77/01/489757701.db2.gz	NQDJQUDLQAFFGX-UHFFFAOYSA-N	-2	3	352.328	0.856	20	5		FCBDHL
COC(=O)Cc1nnc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)[n-]1	ZINC000460537375	489871997	/nfs/dbraw/zinc/87/19/97/489871997.db2.gz	CFQLQGJKUDEUDJ-UHFFFAOYSA-N	-2	3	355.332	0.538	20	5		FCBDHL
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])[C@@H]1OC	ZINC000571528279	491313863	/nfs/dbraw/zinc/31/38/63/491313863.db2.gz	WTVBWZDEEOLCFR-NDMJEZRESA-N	-2	3	374.371	0.764	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C[C@@H]1CCOC1)C(=O)[O-]	ZINC000548203671	490437427	/nfs/dbraw/zinc/43/74/27/490437427.db2.gz	VKNLFKVFPYHHSS-GXSJLCMTSA-N	-2	3	374.371	0.762	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@@H]1CCOC1	ZINC000548205444	490439153	/nfs/dbraw/zinc/43/91/53/490439153.db2.gz	YWQXVMOWCZGLPM-PRHODGIISA-N	-2	3	360.344	0.371	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-]C[C@](C)(CC(=O)[O-])C(=O)[O-])cc1[N+](=O)[O-]	ZINC000548261283	490453121	/nfs/dbraw/zinc/45/31/21/490453121.db2.gz	MEWPFWKKEXPRGQ-NSHDSACASA-N	-3	3	366.373	0.809	20	5		FCBDHL
CCC[C@@H](O)[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000548560113	490506257	/nfs/dbraw/zinc/50/62/57/490506257.db2.gz	QNRYDPYUFPQUQP-KOLCDFICSA-N	-2	3	350.324	0.626	20	5		FCBDHL
C[C@H](CN1CCOCC1)[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000516574908	490869407	/nfs/dbraw/zinc/86/94/07/490869407.db2.gz	WOLLTGWKHHLJMF-SNVBAGLBSA-N	-2	3	373.387	0.292	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]CCCO[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000567053289	491483164	/nfs/dbraw/zinc/48/31/64/491483164.db2.gz	YJYGERTYXJTKSH-NSHDSACASA-N	-2	3	374.371	0.767	20	5		FCBDHL
COC[C@@](C)(O)CC[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000574280791	491485939	/nfs/dbraw/zinc/48/59/39/491485939.db2.gz	AMPNKKBNEBOKGZ-ZDUSSCGKSA-N	-2	3	362.360	0.359	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]CC[C@]2(O)CCOC2)c([N+](=O)[O-])c1	ZINC000593315864	546967003	/nfs/dbraw/zinc/96/70/03/546967003.db2.gz	NMVFSUHTZLZDJX-ZDUSSCGKSA-N	-2	3	360.344	0.113	20	5		FCBDHL
COC(=O)CC[C@@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000275288634	547344832	/nfs/dbraw/zinc/34/48/32/547344832.db2.gz	PCHLSIFOZBCITF-SNVBAGLBSA-N	-2	3	374.371	0.896	20	5		FCBDHL
CC(C)(CCC(=O)[N-]S(=O)(=O)c1cccc(-c2nnn[n-]2)c1)[N+](=O)[O-]	ZINC001589272302	1282825742	/nfs/dbraw/zinc/82/57/42/1282825742.db2.gz	JAMLLWBXSFIBSK-UHFFFAOYSA-N	-2	3	368.375	0.507	20	5		FCBDHL
CC(C)(CCC(=O)[N-]S(=O)(=O)c1cccc(-c2nn[n-]n2)c1)[N+](=O)[O-]	ZINC001589272302	1282825750	/nfs/dbraw/zinc/82/57/50/1282825750.db2.gz	JAMLLWBXSFIBSK-UHFFFAOYSA-N	-2	3	368.375	0.507	20	5		FCBDHL
CC=C(CC)C(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001590349789	1283493297	/nfs/dbraw/zinc/49/32/97/1283493297.db2.gz	MPWVIGGZJKTUFM-BAQGIRSFSA-N	-2	3	366.359	0.936	20	5		FCBDHL
CS[C@H](C)C(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001591686913	1284828880	/nfs/dbraw/zinc/82/88/80/1284828880.db2.gz	OHFNHBFVQGQWTH-ZCFIWIBFSA-N	-2	3	372.388	0.331	20	5		FCBDHL
O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)[N-]Oc1cccc(-c2nnn[n-]2)c1	ZINC001592937167	1285825540	/nfs/dbraw/zinc/82/55/40/1285825540.db2.gz	JQRGPAYZEZACOI-UHFFFAOYSA-N	-2	3	357.286	0.047	20	5		FCBDHL
O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)[N-]Oc1cccc(-c2nn[n-]n2)c1	ZINC001592937167	1285825543	/nfs/dbraw/zinc/82/55/43/1285825543.db2.gz	JQRGPAYZEZACOI-UHFFFAOYSA-N	-2	3	357.286	0.047	20	5		FCBDHL
CN(CC[N-]S(=O)(=O)c1cc(Cl)c([N+](=O)[O-])cc1F)CC(=O)[O-]	ZINC001610119359	1289381319	/nfs/dbraw/zinc/38/13/19/1289381319.db2.gz	WBRDBDULTBQGBX-UHFFFAOYSA-N	-2	3	369.758	0.682	20	5		FCBDHL
O=[N+]([O-])c1c([O-])cc([O-])cc1O[C@H](C[n+]1ccccc1)CS(=O)(=O)[O-]	ZINC001228975232	857241423	/nfs/dbraw/zinc/24/14/23/857241423.db2.gz	YRGRBHVYJOJRHH-LLVKDONJSA-O	-2	3	371.347	0.629	20	5		FCBDHL
COC(=O)C1CC2(C1)CN(c1cc[n-]c(=O)c1[N+](=O)[O-])C[C@H]2C(=O)[O-]	ZINC001593826610	955107911	/nfs/dbraw/zinc/10/79/11/955107911.db2.gz	ULDGZQXNYPIADF-WWNCPBBQSA-N	-2	3	351.315	0.786	20	5		FCBDHL
C[C@@](O)(C[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC001603262710	972448146	/nfs/dbraw/zinc/44/81/46/972448146.db2.gz	BQMKDFOCKJCPBU-SNVBAGLBSA-N	-2	3	372.277	0.728	20	5		FCBDHL
CC[C@H](C)[C@H](NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000296703253	214360239	/nfs/dbraw/zinc/36/02/39/214360239.db2.gz	CEYYPGFTUXQZOZ-ZANVPECISA-N	-2	3	373.387	0.489	20	5		FCBDHL
C[C@@](CO)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)CC(=O)[O-]	ZINC000275636262	212064784	/nfs/dbraw/zinc/06/47/84/212064784.db2.gz	MQLGRTLQTJMNBL-LBPRGKRZSA-N	-2	3	350.324	0.486	20	5		FCBDHL
O=C(c1ccccc1[O-])N1CCN(C(=O)c2cc([N+](=O)[O-])c[n-]c2=O)CC1	ZINC000436851695	248052753	/nfs/dbraw/zinc/05/27/53/248052753.db2.gz	GBGXJMDZLOIYFF-UHFFFAOYSA-N	-2	3	372.337	0.999	20	5		FCBDHL
Cc1cc(Cl)c(S(=O)(=O)[N-]CC[C@H](O)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000274870980	488739261	/nfs/dbraw/zinc/73/92/61/488739261.db2.gz	AQAUGVUGGRBSJP-VIFPVBQESA-N	-2	3	352.752	0.671	20	5		FCBDHL
CCOC(=O)CC[C@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)[O-]	ZINC000278243884	488807277	/nfs/dbraw/zinc/80/72/77/488807277.db2.gz	WGZANDAJMRRRQS-JTQLQIEISA-N	-2	3	374.371	0.978	20	5		FCBDHL
CO[C@H]1COCC[C@H]1C[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000570401408	491238439	/nfs/dbraw/zinc/23/84/39/491238439.db2.gz	RRQKPZNCFNDTRU-ONGXEEELSA-N	-2	3	374.371	0.623	20	5		FCBDHL
CC[C@H](C)N(CC(=O)[O-])C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000455815380	489600596	/nfs/dbraw/zinc/60/05/96/489600596.db2.gz	UBZHAMSGFKEZKK-JTQLQIEISA-N	-2	3	373.387	0.585	20	5		FCBDHL
COC(=O)CC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C(=O)[O-]	ZINC000547881785	490375568	/nfs/dbraw/zinc/37/55/68/490375568.db2.gz	PKKGIMLJQOJWNW-ZETCQYMHSA-N	-2	3	366.373	0.649	20	5		FCBDHL
Cc1cnn(C[C@@H]([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C(=O)[O-])c1	ZINC000547881510	490375643	/nfs/dbraw/zinc/37/56/43/490375643.db2.gz	HSVFHVNAHDDFSC-LLVKDONJSA-N	-2	3	368.371	0.840	20	5		FCBDHL
Cc1nc(S(=O)(=O)[N-][C@@H](Cc2ccccc2[N+](=O)[O-])C(=O)[O-])cn1C	ZINC000548224552	490444244	/nfs/dbraw/zinc/44/42/44/490444244.db2.gz	BSTGQOVOQKOWRR-NSHDSACASA-N	-2	3	368.371	0.611	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@@H]2CCOC2)cc1C	ZINC000548530605	490496749	/nfs/dbraw/zinc/49/67/49/490496749.db2.gz	RDAHBXPRXDKJNS-ZWNOBZJWSA-N	-2	3	358.372	0.980	20	5		FCBDHL
O=C([O-])C1(NC(=O)C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCCC1	ZINC000565876593	491404495	/nfs/dbraw/zinc/40/44/95/491404495.db2.gz	NTRLJFDAWVYIDQ-UHFFFAOYSA-N	-2	3	371.371	0.387	20	5		FCBDHL
CN1CC[C@H](C[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])CC1=O	ZINC000568007713	491546709	/nfs/dbraw/zinc/54/67/09/491546709.db2.gz	YCFCCQWHJDTPTQ-VIFPVBQESA-N	-2	3	371.371	0.440	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]CCC2(O)CCOCC2)c1[N+](=O)[O-]	ZINC000576112690	491582533	/nfs/dbraw/zinc/58/25/33/491582533.db2.gz	QEHWQZZJAXIUBW-UHFFFAOYSA-N	-2	3	374.371	0.503	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]CCN2CC=CCC2)c([N+](=O)[O-])c1	ZINC000577378131	491616744	/nfs/dbraw/zinc/61/67/44/491616744.db2.gz	LHYVPQPZRPISSR-UHFFFAOYSA-N	-2	3	355.372	0.833	20	5		FCBDHL
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])[C@@H]1OC	ZINC000583087937	491837655	/nfs/dbraw/zinc/83/76/55/491837655.db2.gz	NVRPRWAXPMLCCE-XWIASGKRSA-N	-2	3	374.371	0.764	20	5		FCBDHL
CCC[C@@H](O)[C@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC)C(=O)[O-]	ZINC000619470673	492264279	/nfs/dbraw/zinc/26/42/79/492264279.db2.gz	BEYKZIBWVCACKB-KOLCDFICSA-N	-2	3	362.360	0.496	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCOC[C@@H]2CCOC2)c1	ZINC000593313004	546965802	/nfs/dbraw/zinc/96/58/02/546965802.db2.gz	SINKOXRPFXFTMS-SNVBAGLBSA-N	-2	3	374.371	0.624	20	5		FCBDHL
COC[C@](C)(O)CC[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000593311949	546965818	/nfs/dbraw/zinc/96/58/18/546965818.db2.gz	ACJVNDHJGLHTNR-CYBMUJFWSA-N	-2	3	362.360	0.359	20	5		FCBDHL
O=C([O-])[C@@H](O)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1Br	ZINC000776541006	668270069	/nfs/dbraw/zinc/27/00/69/668270069.db2.gz	YXYCOAOOGJYKQV-ZETCQYMHSA-N	-2	3	369.149	0.081	20	5		FCBDHL
CC=C(CC)C(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001590349792	1283494254	/nfs/dbraw/zinc/49/42/54/1283494254.db2.gz	MPWVIGGZJKTUFM-FPYGCLRLSA-N	-2	3	366.359	0.936	20	5		FCBDHL
O=c1[n-]c([C@H]2CCCN(c3ccc(-c4nnn[n-]4)cc3[N+](=O)[O-])C2)n[nH]1	ZINC001593497743	1286180719	/nfs/dbraw/zinc/18/07/19/1286180719.db2.gz	KTGWGAFWGQLUFZ-VIFPVBQESA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=c1[n-]c([C@H]2CCCN(c3ccc(-c4nn[n-]n4)cc3[N+](=O)[O-])C2)n[nH]1	ZINC001593497743	1286180722	/nfs/dbraw/zinc/18/07/22/1286180722.db2.gz	KTGWGAFWGQLUFZ-VIFPVBQESA-N	-2	3	357.334	0.983	20	5		FCBDHL
Cc1cc(S(=O)(=O)[N-]C[C@H]2CCO[C@H]2C(=O)[O-])c([N+](=O)[O-])s1	ZINC001600299946	1286472522	/nfs/dbraw/zinc/47/25/22/1286472522.db2.gz	PKRUNCFJBNSFCI-VXNVDRBHSA-N	-2	3	350.374	0.733	20	5		FCBDHL
C[C@@H](CN(C)C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000263123589	209701592	/nfs/dbraw/zinc/70/15/92/209701592.db2.gz	FKETVXGXWKIUPS-VIFPVBQESA-N	-2	3	359.360	0.052	20	5		FCBDHL
C[C@H](CN(C)C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000263123588	209700922	/nfs/dbraw/zinc/70/09/22/209700922.db2.gz	FKETVXGXWKIUPS-SECBINFHSA-N	-2	3	359.360	0.052	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@](C)(CO)CC(=O)[O-])cc1C	ZINC000275749775	212083889	/nfs/dbraw/zinc/08/38/89/212083889.db2.gz	QRGCIDDUHFAGGH-CQSZACIVSA-N	-2	3	360.388	0.963	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@](C)(CO)CC(=O)[O-]	ZINC000275627991	212063794	/nfs/dbraw/zinc/06/37/94/212063794.db2.gz	LXTCLGZTAQWOBF-ZDUSSCGKSA-N	-2	3	362.360	0.355	20	5		FCBDHL
CCC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC)C(=O)[O-]	ZINC000417479041	245701472	/nfs/dbraw/zinc/70/14/72/245701472.db2.gz	ANSVFEDHGRJTKN-JTQLQIEISA-N	-2	3	360.344	0.913	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CC[C@H](O)C(=O)[O-])c1	ZINC000274887523	488741090	/nfs/dbraw/zinc/74/10/90/488741090.db2.gz	FGLAJBHREITRGN-QMMMGPOBSA-N	-2	3	352.752	0.671	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@H](CC(N)=O)C(=O)[O-])c1	ZINC000274903562	488742392	/nfs/dbraw/zinc/74/23/92/488742392.db2.gz	IRZWYQLKIGHQST-LURJTMIESA-N	-2	3	365.751	0.164	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)CCC(=O)[O-]	ZINC000274946838	488747019	/nfs/dbraw/zinc/74/70/19/488747019.db2.gz	FWGSBNXPUHUTRA-QMMMGPOBSA-N	-2	3	360.344	0.913	20	5		FCBDHL
O=C([O-])C[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000275027328	488754756	/nfs/dbraw/zinc/75/47/56/488754756.db2.gz	STQVINXDVPUCPO-ZCFIWIBFSA-N	-3	3	366.735	0.702	20	5		FCBDHL
CCC(=O)C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(=O)[O-]	ZINC000275076652	488759225	/nfs/dbraw/zinc/75/92/25/488759225.db2.gz	XTQKCGPLXKDUSA-SNVBAGLBSA-N	-2	3	360.344	0.704	20	5		FCBDHL
CO[C@H]1COCC[C@@H]1C[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414331805	489495999	/nfs/dbraw/zinc/49/59/99/489495999.db2.gz	QZNJTSQLQUVCPL-PWSUYJOCSA-N	-2	3	374.371	0.623	20	5		FCBDHL
C[C@H](CS(C)(=O)=O)[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000570850114	491269071	/nfs/dbraw/zinc/26/90/71/491269071.db2.gz	PPYIMPROIOZTHE-SSDOTTSWSA-N	-2	3	366.373	0.004	20	5		FCBDHL
Cn1c2cc([O-])c(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)cc2n(C)c1=O	ZINC000461618758	489922063	/nfs/dbraw/zinc/92/20/63/489922063.db2.gz	KOAVUZQEFATVRE-UHFFFAOYSA-N	-2	3	359.298	0.844	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-][C@@H]2CCn3ccnc3C2)c1[N+](=O)[O-]	ZINC000521882505	490306319	/nfs/dbraw/zinc/30/63/19/490306319.db2.gz	JJSWCPYNZRKDAA-SECBINFHSA-N	-2	3	366.355	0.783	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C(=O)[O-])C1CCC1	ZINC000547904850	490383177	/nfs/dbraw/zinc/38/31/77/490383177.db2.gz	XMCHHYSDXVIDSR-GFCCVEGCSA-N	-2	3	372.355	0.913	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C[C@H]1CCOC1)C(=O)[O-]	ZINC000548203672	490437272	/nfs/dbraw/zinc/43/72/72/490437272.db2.gz	VKNLFKVFPYHHSS-KOLCDFICSA-N	-2	3	374.371	0.762	20	5		FCBDHL
COC(=O)CCCC[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000571767114	491327929	/nfs/dbraw/zinc/32/79/29/491327929.db2.gz	UTTFVXUXEBHZOB-UHFFFAOYSA-N	-2	3	360.344	0.915	20	5		FCBDHL
C[C@@](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)(CC(=O)[O-])C(=O)[O-]	ZINC000548589005	490513625	/nfs/dbraw/zinc/51/36/25/490513625.db2.gz	YTBVICMHVKXCAF-LBPRGKRZSA-N	-3	3	364.307	0.578	20	5		FCBDHL
CC[C@@](C)([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)[O-]	ZINC000564917605	491336411	/nfs/dbraw/zinc/33/64/11/491336411.db2.gz	YTUOOGQNCJJWKS-CYBMUJFWSA-N	-2	3	360.344	0.898	20	5		FCBDHL
NC(=O)[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000516775039	490877644	/nfs/dbraw/zinc/87/76/44/490877644.db2.gz	APMCJFNADWYEHQ-BDAKNGLRSA-N	-2	3	357.344	0.225	20	5		FCBDHL
C[C@H]([N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-])C(=O)NC(C)(C)C	ZINC000576164199	491587766	/nfs/dbraw/zinc/58/77/66/491587766.db2.gz	OPQNLQZTPAHIHF-QMMMGPOBSA-N	-2	3	373.387	0.875	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C(=O)[O-])[C@H]1CCCOC1	ZINC000569232266	491644628	/nfs/dbraw/zinc/64/46/28/491644628.db2.gz	QXTAENHELGWRSO-ZANVPECISA-N	-2	3	374.371	0.762	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@@H]1CCCOC1	ZINC000577722065	491645728	/nfs/dbraw/zinc/64/57/28/491645728.db2.gz	FSNCENLVWYNCDN-NOZJJQNGSA-N	-2	3	374.371	0.762	20	5		FCBDHL
C[C@@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-])C(=O)NC(C)(C)C	ZINC000577955709	491665749	/nfs/dbraw/zinc/66/57/49/491665749.db2.gz	FASDJLFKKMZQOR-MRVPVSSYSA-N	-2	3	373.387	0.875	20	5		FCBDHL
NC(=O)CC1([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])CCC1	ZINC000580896817	491751017	/nfs/dbraw/zinc/75/10/17/491751017.db2.gz	PYCRDTNKBLURSC-UHFFFAOYSA-N	-2	3	357.344	0.369	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]CC(=O)N2CCCCC2)c([N+](=O)[O-])c1	ZINC000581373086	491770232	/nfs/dbraw/zinc/77/02/32/491770232.db2.gz	IZYGALVMDSTKSH-UHFFFAOYSA-N	-2	3	371.371	0.584	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]CCOC[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000593312799	546965352	/nfs/dbraw/zinc/96/53/52/546965352.db2.gz	IXDVRWZDRSEXTD-JTQLQIEISA-N	-2	3	374.371	0.624	20	5		FCBDHL
CC(C)[C@H](CNC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000594459837	546998929	/nfs/dbraw/zinc/99/89/29/546998929.db2.gz	GZUQFWJVKCMMHK-JTQLQIEISA-N	-2	3	373.387	0.346	20	5		FCBDHL
COc1c(F)cc(S(=O)(=O)[N-][C@@H](CCF)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000594572812	547001323	/nfs/dbraw/zinc/00/13/23/547001323.db2.gz	CSRWQCKIFAFMGA-QMMMGPOBSA-N	-2	3	354.287	0.834	20	5		FCBDHL
CCOC(=O)c1cc(C(=O)[N-]c2n[nH]c(CC(=O)[O-])n2)cc([N+](=O)[O-])c1	ZINC000737148799	600536109	/nfs/dbraw/zinc/53/61/09/600536109.db2.gz	PQJGQTUOWADEHV-UHFFFAOYSA-N	-2	3	363.286	0.769	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1n[nH]cc1-c1nnn[n-]1	ZINC000826293569	607461957	/nfs/dbraw/zinc/46/19/57/607461957.db2.gz	UFSNWLYTQVOYDX-UHFFFAOYSA-N	-2	3	350.320	0.607	20	5		FCBDHL
O=C(CNc1ccc(-c2nnn[n-]2)cn1)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000826414274	608166824	/nfs/dbraw/zinc/16/68/24/608166824.db2.gz	NMPOIOGTRVNMSV-UHFFFAOYSA-N	-2	3	356.302	0.926	20	5		FCBDHL
O=C(CNc1ccc(-c2nn[n-]n2)cn1)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000826414274	608166825	/nfs/dbraw/zinc/16/68/25/608166825.db2.gz	NMPOIOGTRVNMSV-UHFFFAOYSA-N	-2	3	356.302	0.926	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1n[nH]cc1-c1nnn[n-]1	ZINC000826212458	608307129	/nfs/dbraw/zinc/30/71/29/608307129.db2.gz	RDRIYHQTQCAHNF-UHFFFAOYSA-N	-2	3	366.319	0.307	20	5		FCBDHL
O=C(NCCNc1ccc(-c2nn[n-]n2)cn1)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000826438141	609147112	/nfs/dbraw/zinc/14/71/12/609147112.db2.gz	OOMVLDDDBYRZMA-UHFFFAOYSA-N	-2	3	370.329	0.717	20	5		FCBDHL
CCO[N-]C(=O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000846003824	671065396	/nfs/dbraw/zinc/06/53/96/671065396.db2.gz	PUFKMIHCTXPXCI-UHFFFAOYSA-N	-2	3	371.293	0.960	20	5		FCBDHL
CC(C)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@@H](O)C(=O)[O-]	ZINC001603685260	1287469263	/nfs/dbraw/zinc/46/92/63/1287469263.db2.gz	AAIHKTBOWKDMIE-VIFPVBQESA-N	-2	3	352.752	0.751	20	5		FCBDHL
O=c1[n-]c([C@@H]2CCCN(c3ccc([N+](=O)[O-])cc3-c3nnn[n-]3)C2)n[nH]1	ZINC001593497924	1286180794	/nfs/dbraw/zinc/18/07/94/1286180794.db2.gz	NQKPXYPCAUMDOB-MRVPVSSYSA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=c1[n-]c([C@@H]2CCCN(c3ccc([N+](=O)[O-])cc3-c3nn[n-]n3)C2)n[nH]1	ZINC001593497924	1286180797	/nfs/dbraw/zinc/18/07/97/1286180797.db2.gz	NQKPXYPCAUMDOB-MRVPVSSYSA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=C([O-])[C@@H]1OCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC001602203532	1286968887	/nfs/dbraw/zinc/96/88/87/1286968887.db2.gz	KQFNKQRXSYPVCE-WCBMZHEXSA-N	-2	3	350.736	0.769	20	5		FCBDHL
Cn1cc([N+](=O)[O-])c(S(=O)(=O)[N-]Cc2ccc(-c3nnn[n-]3)s2)n1	ZINC001606246225	1288232795	/nfs/dbraw/zinc/23/27/95/1288232795.db2.gz	HDZNCVBUWLSRTC-UHFFFAOYSA-N	-2	3	370.376	0.048	20	5		FCBDHL
Cn1cc([N+](=O)[O-])c(S(=O)(=O)[N-]Cc2ccc(-c3nn[n-]n3)s2)n1	ZINC001606246225	1288232799	/nfs/dbraw/zinc/23/27/99/1288232799.db2.gz	HDZNCVBUWLSRTC-UHFFFAOYSA-N	-2	3	370.376	0.048	20	5		FCBDHL
O=C([O-])[C@H](CC1CC1)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000285303257	213320812	/nfs/dbraw/zinc/32/08/12/213320812.db2.gz	YJNGZHSRTNVZAH-VIFPVBQESA-N	-2	3	372.355	0.898	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCn2cc(C(=O)[O-])nn2)c1C	ZINC000277324735	212351548	/nfs/dbraw/zinc/35/15/48/212351548.db2.gz	MKOYOAKZCYDXAL-UHFFFAOYSA-N	-2	3	369.359	0.480	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](CC(F)F)C(=O)[O-]	ZINC000275310060	212003968	/nfs/dbraw/zinc/00/39/68/212003968.db2.gz	REWBQRMFTUQVDP-ZETCQYMHSA-N	-2	3	354.287	0.990	20	5		FCBDHL
O=C([O-])[C@H]1CCCCN1C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000263382662	488610821	/nfs/dbraw/zinc/61/08/21/488610821.db2.gz	BYUUOTWTAWMOCH-LLVKDONJSA-N	-2	3	371.371	0.339	20	5		FCBDHL
C[C@H](C(=O)[O-])N(C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C1CC1	ZINC000263556386	488614655	/nfs/dbraw/zinc/61/46/55/488614655.db2.gz	OMPGZWJVGMZNHJ-SECBINFHSA-N	-2	3	371.371	0.337	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-]C[C@H](CC(=O)[O-])C(=O)[O-])c([N+](=O)[O-])c1	ZINC000275042808	488756019	/nfs/dbraw/zinc/75/60/19/488756019.db2.gz	VWNHSGHOILURBR-ZETCQYMHSA-N	-3	3	362.316	0.057	20	5		FCBDHL
CC[C@@H](C)N(CC(=O)[O-])C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000455815382	489600736	/nfs/dbraw/zinc/60/07/36/489600736.db2.gz	UBZHAMSGFKEZKK-SNVBAGLBSA-N	-2	3	373.387	0.585	20	5		FCBDHL
NC(=O)CC1(C[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1	ZINC000421815717	490107622	/nfs/dbraw/zinc/10/76/22/490107622.db2.gz	VLNOJDUUKYQBGW-UHFFFAOYSA-N	-2	3	357.344	0.227	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C(=O)[O-])[C@H]2CCOC2)c1C	ZINC000547876263	490373786	/nfs/dbraw/zinc/37/37/86/490373786.db2.gz	YOUGNKLTOFSJDX-JQWIXIFHSA-N	-2	3	358.372	0.980	20	5		FCBDHL
COc1cc(S(=O)(=O)[N-][C@@H](CC(F)F)C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000547881369	490376080	/nfs/dbraw/zinc/37/60/80/490376080.db2.gz	BVMWQJLZXIQAPW-ZETCQYMHSA-N	-2	3	354.287	0.990	20	5		FCBDHL
Cc1ccc(S(=O)(=O)[N-]Cc2cn(CC(=O)[O-])nn2)c([N+](=O)[O-])c1	ZINC000547911244	490384891	/nfs/dbraw/zinc/38/48/91/490384891.db2.gz	JKPZJEAAHRZSAG-UHFFFAOYSA-N	-2	3	355.332	0.058	20	5		FCBDHL
Cc1ccc(S(=O)(=O)[N-][C@@H](C(=O)[O-])c2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000548200878	490435787	/nfs/dbraw/zinc/43/57/87/490435787.db2.gz	UMHFLTGNQVOYSF-GFCCVEGCSA-N	-2	3	354.344	0.741	20	5		FCBDHL
CCC[C@H](O)[C@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000548593238	490515140	/nfs/dbraw/zinc/51/51/40/490515140.db2.gz	ZBXIAXRRJGBOFQ-JQWIXIFHSA-N	-2	3	362.360	0.496	20	5		FCBDHL
CCn1cc(S(=O)(=O)[N-]c2cccc(-c3nnn[n-]3)c2)c([N+](=O)[O-])n1	ZINC000486895086	490679788	/nfs/dbraw/zinc/67/97/88/490679788.db2.gz	NWIVRVUKTFXXIR-UHFFFAOYSA-N	-2	3	364.347	0.792	20	5		FCBDHL
CCn1cc(S(=O)(=O)[N-]c2cccc(-c3nn[n-]n3)c2)c([N+](=O)[O-])n1	ZINC000486895086	490679796	/nfs/dbraw/zinc/67/97/96/490679796.db2.gz	NWIVRVUKTFXXIR-UHFFFAOYSA-N	-2	3	364.347	0.792	20	5		FCBDHL
COCCOCCC[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000565061275	491349367	/nfs/dbraw/zinc/34/93/67/491349367.db2.gz	AIFZJIBDSJOWKF-UHFFFAOYSA-N	-2	3	362.360	0.624	20	5		FCBDHL
CN(C)C(=O)C(C)(C)[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000565061307	491349448	/nfs/dbraw/zinc/34/94/48/491349448.db2.gz	BKDJHVXDLLGQPC-UHFFFAOYSA-N	-2	3	359.360	0.438	20	5		FCBDHL
C[C@@]1(C[C@@H]2CCCN2C(=O)c2cc([O-])cc([N+](=O)[O-])c2)NC(=O)[N-]C1=O	ZINC000557608884	491386888	/nfs/dbraw/zinc/38/68/88/491386888.db2.gz	JEZZCRZWPQHHNG-QFYYESIMSA-N	-2	3	362.342	0.893	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@H](CCCC(=O)[O-])C(=O)[O-])cc1[N+](=O)[O-]	ZINC000567431143	491506481	/nfs/dbraw/zinc/50/64/81/491506481.db2.gz	HZYYNQYNOMOATE-SSDOTTSWSA-N	-3	3	366.373	0.951	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]CCOCC(F)F)c([N+](=O)[O-])c1	ZINC000574993435	491532619	/nfs/dbraw/zinc/53/26/19/491532619.db2.gz	SREYOISXQQHYSK-UHFFFAOYSA-N	-2	3	354.287	0.853	20	5		FCBDHL
CN(C)C(=O)C(C)(C)[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000591256289	491800285	/nfs/dbraw/zinc/80/02/85/491800285.db2.gz	DHOTWLMYMBFHFN-UHFFFAOYSA-N	-2	3	359.360	0.438	20	5		FCBDHL
CC[C@@H](C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)[O-]	ZINC000614343556	492025168	/nfs/dbraw/zinc/02/51/68/492025168.db2.gz	LSAJKGBFJKEUPY-QMMMGPOBSA-N	-2	3	360.344	0.755	20	5		FCBDHL
CC[C@@H](C[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-])C(=O)OC	ZINC000592446149	546950840	/nfs/dbraw/zinc/95/08/40/546950840.db2.gz	WZNOLFGSDHXSSU-QMMMGPOBSA-N	-2	3	360.344	0.771	20	5		FCBDHL
Cc1nc([C@H](C)[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])n[nH]1	ZINC000593310971	546966523	/nfs/dbraw/zinc/96/65/23/546966523.db2.gz	OKPYVJKLICQUJR-LURJTMIESA-N	-2	3	355.332	0.759	20	5		FCBDHL
Cc1nnc([C@H](C)[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])[nH]1	ZINC000593310971	546966526	/nfs/dbraw/zinc/96/65/26/546966526.db2.gz	OKPYVJKLICQUJR-LURJTMIESA-N	-2	3	355.332	0.759	20	5		FCBDHL
Cc1nc([C@H](C)[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])n[nH]1	ZINC000593310987	546967110	/nfs/dbraw/zinc/96/71/10/546967110.db2.gz	PIICXMNMQPZLNS-LURJTMIESA-N	-2	3	355.332	0.759	20	5		FCBDHL
Cc1nnc([C@H](C)[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])[nH]1	ZINC000593310987	546967112	/nfs/dbraw/zinc/96/71/12/546967112.db2.gz	PIICXMNMQPZLNS-LURJTMIESA-N	-2	3	355.332	0.759	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](CCF)C(=O)[O-]	ZINC000594573621	547001647	/nfs/dbraw/zinc/00/16/47/547001647.db2.gz	PAQRZBREDSZZCK-VIFPVBQESA-N	-2	3	364.307	0.473	20	5		FCBDHL
Cn1ccc([N-]S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])n1	ZINC000737610928	599040316	/nfs/dbraw/zinc/04/03/16/599040316.db2.gz	AKVLEOYBWGHFLB-UHFFFAOYSA-N	-2	3	350.320	0.309	20	5		FCBDHL
Cn1ccc([N-]S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])n1	ZINC000737610928	599040319	/nfs/dbraw/zinc/04/03/19/599040319.db2.gz	AKVLEOYBWGHFLB-UHFFFAOYSA-N	-2	3	350.320	0.309	20	5		FCBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]c1n[nH]cc1-c1nnn[n-]1	ZINC000826304597	608305370	/nfs/dbraw/zinc/30/53/70/608305370.db2.gz	RCRQDTUXCWRGCP-UHFFFAOYSA-N	-2	3	350.320	0.607	20	5		FCBDHL
CN(C)C(=O)Cn1ccc([N-]c2nccc(-c3nnn[n-]3)c2[N+](=O)[O-])n1	ZINC000825845373	609550008	/nfs/dbraw/zinc/55/00/08/609550008.db2.gz	GGECKLHUUAJUAP-UHFFFAOYSA-N	-2	3	358.322	0.198	20	5		FCBDHL
Cc1[nH]nc([N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1-c1nnn[n-]1	ZINC000826292914	669489981	/nfs/dbraw/zinc/48/99/81/669489981.db2.gz	RVVNPKJROGXSSY-UHFFFAOYSA-N	-2	3	364.347	0.916	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCCCNC2=O)c1	ZINC000840889824	670524126	/nfs/dbraw/zinc/52/41/26/670524126.db2.gz	OFWWRXNCEPGMNJ-VIFPVBQESA-N	-2	3	357.344	0.240	20	5		FCBDHL
Cc1cc(S(=O)(=O)[N-]C[C@H](C(=O)[O-])[C@H]2CCOC2)c([N+](=O)[O-])s1	ZINC001600298769	1286472602	/nfs/dbraw/zinc/47/26/02/1286472602.db2.gz	BLXLTFOAYFYLHY-IUCAKERBSA-N	-2	3	364.401	0.980	20	5		FCBDHL
CNC(=O)Cn1nc([N-]c2ncc(-c3nn[n-]n3)cc2[N+](=O)[O-])cc1C	ZINC001604883562	1287807212	/nfs/dbraw/zinc/80/72/12/1287807212.db2.gz	UIYOXIJMPCHRNK-UHFFFAOYSA-N	-2	3	358.322	0.164	20	5		FCBDHL
O=c1[n-]c(C2CCN(c3cccc(-c4nnn[n-]4)c3[N+](=O)[O-])CC2)n[nH]1	ZINC001607090531	1288656936	/nfs/dbraw/zinc/65/69/36/1288656936.db2.gz	MEVJFQVAOLRYDE-UHFFFAOYSA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=C([O-])[C@@H]1CC(=O)N(C2CCN(c3cc[n-]c(=O)c3[N+](=O)[O-])CC2)C1	ZINC001594897612	954581419	/nfs/dbraw/zinc/58/14/19/954581419.db2.gz	AJKOHQKMABVXCB-SECBINFHSA-N	-2	3	350.331	0.597	20	5		FCBDHL
O=C([O-])C1CC2(C1)CC[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)O2	ZINC001594907293	954686009	/nfs/dbraw/zinc/68/60/09/954686009.db2.gz	LJPQDUSCUUXIQP-GOSTWBGLSA-N	-2	3	371.371	0.681	20	5		FCBDHL
CC(C)[C@H](NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000296701011	214360596	/nfs/dbraw/zinc/36/05/96/214360596.db2.gz	BVTZVKBSVPWIPN-LBPRGKRZSA-N	-2	3	359.360	0.099	20	5		FCBDHL
Cc1nc([C@H](C)[N-]S(=O)(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)n[nH]1	ZINC000285384753	213334789	/nfs/dbraw/zinc/33/47/89/213334789.db2.gz	JCNCJBPYDGZKQN-LURJTMIESA-N	-2	3	355.332	0.759	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](Cc2c[nH]cn2)C(=O)[O-])c1[N+](=O)[O-]	ZINC000277305918	212348535	/nfs/dbraw/zinc/34/85/35/212348535.db2.gz	SLXUOHOJGRIJEZ-NSHDSACASA-N	-2	3	368.371	0.909	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCn2cc(C(=O)[O-])nn2)cc1C	ZINC000277176695	212336229	/nfs/dbraw/zinc/33/62/29/212336229.db2.gz	CFMNTDDWHBTTQX-UHFFFAOYSA-N	-2	3	369.359	0.480	20	5		FCBDHL
C[C@@](CO)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)CC(=O)[O-]	ZINC000275639247	212065810	/nfs/dbraw/zinc/06/58/10/212065810.db2.gz	NAHHOZNTZXLUHB-LBPRGKRZSA-N	-2	3	366.779	1.000	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@](C)(CO)CC(=O)[O-]	ZINC000275552105	212049156	/nfs/dbraw/zinc/04/91/56/212049156.db2.gz	DXQRCDUFAJALAB-ZDUSSCGKSA-N	-2	3	362.360	0.355	20	5		FCBDHL
O=C([O-])CC[C@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000319848855	488898886	/nfs/dbraw/zinc/89/88/86/488898886.db2.gz	NCWUYCBPAONHCG-ZETCQYMHSA-N	-3	3	366.735	0.845	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1(C(=O)[O-])CCOCC1	ZINC000325358792	488909728	/nfs/dbraw/zinc/90/97/28/488909728.db2.gz	HBFGWKOIOXKHME-UHFFFAOYSA-N	-2	3	360.344	0.516	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-]C2(C(=O)[O-])CCOCC2)c([N+](=O)[O-])c1	ZINC000325405062	488909943	/nfs/dbraw/zinc/90/99/43/488909943.db2.gz	RDLJLDDAFXAWFR-UHFFFAOYSA-N	-2	3	360.344	0.516	20	5		FCBDHL
Cc1noc(CC[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])n1	ZINC000569815175	491194756	/nfs/dbraw/zinc/19/47/56/491194756.db2.gz	PFCMVMANRYSGCR-UHFFFAOYSA-N	-2	3	356.316	0.505	20	5		FCBDHL
O=C([O-])[C@H]1CCCN(C(=O)C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000263226825	488606616	/nfs/dbraw/zinc/60/66/16/488606616.db2.gz	AMORFPJBYGFBJI-JTQLQIEISA-N	-2	3	371.371	0.196	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H](CC(N)=O)C(=O)[O-])c1	ZINC000274903563	488742382	/nfs/dbraw/zinc/74/23/82/488742382.db2.gz	IRZWYQLKIGHQST-ZCFIWIBFSA-N	-2	3	365.751	0.164	20	5		FCBDHL
C[C@H](C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)CC(=O)[O-]	ZINC000274946843	488746995	/nfs/dbraw/zinc/74/69/95/488746995.db2.gz	FWJOSKFKXUHAQJ-QMMMGPOBSA-N	-2	3	360.344	0.755	20	5		FCBDHL
O=C([O-])C1([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CCC1	ZINC000282348107	489156284	/nfs/dbraw/zinc/15/62/84/489156284.db2.gz	AMFOTBGQIAEVKA-UHFFFAOYSA-N	-2	3	358.328	0.652	20	5		FCBDHL
Cc1noc(C)c1S(=O)(=O)[N-]CC(=O)Nc1ccc([O-])c([N+](=O)[O-])c1	ZINC000555078952	491237952	/nfs/dbraw/zinc/23/79/52/491237952.db2.gz	DKZDNZAACGYHNJ-UHFFFAOYSA-N	-2	3	370.343	0.822	20	5		FCBDHL
CCOC(=O)CCC[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414321418	489496357	/nfs/dbraw/zinc/49/63/57/489496357.db2.gz	QOHGULUGPUAUFL-UHFFFAOYSA-N	-2	3	360.344	0.915	20	5		FCBDHL
COC(=O)Cc1nnc([N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])[n-]1	ZINC000414450758	489499058	/nfs/dbraw/zinc/49/90/58/489499058.db2.gz	HIASAPKXEFCTIR-UHFFFAOYSA-N	-2	3	369.359	0.846	20	5		FCBDHL
COC(=O)Cc1nnc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)[n-]1	ZINC000460540399	489871844	/nfs/dbraw/zinc/87/18/44/489871844.db2.gz	UBAHTIPFJMBQMO-UHFFFAOYSA-N	-2	3	355.332	0.538	20	5		FCBDHL
C[C@@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)[C@@H](C)C(=O)[O-]	ZINC000521824733	490299845	/nfs/dbraw/zinc/29/98/45/490299845.db2.gz	GLNYATUOMUAKGF-HTQZYQBOSA-N	-2	3	360.344	0.754	20	5		FCBDHL
O=C([O-])[C@H](CO)[N-]S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1	ZINC000547875361	490372216	/nfs/dbraw/zinc/37/22/16/490372216.db2.gz	FCFHJSULQSAGRR-QMMMGPOBSA-N	-2	3	369.149	0.081	20	5		FCBDHL
Cc1cc(=O)n2[n-]c([N-]S(=O)(=O)c3ccc([N+](=O)[O-])cc3F)nc2n1	ZINC000484437678	490428211	/nfs/dbraw/zinc/42/82/11/490428211.db2.gz	AZXRRRJPHKFBGU-UHFFFAOYSA-N	-2	3	368.306	0.574	20	5		FCBDHL
C[C@H]([N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-])c1nncn1C	ZINC000565061937	491349718	/nfs/dbraw/zinc/34/97/18/491349718.db2.gz	QCJXMCNXFFANAM-ZETCQYMHSA-N	-2	3	355.332	0.461	20	5		FCBDHL
Cc1c([C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C(=O)[O-])cnn1C	ZINC000530488022	490908912	/nfs/dbraw/zinc/90/89/12/490908912.db2.gz	VOUZYDYDCYMPJD-GFCCVEGCSA-N	-2	3	354.344	0.741	20	5		FCBDHL
C[C@@H](CO[C@H]1CCOC1)[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000519660100	490982952	/nfs/dbraw/zinc/98/29/52/490982952.db2.gz	WEJUKVQCLBSZJC-ONGXEEELSA-N	-2	3	374.371	0.765	20	5		FCBDHL
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])[C@H]1OC	ZINC000583087934	491837650	/nfs/dbraw/zinc/83/76/50/491837650.db2.gz	NVRPRWAXPMLCCE-IRUJWGPZSA-N	-2	3	374.371	0.764	20	5		FCBDHL
CO[C@H](C[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000583552281	491847330	/nfs/dbraw/zinc/84/73/30/491847330.db2.gz	MDQJSMNRGDRYHN-MRVPVSSYSA-N	-2	3	372.277	0.992	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCOC[C@H]2CCOC2)c1	ZINC000593313003	546966046	/nfs/dbraw/zinc/96/60/46/546966046.db2.gz	SINKOXRPFXFTMS-JTQLQIEISA-N	-2	3	374.371	0.624	20	5		FCBDHL
CCn1cc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(=O)[O-])nn1	ZINC000594720591	547003148	/nfs/dbraw/zinc/00/31/48/547003148.db2.gz	QTXLHAWPYMCEND-UHFFFAOYSA-N	-2	3	355.332	0.383	20	5		FCBDHL
Cn1cc([N-]S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])cn1	ZINC000737609378	599040543	/nfs/dbraw/zinc/04/05/43/599040543.db2.gz	GCIAYHFKBVBBRY-UHFFFAOYSA-N	-2	3	350.320	0.309	20	5		FCBDHL
Cn1cc([N-]S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])cn1	ZINC000737609378	599040546	/nfs/dbraw/zinc/04/05/46/599040546.db2.gz	GCIAYHFKBVBBRY-UHFFFAOYSA-N	-2	3	350.320	0.309	20	5		FCBDHL
CC(=O)C[C@@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000787934360	668815831	/nfs/dbraw/zinc/81/58/31/668815831.db2.gz	NJTIOLAYNJQARB-MRVPVSSYSA-N	-2	3	350.736	0.959	20	5		FCBDHL
O=C([N-]CC1CN(c2ncc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1)C(F)(F)F	ZINC001593048718	1285941053	/nfs/dbraw/zinc/94/10/53/1285941053.db2.gz	RFLHTNTVNDIFGE-UHFFFAOYSA-N	-2	3	372.267	0.285	20	5		FCBDHL
CC[C@@H](C)C(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001609183431	1288975196	/nfs/dbraw/zinc/97/51/96/1288975196.db2.gz	BICRUHJPKPNHGD-SSDOTTSWSA-N	-2	3	354.348	0.626	20	5		FCBDHL
CC[C@H](C)C(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001609183433	1288975357	/nfs/dbraw/zinc/97/53/57/1288975357.db2.gz	BICRUHJPKPNHGD-ZETCQYMHSA-N	-2	3	354.348	0.626	20	5		FCBDHL
O=C([O-])[C@H](Cc1ccccc1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC001595192249	952287685	/nfs/dbraw/zinc/28/76/85/952287685.db2.gz	DJTCHMZSDWZTLZ-LBPRGKRZSA-N	-2	3	351.340	0.964	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@H](C)O)c1	ZINC000274870952	211919415	/nfs/dbraw/zinc/91/94/15/211919415.db2.gz	APORESSMSYAALF-QUBYGPBYSA-N	-2	3	352.752	0.669	20	5		FCBDHL
NC(=O)CC[C@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000319957445	488898855	/nfs/dbraw/zinc/89/88/55/488898855.db2.gz	GWOQLEINZSMDTF-ZETCQYMHSA-N	-2	3	365.751	0.245	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H](C(=O)[O-])[C@@H](C)O)c1	ZINC000274870948	488739087	/nfs/dbraw/zinc/73/90/87/488739087.db2.gz	APORESSMSYAALF-LDWIPMOCSA-N	-2	3	352.752	0.669	20	5		FCBDHL
CCC(=O)C[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)C(=O)[O-]	ZINC000274937657	488745537	/nfs/dbraw/zinc/74/55/37/488745537.db2.gz	DMMXCGSEJUFHBJ-JTQLQIEISA-N	-2	3	360.344	0.704	20	5		FCBDHL
O=C([O-])[C@@H](CCO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000274944248	488746466	/nfs/dbraw/zinc/74/64/66/488746466.db2.gz	ROGQNGZHXOWBIA-MRVPVSSYSA-N	-2	3	372.277	0.728	20	5		FCBDHL
O=C([O-])[C@@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000275250806	488777158	/nfs/dbraw/zinc/77/71/58/488777158.db2.gz	LERQEBXNBDLAAI-ZETCQYMHSA-N	-2	3	358.250	0.337	20	5		FCBDHL
C[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-])C(=O)NC(C)(C)C	ZINC000414314892	489495533	/nfs/dbraw/zinc/49/55/33/489495533.db2.gz	FBEREXGBNXSRKP-QMMMGPOBSA-N	-2	3	373.387	0.875	20	5		FCBDHL
CO[C@H]1COCC[C@H]1C[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414331801	489495944	/nfs/dbraw/zinc/49/59/44/489495944.db2.gz	QZNJTSQLQUVCPL-JQWIXIFHSA-N	-2	3	374.371	0.623	20	5		FCBDHL
O=C(c1c[n-]c(=O)c([N+](=O)[O-])c1)N1CCN(C(=O)c2ccccc2[O-])CC1	ZINC000436625284	490010177	/nfs/dbraw/zinc/01/01/77/490010177.db2.gz	FCBQNFOMVDVTFH-UHFFFAOYSA-N	-2	3	372.337	0.999	20	5		FCBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](CCCC(=O)[O-])C(=O)[O-]	ZINC000392331114	490150383	/nfs/dbraw/zinc/15/03/83/490150383.db2.gz	WOGJBXXUMAFGCJ-SECBINFHSA-N	-3	3	360.344	0.890	20	5		FCBDHL
NC(=O)[C@@H]1CC[C@H]([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])C1	ZINC000571646282	491320715	/nfs/dbraw/zinc/32/07/15/491320715.db2.gz	PGNONXOOQCHODQ-APPZFPTMSA-N	-2	3	357.344	0.225	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](Cc2c[nH]cn2)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000547871294	490370676	/nfs/dbraw/zinc/37/06/76/490370676.db2.gz	QLZQHKVBJIFQNB-QMMMGPOBSA-N	-2	3	360.373	0.662	20	5		FCBDHL
Cn1cc(C[C@@H](C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C(=O)[O-])cn1	ZINC000547884508	490376965	/nfs/dbraw/zinc/37/69/65/490376965.db2.gz	IQYOSWBHEUFTTJ-NSHDSACASA-N	-2	3	368.371	0.550	20	5		FCBDHL
Cc1cnn(C[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C(=O)[O-])c1	ZINC000548531967	490497591	/nfs/dbraw/zinc/49/75/91/490497591.db2.gz	ZLWMTOPFFOZANX-SNVBAGLBSA-N	-2	3	354.344	0.531	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]Cc2cn(CC(=O)[O-])nn2)c1C	ZINC000548594329	490514508	/nfs/dbraw/zinc/51/45/08/490514508.db2.gz	OMWLSOXMYVBHER-UHFFFAOYSA-N	-2	3	369.359	0.366	20	5		FCBDHL
NC(=O)[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000515352516	490821253	/nfs/dbraw/zinc/82/12/53/490821253.db2.gz	GGUOVYIXYRFVGL-APPZFPTMSA-N	-2	3	357.344	0.225	20	5		FCBDHL
C[C@]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)(C(=O)[O-])C1CC1	ZINC000515643490	490834338	/nfs/dbraw/zinc/83/43/38/490834338.db2.gz	UOOBGAJYRVIWGG-CQSZACIVSA-N	-2	3	372.355	0.898	20	5		FCBDHL
C[C@@H](CO[C@@H]1CCOC1)[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000566316577	491435444	/nfs/dbraw/zinc/43/54/44/491435444.db2.gz	FOZOZMYFFMJZEX-GXSJLCMTSA-N	-2	3	374.371	0.765	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-]C2(CC(=O)[O-])CCOCC2)c([N+](=O)[O-])c1	ZINC000566794489	491467589	/nfs/dbraw/zinc/46/75/89/491467589.db2.gz	GKHAAFBMSMEGGO-UHFFFAOYSA-N	-2	3	374.371	0.906	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]CCCO[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000567053288	491483363	/nfs/dbraw/zinc/48/33/63/491483363.db2.gz	YJYGERTYXJTKSH-LLVKDONJSA-N	-2	3	374.371	0.767	20	5		FCBDHL
O=C([O-])[C@H]1CC[C@@H]([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000576819411	491646921	/nfs/dbraw/zinc/64/69/21/491646921.db2.gz	HDUMEFLNEKLNIS-DTWKUNHWSA-N	-2	3	372.355	0.898	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]CCCO[C@@H]2CCOC2)c1[N+](=O)[O-]	ZINC000582907535	491831619	/nfs/dbraw/zinc/83/16/19/491831619.db2.gz	BAYRDMQLCRWENO-SNVBAGLBSA-N	-2	3	374.371	0.767	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]CCCO[C@H]2CCOC2)c1[N+](=O)[O-]	ZINC000582907534	491831624	/nfs/dbraw/zinc/83/16/24/491831624.db2.gz	BAYRDMQLCRWENO-JTQLQIEISA-N	-2	3	374.371	0.767	20	5		FCBDHL
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])[C@H]1OC	ZINC000583087936	491837632	/nfs/dbraw/zinc/83/76/32/491837632.db2.gz	NVRPRWAXPMLCCE-UFGOTCBOSA-N	-2	3	374.371	0.764	20	5		FCBDHL
CCN(C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])[C@H](C)C(=O)[O-]	ZINC000595999457	491971102	/nfs/dbraw/zinc/97/11/02/491971102.db2.gz	ATTPYCMHMKGRIK-SECBINFHSA-N	-2	3	359.360	0.195	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]C[C@H]2CCCC(=O)N2)c1[N+](=O)[O-]	ZINC000593310105	546966610	/nfs/dbraw/zinc/96/66/10/546966610.db2.gz	NVRIRVGIDVQUBT-MRVPVSSYSA-N	-2	3	357.344	0.240	20	5		FCBDHL
CCn1cc(C[N-]S(=O)(=O)c2cc(C(=O)[O-])c(C)c([N+](=O)[O-])c2)nn1	ZINC000594721485	547003346	/nfs/dbraw/zinc/00/33/46/547003346.db2.gz	UYIQBZNWXRERQG-UHFFFAOYSA-N	-2	3	369.359	0.691	20	5		FCBDHL
COCc1nc(C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])n[n-]1	ZINC000594826430	547014570	/nfs/dbraw/zinc/01/45/70/547014570.db2.gz	ACFKCCHAVCQHSJ-UHFFFAOYSA-N	-2	3	361.767	0.991	20	5		FCBDHL
COCc1nc(C[N-]S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])n[n-]1	ZINC000594828670	547015334	/nfs/dbraw/zinc/01/53/34/547015334.db2.gz	UPLXLMARFZEYNE-UHFFFAOYSA-N	-2	3	361.767	0.991	20	5		FCBDHL
O=[N+]([O-])c1cc(S(=O)(=O)[N-]c2n[nH]cc2-c2nnn[n-]2)ccc1Cl	ZINC000826498271	608307999	/nfs/dbraw/zinc/30/79/99/608307999.db2.gz	NUDJSORGOCQTDP-UHFFFAOYSA-N	-2	3	370.738	0.952	20	5		FCBDHL
NC(=O)C1([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])CCCC1	ZINC000840891757	670524106	/nfs/dbraw/zinc/52/41/06/670524106.db2.gz	YZHHCCIAIKCGDA-UHFFFAOYSA-N	-2	3	357.344	0.369	20	5		FCBDHL
O=C([O-])C[C@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC001608677025	1288863019	/nfs/dbraw/zinc/86/30/19/1288863019.db2.gz	OYYJQYXFSNJYQZ-ZETCQYMHSA-N	-2	3	372.277	0.728	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](CCC(=O)[O-])C(=O)[O-])c1[N+](=O)[O-]	ZINC000277350263	212352567	/nfs/dbraw/zinc/35/25/67/212352567.db2.gz	XHMWPHVAXXUESD-VIFPVBQESA-N	-3	3	360.344	0.808	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](CC1CC1)C(=O)[O-]	ZINC000287524927	488877925	/nfs/dbraw/zinc/87/79/25/488877925.db2.gz	MPFBFNWJYOOAPQ-LLVKDONJSA-N	-2	3	372.355	0.913	20	5		FCBDHL
O=C([O-])C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000316762797	488897580	/nfs/dbraw/zinc/89/75/80/488897580.db2.gz	KNLZHNYKGVVMTH-SSDOTTSWSA-N	-3	3	352.708	0.454	20	5		FCBDHL
CC(C)[C@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)[O-]	ZINC000261628485	488527787	/nfs/dbraw/zinc/52/77/87/488527787.db2.gz	DJGJFLKGZRWKMU-LBPRGKRZSA-N	-2	3	360.344	0.754	20	5		FCBDHL
C[C@@H](C(=O)[O-])N(C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C1CC1	ZINC000263556390	488614380	/nfs/dbraw/zinc/61/43/80/488614380.db2.gz	OMPGZWJVGMZNHJ-VIFPVBQESA-N	-2	3	371.371	0.337	20	5		FCBDHL
CCC(=O)C[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)C(=O)[O-]	ZINC000274937659	488745692	/nfs/dbraw/zinc/74/56/92/488745692.db2.gz	DMMXCGSEJUFHBJ-SNVBAGLBSA-N	-2	3	360.344	0.704	20	5		FCBDHL
COC(=O)CC[C@@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000275176280	488769235	/nfs/dbraw/zinc/76/92/35/488769235.db2.gz	CVCWNJJUBDMPSG-SNVBAGLBSA-N	-2	3	374.371	0.896	20	5		FCBDHL
O=C(C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])[N-]O[C@H]1CCCCO1	ZINC000280749051	489028743	/nfs/dbraw/zinc/02/87/43/489028743.db2.gz	KKFIVKVECAJMJH-ZDUSSCGKSA-N	-2	3	359.360	0.448	20	5		FCBDHL
COc1c(F)cc(S(=O)(=O)[N-][C@@]2(C(=O)[O-])CCOC2)cc1[N+](=O)[O-]	ZINC000370141165	489319709	/nfs/dbraw/zinc/31/97/09/489319709.db2.gz	QNMFREYNDVNDAR-LBPRGKRZSA-N	-2	3	364.307	0.265	20	5		FCBDHL
C[C@]1(C[C@@H]2CCCN2C(=O)c2ccc([O-])c([N+](=O)[O-])c2)NC(=O)[N-]C1=O	ZINC000286208539	489368958	/nfs/dbraw/zinc/36/89/58/489368958.db2.gz	MSPMDSYZMSHGQX-MGPLVRAMSA-N	-2	3	362.342	0.893	20	5		FCBDHL
C[C@@]1(C[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])CCC(=O)N1	ZINC000414345072	489497228	/nfs/dbraw/zinc/49/72/28/489497228.db2.gz	LAVNKOBKOZTTCD-ZDUSSCGKSA-N	-2	3	357.344	0.240	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](CC(F)F)C(=O)[O-]	ZINC000391915414	490144516	/nfs/dbraw/zinc/14/45/16/490144516.db2.gz	SKOPXFDDQCQJKU-SSDOTTSWSA-N	-2	3	354.287	0.990	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C(=O)[O-])[C@@H]1CCOC1	ZINC000548205443	490439183	/nfs/dbraw/zinc/43/91/83/490439183.db2.gz	YWQXVMOWCZGLPM-PELKAZGASA-N	-2	3	360.344	0.371	20	5		FCBDHL
Cc1cnn(C[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C(=O)[O-])c1	ZINC000548531966	490498279	/nfs/dbraw/zinc/49/82/79/490498279.db2.gz	ZLWMTOPFFOZANX-JTQLQIEISA-N	-2	3	354.344	0.531	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C(=O)[O-])C1CC1	ZINC000548555337	490505529	/nfs/dbraw/zinc/50/55/29/490505529.db2.gz	FYMDNUPNWVNAOM-LLVKDONJSA-N	-2	3	358.328	0.523	20	5		FCBDHL
CCC[C@H](O)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000548560109	490506627	/nfs/dbraw/zinc/50/66/27/490506627.db2.gz	QNRYDPYUFPQUQP-GXSJLCMTSA-N	-2	3	350.324	0.626	20	5		FCBDHL
C[C@H](O)[C@H]([N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000562737273	491185242	/nfs/dbraw/zinc/18/52/42/491185242.db2.gz	ZALXPAYTTWTAMK-CDUCUWFYSA-N	-2	3	372.277	0.726	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]C2CCS(=O)CC2)c([N+](=O)[O-])c1	ZINC000565660661	491391931	/nfs/dbraw/zinc/39/19/31/491391931.db2.gz	KAYKGFFKCISQBP-UHFFFAOYSA-N	-2	3	362.385	0.482	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@@]2(CC(=O)[O-])CCOC2)c([N+](=O)[O-])c1	ZINC000574312057	491488621	/nfs/dbraw/zinc/48/86/21/491488621.db2.gz	GOGKIBQHDPDXTF-CYBMUJFWSA-N	-2	3	360.344	0.516	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1(CC(=O)[O-])CCOCC1	ZINC000567799493	491530404	/nfs/dbraw/zinc/53/04/04/491530404.db2.gz	RNHGUDUEBWZBLO-UHFFFAOYSA-N	-2	3	374.371	0.906	20	5		FCBDHL
O=C([O-])C1(C[N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000568363029	491571955	/nfs/dbraw/zinc/57/19/55/491571955.db2.gz	YSCYCOUKUQVVME-UHFFFAOYSA-N	-2	3	358.328	0.509	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)[C@H](C)C(=O)[O-]	ZINC000576240490	491596374	/nfs/dbraw/zinc/59/63/74/491596374.db2.gz	QRSWNAAAUDKWFN-JGVFFNPUSA-N	-2	3	360.344	0.769	20	5		FCBDHL
O=C([O-])[C@@H]1CC[C@H]([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000577460683	491623890	/nfs/dbraw/zinc/62/38/90/491623890.db2.gz	HDUMEFLNEKLNIS-BDAKNGLRSA-N	-2	3	372.355	0.898	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@H]2CCCOC2)c([N+](=O)[O-])c1	ZINC000569450026	491662201	/nfs/dbraw/zinc/66/22/01/491662201.db2.gz	RUJPYOINHOULJQ-TVQRCGJNSA-N	-2	3	374.371	0.762	20	5		FCBDHL
Cc1noc(CCC[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])n1	ZINC000581552440	491777371	/nfs/dbraw/zinc/77/73/71/491777371.db2.gz	ZAQLLEFXXPVBMI-UHFFFAOYSA-N	-2	3	370.343	0.896	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]CCCN2CCCC2=O)c([N+](=O)[O-])c1	ZINC000583029100	491836698	/nfs/dbraw/zinc/83/66/98/491836698.db2.gz	ZVSWWKGSZGWWHK-UHFFFAOYSA-N	-2	3	371.371	0.584	20	5		FCBDHL
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])[C@@H]1OC	ZINC000583087935	491837668	/nfs/dbraw/zinc/83/76/68/491837668.db2.gz	NVRPRWAXPMLCCE-NDMJEZRESA-N	-2	3	374.371	0.764	20	5		FCBDHL
CO[C@@H](C[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000583552282	491847325	/nfs/dbraw/zinc/84/73/25/491847325.db2.gz	MDQJSMNRGDRYHN-QMMMGPOBSA-N	-2	3	372.277	0.992	20	5		FCBDHL
O=C([O-])[C@H](C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C1CC1	ZINC000595994574	491970283	/nfs/dbraw/zinc/97/02/83/491970283.db2.gz	IPGVCFJWAUCVHY-LBPRGKRZSA-N	-2	3	371.371	0.100	20	5		FCBDHL
Cc1nc([C@@H](C)[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])n[nH]1	ZINC000593310988	546966868	/nfs/dbraw/zinc/96/68/68/546966868.db2.gz	PIICXMNMQPZLNS-ZCFIWIBFSA-N	-2	3	355.332	0.759	20	5		FCBDHL
Cc1nnc([C@@H](C)[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])[nH]1	ZINC000593310988	546966871	/nfs/dbraw/zinc/96/68/71/546966871.db2.gz	PIICXMNMQPZLNS-ZCFIWIBFSA-N	-2	3	355.332	0.759	20	5		FCBDHL
COCc1nc(C[N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])n[n-]1	ZINC000594827892	547015167	/nfs/dbraw/zinc/01/51/67/547015167.db2.gz	PGFHIZMWAWRILZ-UHFFFAOYSA-N	-2	3	355.376	0.955	20	5		FCBDHL
COCc1nc(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2OC)n[n-]1	ZINC000594826536	547015208	/nfs/dbraw/zinc/01/52/08/547015208.db2.gz	CMEWKWOVDVMHSB-UHFFFAOYSA-N	-2	3	357.348	0.346	20	5		FCBDHL
CC(=O)C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000787934636	668815859	/nfs/dbraw/zinc/81/58/59/668815859.db2.gz	JOXPCHYXMSBUFA-VIFPVBQESA-N	-2	3	350.736	0.959	20	5		FCBDHL
O=C(CCC1CC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001592828954	1285742812	/nfs/dbraw/zinc/74/28/12/1285742812.db2.gz	QWTHKPLNMYHTCF-UHFFFAOYSA-N	-2	3	366.359	0.770	20	5		FCBDHL
CC1(C)C[C@H]1C(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001609144266	1288947023	/nfs/dbraw/zinc/94/70/23/1288947023.db2.gz	OSSJBHQIRCRQPE-VIFPVBQESA-N	-2	3	366.359	0.626	20	5		FCBDHL
COC(=O)C1CC2(C1)CN(c1cc[n-]c(=O)c1[N+](=O)[O-])C[C@@H]2C(=O)[O-]	ZINC001593826608	955107545	/nfs/dbraw/zinc/10/75/45/955107545.db2.gz	ULDGZQXNYPIADF-OSPBMLLASA-N	-2	3	351.315	0.786	20	5		FCBDHL
CC(C)C[C@H](NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000296861572	214366771	/nfs/dbraw/zinc/36/67/71/214366771.db2.gz	VBRBPJIYAIWKGJ-JTQLQIEISA-N	-2	3	373.387	0.489	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@H](CC(F)F)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000275197164	211981363	/nfs/dbraw/zinc/98/13/63/211981363.db2.gz	GHOLCTDIQHEMDL-SSDOTTSWSA-N	-2	3	354.287	0.990	20	5		FCBDHL
NC(=O)CC[C@@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000319957443	488899134	/nfs/dbraw/zinc/89/91/34/488899134.db2.gz	GWOQLEINZSMDTF-SSDOTTSWSA-N	-2	3	365.751	0.245	20	5		FCBDHL
O=C([O-])C[C@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000316858095	488897575	/nfs/dbraw/zinc/89/75/75/488897575.db2.gz	VFANJSDLPOCDGM-LURJTMIESA-N	-3	3	352.708	0.454	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1(C(=O)[O-])CCOCC1	ZINC000325352067	488909624	/nfs/dbraw/zinc/90/96/24/488909624.db2.gz	FQDGJGAVUYPFBM-UHFFFAOYSA-N	-2	3	360.344	0.516	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C(=O)[O-])c1cnn(C)c1	ZINC000327075329	488917947	/nfs/dbraw/zinc/91/79/47/488917947.db2.gz	UKTSCVDWNVQTKF-LBPRGKRZSA-N	-2	3	370.343	0.441	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C(=O)[O-])c1cnn(C)c1	ZINC000327165676	488918495	/nfs/dbraw/zinc/91/84/95/488918495.db2.gz	TWCVQYSUNCCJDE-GFCCVEGCSA-N	-2	3	370.343	0.441	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]Cc2cn(CC(=O)[O-])nn2)cc1C	ZINC000327350551	488919257	/nfs/dbraw/zinc/91/92/57/488919257.db2.gz	FMHAKIFYCMCLTA-UHFFFAOYSA-N	-2	3	369.359	0.366	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@H](CC(=O)[O-])C(=O)[O-])c1	ZINC000274949261	488747013	/nfs/dbraw/zinc/74/70/13/488747013.db2.gz	SJQRYUAJCIPHJU-LURJTMIESA-N	-3	3	366.735	0.763	20	5		FCBDHL
C[C@@H](Cn1cncn1)[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000570454193	491242218	/nfs/dbraw/zinc/24/22/18/491242218.db2.gz	APWVJKIEZZRNOI-QMMMGPOBSA-N	-2	3	355.332	0.252	20	5		FCBDHL
C[C@]1(C[C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2[O-])NC(=O)[N-]C1=O	ZINC000286136887	489360327	/nfs/dbraw/zinc/36/03/27/489360327.db2.gz	HQCPZLPBOZUDGB-QLJPJBMISA-N	-2	3	362.342	0.893	20	5		FCBDHL
CCOC(=O)[C@@H](C)C[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414318226	489495906	/nfs/dbraw/zinc/49/59/06/489495906.db2.gz	LMRRFJIWCYFTOO-QMMMGPOBSA-N	-2	3	360.344	0.771	20	5		FCBDHL
C[C@@H](CS(C)(=O)=O)[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000570850119	491269251	/nfs/dbraw/zinc/26/92/51/491269251.db2.gz	PPYIMPROIOZTHE-ZETCQYMHSA-N	-2	3	366.373	0.004	20	5		FCBDHL
CS(=O)(=O)[N-]c1nnc([N-]C(=O)c2cc([O-])ccc2[N+](=O)[O-])s1	ZINC000469571466	489712877	/nfs/dbraw/zinc/71/28/77/489712877.db2.gz	WDLRVDFKYOHENG-UHFFFAOYSA-N	-3	3	359.345	0.776	20	5		FCBDHL
COC(=O)Cc1nnc([N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)[n-]1	ZINC000460539273	489872333	/nfs/dbraw/zinc/87/23/33/489872333.db2.gz	NEEOURYZUHTFTM-UHFFFAOYSA-N	-2	3	355.332	0.538	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](CC(F)F)C(=O)[O-]	ZINC000391915415	490146363	/nfs/dbraw/zinc/14/63/63/490146363.db2.gz	SKOPXFDDQCQJKU-ZETCQYMHSA-N	-2	3	354.287	0.990	20	5		FCBDHL
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])[C@H]1OC	ZINC000571528278	491313981	/nfs/dbraw/zinc/31/39/81/491313981.db2.gz	WTVBWZDEEOLCFR-IRUJWGPZSA-N	-2	3	374.371	0.764	20	5		FCBDHL
C[C@@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)[C@H](C)C(=O)[O-]	ZINC000521824734	490300018	/nfs/dbraw/zinc/30/00/18/490300018.db2.gz	GLNYATUOMUAKGF-JGVFFNPUSA-N	-2	3	360.344	0.754	20	5		FCBDHL
C[C@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)[C@H](C)C(=O)[O-]	ZINC000521824736	490300131	/nfs/dbraw/zinc/30/01/31/490300131.db2.gz	GLNYATUOMUAKGF-YUMQZZPRSA-N	-2	3	360.344	0.754	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-]C[C@](C)(CO)CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000548355779	490470533	/nfs/dbraw/zinc/47/05/33/490470533.db2.gz	IRWBCOXQWHUEEE-LLVKDONJSA-N	-2	3	352.390	0.716	20	5		FCBDHL
CCC[C@H](O)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(=O)[O-]	ZINC000548593334	490514680	/nfs/dbraw/zinc/51/46/80/490514680.db2.gz	ZQCSNNJHAOLRRP-JOYOIKCWSA-N	-2	3	362.360	0.496	20	5		FCBDHL
O=C([O-])[C@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C1CCC1	ZINC000548597148	490515821	/nfs/dbraw/zinc/51/58/21/490515821.db2.gz	DTKLQDFJJXQGMD-CYBMUJFWSA-N	-2	3	372.355	0.898	20	5		FCBDHL
O=C([O-])[C@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C1CC1	ZINC000516525086	490867037	/nfs/dbraw/zinc/86/70/37/490867037.db2.gz	HCLWEIHRQJBEBN-GFCCVEGCSA-N	-2	3	358.328	0.508	20	5		FCBDHL
Cc1c([C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)C(=O)[O-])cnn1C	ZINC000530540786	490912113	/nfs/dbraw/zinc/91/21/13/490912113.db2.gz	GCOZWCWPZHIAQX-JTQLQIEISA-N	-2	3	360.373	0.802	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@]1(CC(=O)[O-])CCOC1	ZINC000573110645	491413425	/nfs/dbraw/zinc/41/34/25/491413425.db2.gz	AJMDBZPCUQZURH-CYBMUJFWSA-N	-2	3	360.344	0.516	20	5		FCBDHL
C[C@@H](CO[C@H]1CCOC1)[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000566316580	491435550	/nfs/dbraw/zinc/43/55/50/491435550.db2.gz	FOZOZMYFFMJZEX-ONGXEEELSA-N	-2	3	374.371	0.765	20	5		FCBDHL
Cc1noc(CC[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])n1	ZINC000567393970	491503797	/nfs/dbraw/zinc/50/37/97/491503797.db2.gz	YSEVTSLZZNZCKN-UHFFFAOYSA-N	-2	3	356.316	0.505	20	5		FCBDHL
CC(C)[C@@H](C(=O)[O-])C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000567987559	491545074	/nfs/dbraw/zinc/54/50/74/491545074.db2.gz	GBHMZZRMKHFAFD-GFCCVEGCSA-N	-2	3	373.387	0.346	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](C(=O)[O-])[C@@H]2CCOC2)c1[N+](=O)[O-]	ZINC000577036845	491582712	/nfs/dbraw/zinc/58/27/12/491582712.db2.gz	VCLPCKZGGLVLSN-MNOVXSKESA-N	-2	3	358.372	0.980	20	5		FCBDHL
CS(=O)(=O)CCC[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000578538128	491679509	/nfs/dbraw/zinc/67/95/09/491679509.db2.gz	OYLKKNIQYIMEGY-UHFFFAOYSA-N	-2	3	366.373	0.006	20	5		FCBDHL
Cc1nc(S(=O)(=O)[N-][C@](C)(C(=O)[O-])c2cccc([N+](=O)[O-])c2)cn1C	ZINC000600666209	491874155	/nfs/dbraw/zinc/87/41/55/491874155.db2.gz	NDCCJWBHXYQTIE-AWEZNQCLSA-N	-2	3	368.371	0.915	20	5		FCBDHL
COC[C@@](C)(O)CC[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000593311950	546965364	/nfs/dbraw/zinc/96/53/64/546965364.db2.gz	ACJVNDHJGLHTNR-ZDUSSCGKSA-N	-2	3	362.360	0.359	20	5		FCBDHL
CC[C@@H](C[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-])C(=O)OC	ZINC000593312613	546965768	/nfs/dbraw/zinc/96/57/68/546965768.db2.gz	YYLJCZNLXULRRL-QMMMGPOBSA-N	-2	3	360.344	0.771	20	5		FCBDHL
O=C([O-])CN(CC1CC1)C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000593921032	546995416	/nfs/dbraw/zinc/99/54/16/546995416.db2.gz	GQEQSIKZADHTGN-UHFFFAOYSA-N	-2	3	371.371	0.196	20	5		FCBDHL
CCn1cc([N-]S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])cn1	ZINC000736723922	599039648	/nfs/dbraw/zinc/03/96/48/599039648.db2.gz	XIELUUSFKDXCRS-UHFFFAOYSA-N	-2	3	364.347	0.792	20	5		FCBDHL
CCn1cc([N-]S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])cn1	ZINC000736723922	599039651	/nfs/dbraw/zinc/03/96/51/599039651.db2.gz	XIELUUSFKDXCRS-UHFFFAOYSA-N	-2	3	364.347	0.792	20	5		FCBDHL
Cc1cc(S(=O)(=O)[N-]c2n[nH]cc2-c2nnn[n-]2)ccc1[N+](=O)[O-]	ZINC000826272649	607462123	/nfs/dbraw/zinc/46/21/23/607462123.db2.gz	URJUWGLCVSAHLT-UHFFFAOYSA-N	-2	3	350.320	0.607	20	5		FCBDHL
COC[C@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000831591215	601266603	/nfs/dbraw/zinc/26/66/03/601266603.db2.gz	SEERPDROXSYKCS-LBPRGKRZSA-N	-2	3	350.324	0.892	20	5		FCBDHL
Cc1ccc(S(=O)(=O)[N-]c2n[nH]cc2-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000826292860	608305559	/nfs/dbraw/zinc/30/55/59/608305559.db2.gz	PCFRDKNXWPPABI-UHFFFAOYSA-N	-2	3	350.320	0.607	20	5		FCBDHL
O=C([O-])[C@H](CO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1Br	ZINC000776445464	668263243	/nfs/dbraw/zinc/26/32/43/668263243.db2.gz	XCIAIPGWDUPEHA-ZETCQYMHSA-N	-2	3	369.149	0.081	20	5		FCBDHL
O=C([O-])[C@@H](CO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1Br	ZINC000776445463	668263248	/nfs/dbraw/zinc/26/32/48/668263248.db2.gz	XCIAIPGWDUPEHA-SSDOTTSWSA-N	-2	3	369.149	0.081	20	5		FCBDHL
O=C([O-])[C@@H](F)C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC001602170765	1286956204	/nfs/dbraw/zinc/95/62/04/1286956204.db2.gz	XOVMBHMUMLPFIP-LURJTMIESA-N	-2	3	350.280	0.067	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1cc([N+](=O)[O-])cs1)c1c[nH]c(-c2nnn[n-]2)c1	ZINC000826450460	836527797	/nfs/dbraw/zinc/52/77/97/836527797.db2.gz	NOCAOEBRMNOODO-UHFFFAOYSA-N	-2	3	369.344	0.283	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1cc([N+](=O)[O-])cs1)c1c[nH]c(-c2nn[n-]n2)c1	ZINC000826450460	836527798	/nfs/dbraw/zinc/52/77/98/836527798.db2.gz	NOCAOEBRMNOODO-UHFFFAOYSA-N	-2	3	369.344	0.283	20	5		FCBDHL
O=C([O-])C[C@@H](O)C(=O)Oc1c([O-])cc(Br)cc1[N+](=O)[O-]	ZINC001234878188	857414771	/nfs/dbraw/zinc/41/47/71/857414771.db2.gz	SNPBBIBCMFIXBK-SSDOTTSWSA-N	-2	3	350.077	0.804	20	5		FCBDHL
CN(CC[N-]S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])CC(=O)[O-]	ZINC001598494428	992344200	/nfs/dbraw/zinc/34/42/00/992344200.db2.gz	WULSLCYMKJCKOM-UHFFFAOYSA-N	-2	3	351.768	0.543	20	5		FCBDHL
C[C@@]1(C[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c([O-])c2)NC(=O)[N-]C1=O	ZINC000288017587	488933055	/nfs/dbraw/zinc/93/30/55/488933055.db2.gz	WJJLNEFSHYQJJX-HWPZZCPQSA-N	-2	3	362.342	0.893	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CC(=O)NCC(=O)[O-])c1	ZINC000273372087	488647010	/nfs/dbraw/zinc/64/70/10/488647010.db2.gz	VUJFSUDLUNTORH-UHFFFAOYSA-N	-2	3	365.751	0.036	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-]C[C@@H](CC(=O)[O-])C(=O)[O-])c([N+](=O)[O-])c1	ZINC000275042806	488756009	/nfs/dbraw/zinc/75/60/09/488756009.db2.gz	VWNHSGHOILURBR-SSDOTTSWSA-N	-3	3	362.316	0.057	20	5		FCBDHL
O=C([O-])[C@H]1C[C@@H]([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000570629684	491254567	/nfs/dbraw/zinc/25/45/67/491254567.db2.gz	ROUUYMFKJANFBL-OCAPTIKFSA-N	-2	3	358.328	0.508	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCn3ccnc3C2)c1	ZINC000414328507	489496347	/nfs/dbraw/zinc/49/63/47/489496347.db2.gz	AOXHVWUFVHAVRH-SNVBAGLBSA-N	-2	3	366.355	0.783	20	5		FCBDHL
Cc1ncc([N+](=O)[O-])cc1C(=O)[N-]c1nnc([N-]S(C)(=O)=O)s1	ZINC000492147938	489819265	/nfs/dbraw/zinc/81/92/65/489819265.db2.gz	OEAHNMNANBEBDR-UHFFFAOYSA-N	-2	3	358.361	0.774	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CC[C@H](C(=O)[O-])C1	ZINC000571029716	491281469	/nfs/dbraw/zinc/28/14/69/491281469.db2.gz	IVSVYWZWVFLTRE-DTWKUNHWSA-N	-2	3	372.355	0.913	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@H](C(=O)[O-])c2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000392716075	490155619	/nfs/dbraw/zinc/15/56/19/490155619.db2.gz	CSMWSTOPOPUXEG-LBPRGKRZSA-N	-2	3	370.343	0.441	20	5		FCBDHL
COC(=O)CCN(C)S(=O)(=O)[N-]c1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000547868590	490368984	/nfs/dbraw/zinc/36/89/84/490368984.db2.gz	UYQWRBPSJFNVME-UHFFFAOYSA-N	-2	3	361.332	0.445	20	5		FCBDHL
Cc1cnn(C[C@@H]([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C(=O)[O-])c1	ZINC000547875398	490372605	/nfs/dbraw/zinc/37/26/05/490372605.db2.gz	GWGUIWRSQALDOE-LLVKDONJSA-N	-2	3	368.371	0.840	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C(=O)[O-])C1CCC1	ZINC000547904851	490383307	/nfs/dbraw/zinc/38/33/07/490383307.db2.gz	XMCHHYSDXVIDSR-LBPRGKRZSA-N	-2	3	372.355	0.913	20	5		FCBDHL
Cc1ccc(S(=O)(=O)[N-]c2nc3nc(C)cc(=O)n3[n-]2)c([N+](=O)[O-])c1	ZINC000484421549	490423958	/nfs/dbraw/zinc/42/39/58/490423958.db2.gz	JFJLRVXGVCVIEV-UHFFFAOYSA-N	-2	3	364.343	0.743	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-]C[C@H](CC(=O)[O-])C(=O)[O-])cc1[N+](=O)[O-]	ZINC000548212541	490441253	/nfs/dbraw/zinc/44/12/53/490441253.db2.gz	OMXOYNJOBLFEQZ-LURJTMIESA-N	-3	3	352.346	0.419	20	5		FCBDHL
Cc1ccc(S(=O)(=O)[N-][C@H](Cc2cnn(C)c2)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000548223795	490444854	/nfs/dbraw/zinc/44/48/54/490444854.db2.gz	KPDFVILQRDDKOV-LLVKDONJSA-N	-2	3	368.371	0.611	20	5		FCBDHL
CC(C)(C)NC(=O)C[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000516654297	490872967	/nfs/dbraw/zinc/87/29/67/490872967.db2.gz	AFWGJTNEENZHKB-UHFFFAOYSA-N	-2	3	359.360	0.486	20	5		FCBDHL
Cc1nnc(CC[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])s1	ZINC000569127431	491636166	/nfs/dbraw/zinc/63/61/66/491636166.db2.gz	BDKHSEXDVFMQRL-UHFFFAOYSA-N	-2	3	372.384	0.974	20	5		FCBDHL
CN1C[C@H]([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])CCC1=O	ZINC000576760490	491642602	/nfs/dbraw/zinc/64/26/02/491642602.db2.gz	VGJDNMXGXUFKBJ-MRVPVSSYSA-N	-2	3	357.344	0.192	20	5		FCBDHL
O=C([O-])[C@H](CCO)[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000578976602	491688091	/nfs/dbraw/zinc/68/80/91/491688091.db2.gz	SJVHCITXVFNCEW-ZETCQYMHSA-N	-2	3	372.277	0.728	20	5		FCBDHL
CC(C)C(=O)NCC[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000580718471	491743140	/nfs/dbraw/zinc/74/31/40/491743140.db2.gz	SQSGFBWJPNAUGH-UHFFFAOYSA-N	-2	3	359.360	0.344	20	5		FCBDHL
CO[C@@H]1COCC[C@H]1C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000582305038	491806843	/nfs/dbraw/zinc/80/68/43/491806843.db2.gz	LHNIORHPVNHIIB-CMPLNLGQSA-N	-2	3	374.371	0.623	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@H](CCC(=O)[O-])C(=O)[O-])cc1[N+](=O)[O-]	ZINC000614327660	492024543	/nfs/dbraw/zinc/02/45/43/492024543.db2.gz	UXLHQICSXUUXPS-ZCFIWIBFSA-N	-3	3	352.346	0.561	20	5		FCBDHL
CN(C)C(=O)C(C)(C)[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000593306957	546965633	/nfs/dbraw/zinc/96/56/33/546965633.db2.gz	FYLBRYJOMQKQRK-UHFFFAOYSA-N	-2	3	359.360	0.438	20	5		FCBDHL
Cc1nc([C@@H](C)[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])n[nH]1	ZINC000593310973	546966414	/nfs/dbraw/zinc/96/64/14/546966414.db2.gz	OKPYVJKLICQUJR-ZCFIWIBFSA-N	-2	3	355.332	0.759	20	5		FCBDHL
Cc1nnc([C@@H](C)[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])[nH]1	ZINC000593310973	546966418	/nfs/dbraw/zinc/96/64/18/546966418.db2.gz	OKPYVJKLICQUJR-ZCFIWIBFSA-N	-2	3	355.332	0.759	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@@]2(O)CCOC2)c1	ZINC000593315827	546966504	/nfs/dbraw/zinc/96/65/04/546966504.db2.gz	NBYQHZAWROLSJO-CYBMUJFWSA-N	-2	3	360.344	0.113	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]CC[C@@]2(O)CCOC2)c1[N+](=O)[O-]	ZINC000593316538	546966811	/nfs/dbraw/zinc/96/68/11/546966811.db2.gz	QDFRZURJIQLYFE-CYBMUJFWSA-N	-2	3	360.344	0.113	20	5		FCBDHL
O=C([O-])CC1(NC(=O)C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCC1	ZINC000593920926	546994900	/nfs/dbraw/zinc/99/49/00/546994900.db2.gz	DTHOWJNXMSJMNP-UHFFFAOYSA-N	-2	3	371.371	0.387	20	5		FCBDHL
O=C(NCCNc1ncccc1-c1nnn[n-]1)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000826438187	609150537	/nfs/dbraw/zinc/15/05/37/609150537.db2.gz	QVMGWFWGHKKMBM-UHFFFAOYSA-N	-2	3	370.329	0.717	20	5		FCBDHL
O=C(NCCNc1ncccc1-c1nn[n-]n1)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000826438187	609150538	/nfs/dbraw/zinc/15/05/38/609150538.db2.gz	QVMGWFWGHKKMBM-UHFFFAOYSA-N	-2	3	370.329	0.717	20	5		FCBDHL
CCn1nc(C)c(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C(=O)[O-])c2)n1	ZINC000844891535	670952840	/nfs/dbraw/zinc/95/28/40/670952840.db2.gz	QSXGWKATYXIHBO-UHFFFAOYSA-N	-2	3	369.359	0.691	20	5		FCBDHL
CCCOCC(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001590646181	1283699004	/nfs/dbraw/zinc/69/90/04/1283699004.db2.gz	PDERQRFXOKQYTE-UHFFFAOYSA-N	-2	3	370.347	0.006	20	5		FCBDHL
CS[C@@H](C)C(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001591686911	1284829890	/nfs/dbraw/zinc/82/98/90/1284829890.db2.gz	OHFNHBFVQGQWTH-LURJTMIESA-N	-2	3	372.388	0.331	20	5		FCBDHL
Cn1ncc(-c2nnn[n-]2)c1[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC001592597966	1285531267	/nfs/dbraw/zinc/53/12/67/1285531267.db2.gz	VTFOPSPTHDBXPC-UHFFFAOYSA-N	-2	3	356.349	0.371	20	5		FCBDHL
CC(C)CC(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001609092587	1288915163	/nfs/dbraw/zinc/91/51/63/1288915163.db2.gz	RNJZAYHBOMDPAM-UHFFFAOYSA-N	-2	3	354.348	0.626	20	5		FCBDHL
C[C@](CO)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC001592755200	979327515	/nfs/dbraw/zinc/32/75/15/979327515.db2.gz	AYTPTVBBWYXUHG-SNVBAGLBSA-N	-2	3	372.277	0.728	20	5		FCBDHL
COC(=O)CC[C@@H]([N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C(=O)[O-]	ZINC000277370337	212354092	/nfs/dbraw/zinc/35/40/92/212354092.db2.gz	ZIGRMHLGNZLMFN-SNVBAGLBSA-N	-2	3	374.371	0.896	20	5		FCBDHL
O=C([O-])[C@@H](Cc1c[nH]cn1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000325949676	488912727	/nfs/dbraw/zinc/91/27/27/488912727.db2.gz	NKOINOFMJGSRHL-SNVBAGLBSA-N	-2	3	374.762	0.946	20	5		FCBDHL
O=C([O-])[C@@H](Cc1cnc[nH]1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000325949676	488912730	/nfs/dbraw/zinc/91/27/30/488912730.db2.gz	NKOINOFMJGSRHL-SNVBAGLBSA-N	-2	3	374.762	0.946	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](Cc2c[nH]cn2)C(=O)[O-])cc1C	ZINC000327259632	488918406	/nfs/dbraw/zinc/91/84/06/488918406.db2.gz	CXFRRZZSHOUNPS-NSHDSACASA-N	-2	3	368.371	0.909	20	5		FCBDHL
C[C@]1(C[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c([O-])c2)NC(=O)[N-]C1=O	ZINC000288019870	488933638	/nfs/dbraw/zinc/93/36/38/488933638.db2.gz	WJJLNEFSHYQJJX-QLJPJBMISA-N	-2	3	362.342	0.893	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1C=C[C@@H](C(=O)[O-])C1	ZINC000274952600	488747239	/nfs/dbraw/zinc/74/72/39/488747239.db2.gz	GOCFDZJNKCBWIV-BDAKNGLRSA-N	-2	3	370.339	0.689	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-]CCSCC(=O)[O-])c([N+](=O)[O-])c1	ZINC000275057595	488757131	/nfs/dbraw/zinc/75/71/31/488757131.db2.gz	UCRUSMLYLMWIDO-UHFFFAOYSA-N	-2	3	350.374	0.700	20	5		FCBDHL
C[C@@]1(C[C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2[O-])NC(=O)[N-]C1=O	ZINC000286136880	489359841	/nfs/dbraw/zinc/35/98/41/489359841.db2.gz	HQCPZLPBOZUDGB-QFYYESIMSA-N	-2	3	362.342	0.893	20	5		FCBDHL
C[C@@]1(C[C@@H]2CCCN2C(=O)c2ccc([O-])c([N+](=O)[O-])c2)NC(=O)[N-]C1=O	ZINC000286208541	489368775	/nfs/dbraw/zinc/36/87/75/489368775.db2.gz	MSPMDSYZMSHGQX-QFYYESIMSA-N	-2	3	362.342	0.893	20	5		FCBDHL
Cc1nnc(CC[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])s1	ZINC000414352994	489497267	/nfs/dbraw/zinc/49/72/67/489497267.db2.gz	XUAFCVNGJBZJQU-UHFFFAOYSA-N	-2	3	372.384	0.974	20	5		FCBDHL
COC(=O)[C@H](CC1CC1)[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414356149	489498024	/nfs/dbraw/zinc/49/80/24/489498024.db2.gz	YPBQTMWEXOUMFE-JTQLQIEISA-N	-2	3	372.355	0.913	20	5		FCBDHL
COC[C@@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000571043167	491281781	/nfs/dbraw/zinc/28/17/81/491281781.db2.gz	BLWWSODEKOYKBX-CYBMUJFWSA-N	-2	3	362.360	0.762	20	5		FCBDHL
NC(=O)[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000421814501	490108903	/nfs/dbraw/zinc/10/89/03/490108903.db2.gz	JTRRACUAHZRHEW-BDAKNGLRSA-N	-2	3	357.344	0.225	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@]1(CC(=O)[O-])CCOC1	ZINC000520397512	490142784	/nfs/dbraw/zinc/14/27/84/490142784.db2.gz	HEHOUQLANUMTJB-CYBMUJFWSA-N	-2	3	360.344	0.516	20	5		FCBDHL
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])[C@H]1OC	ZINC000571528280	491313833	/nfs/dbraw/zinc/31/38/33/491313833.db2.gz	WTVBWZDEEOLCFR-UFGOTCBOSA-N	-2	3	374.371	0.764	20	5		FCBDHL
C[C@@H](C(=O)[O-])[C@H](C)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000521824735	490299855	/nfs/dbraw/zinc/29/98/55/490299855.db2.gz	GLNYATUOMUAKGF-SFYZADRCSA-N	-2	3	360.344	0.754	20	5		FCBDHL
Cn1cc(C[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C(=O)[O-])cn1	ZINC000547893150	490378990	/nfs/dbraw/zinc/37/89/90/490378990.db2.gz	ZGEJTUPRTJPUIG-JTQLQIEISA-N	-2	3	354.344	0.303	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-]C[C@@H](CC(=O)[O-])C(=O)[O-])cc1[N+](=O)[O-]	ZINC000548212542	490441144	/nfs/dbraw/zinc/44/11/44/490441144.db2.gz	OMXOYNJOBLFEQZ-ZCFIWIBFSA-N	-3	3	352.346	0.419	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C(=O)[O-])[C@@H]2CCOC2)cc1C	ZINC000548530603	490496980	/nfs/dbraw/zinc/49/69/80/490496980.db2.gz	RDAHBXPRXDKJNS-MFKMUULPSA-N	-2	3	358.372	0.980	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C[C@@H]1CCOC1)C(=O)[O-]	ZINC000548531908	490498361	/nfs/dbraw/zinc/49/83/61/490498361.db2.gz	WEKUOWHLLVIHMO-ONGXEEELSA-N	-2	3	374.371	0.762	20	5		FCBDHL
COC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000548551521	490504425	/nfs/dbraw/zinc/50/44/25/490504425.db2.gz	LGCCDGLMSVHBDG-MRVPVSSYSA-N	-2	3	372.277	0.992	20	5		FCBDHL
CCC[C@H](O)[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000548560116	490506587	/nfs/dbraw/zinc/50/65/87/490506587.db2.gz	QNRYDPYUFPQUQP-ONGXEEELSA-N	-2	3	350.324	0.626	20	5		FCBDHL
CCOc1ccc([N+](=O)[O-])c(C(=O)[N-]c2n[n-]c(S(C)(=O)=O)n2)c1	ZINC000549597455	490591869	/nfs/dbraw/zinc/59/18/69/490591869.db2.gz	IYMNTFLZXPHGQU-UHFFFAOYSA-N	-2	3	355.332	0.767	20	5		FCBDHL
CN1CC[C@H](C[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])CC1=O	ZINC000565061405	491349898	/nfs/dbraw/zinc/34/98/98/491349898.db2.gz	YXKNVDYEFPPLJB-VIFPVBQESA-N	-2	3	371.371	0.440	20	5		FCBDHL
C[C@@]1(C[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])CCC(=O)N1	ZINC000516573657	490869028	/nfs/dbraw/zinc/86/90/28/490869028.db2.gz	BSDXEVDKHGDCIJ-ZDUSSCGKSA-N	-2	3	357.344	0.240	20	5		FCBDHL
Cc1c([C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C(=O)[O-])cnn1C	ZINC000530435970	490905938	/nfs/dbraw/zinc/90/59/38/490905938.db2.gz	KITWPSSTMFZCGL-GFCCVEGCSA-N	-2	3	372.334	0.880	20	5		FCBDHL
CSC[C@@](C)(O)C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000572607356	491381606	/nfs/dbraw/zinc/38/16/06/491381606.db2.gz	VIBWVONGJPKUMG-LBPRGKRZSA-N	-2	3	364.401	0.685	20	5		FCBDHL
C[C@@]1(C[C@H]2CCCN2C(=O)c2cc([O-])cc([N+](=O)[O-])c2)NC(=O)[N-]C1=O	ZINC000557608882	491386751	/nfs/dbraw/zinc/38/67/51/491386751.db2.gz	JEZZCRZWPQHHNG-HWPZZCPQSA-N	-2	3	362.342	0.893	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1C[C@H](C(=O)[O-])C1	ZINC000565888599	491405403	/nfs/dbraw/zinc/40/54/03/491405403.db2.gz	MPPBZXLEYLZUEG-ZKCHVHJHSA-N	-2	3	358.328	0.523	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCn3ccnc3C2)c([N+](=O)[O-])c1	ZINC000574210388	491481409	/nfs/dbraw/zinc/48/14/09/491481409.db2.gz	JMOSGGDLRCOCCM-JTQLQIEISA-N	-2	3	366.355	0.783	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-]CCn2cc(C(=O)[O-])nn2)cc1[N+](=O)[O-]	ZINC000575791046	491561157	/nfs/dbraw/zinc/56/11/57/491561157.db2.gz	NHAMFNFPIUAFJB-UHFFFAOYSA-N	-2	3	361.361	0.233	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)[C@@H](C)C(=O)[O-]	ZINC000576240491	491596474	/nfs/dbraw/zinc/59/64/74/491596474.db2.gz	QRSWNAAAUDKWFN-SFYZADRCSA-N	-2	3	360.344	0.769	20	5		FCBDHL
CC(C)(C)[C@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-])C(N)=O	ZINC000569225052	491643184	/nfs/dbraw/zinc/64/31/84/491643184.db2.gz	FTRHSICEIDVVKO-SNVBAGLBSA-N	-2	3	359.360	0.471	20	5		FCBDHL
O=C([O-])[C@H](Cc1ccncc1)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000590599834	491780782	/nfs/dbraw/zinc/78/07/82/491780782.db2.gz	GHKIOBRTCLMVRX-NSHDSACASA-N	-2	3	351.340	0.964	20	5		FCBDHL
O=C([O-])[C@H](CO)[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000583309579	491842033	/nfs/dbraw/zinc/84/20/33/491842033.db2.gz	ZAZVRNOBMYUZCI-LURJTMIESA-N	-2	3	358.250	0.337	20	5		FCBDHL
O=C([O-])C1(C(=O)NCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCC1	ZINC000595996028	491970648	/nfs/dbraw/zinc/97/06/48/491970648.db2.gz	VQAVYVIINDWYLV-UHFFFAOYSA-N	-2	3	371.371	0.244	20	5		FCBDHL
COc1c(F)cc(S(=O)(=O)[N-]C[C@@H](CC(=O)[O-])OC)cc1[N+](=O)[O-]	ZINC000616333633	492126220	/nfs/dbraw/zinc/12/62/20/492126220.db2.gz	UBIUNLZNSFCZEG-SSDOTTSWSA-N	-2	3	366.323	0.511	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]CCOC[C@@H]2CCOC2)c1[N+](=O)[O-]	ZINC000593313002	546965932	/nfs/dbraw/zinc/96/59/32/546965932.db2.gz	SHRKYUKCGQPCHO-SNVBAGLBSA-N	-2	3	374.371	0.624	20	5		FCBDHL
CC[C@H](C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-])C(=O)OC	ZINC000593312603	546966035	/nfs/dbraw/zinc/96/60/35/546966035.db2.gz	YKBPHWGEDYVTAH-MRVPVSSYSA-N	-2	3	360.344	0.771	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]CC[C@]2(O)CCCOC2)c([N+](=O)[O-])c1	ZINC000593314457	546966967	/nfs/dbraw/zinc/96/69/67/546966967.db2.gz	BIIAPVSAWHGSIA-CQSZACIVSA-N	-2	3	374.371	0.503	20	5		FCBDHL
C[C@@H]1CC[C@H](C(=O)[O-])N1C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000593919752	546995387	/nfs/dbraw/zinc/99/53/87/546995387.db2.gz	BCUIFVUAYLHWHM-MWLCHTKSSA-N	-2	3	371.371	0.337	20	5		FCBDHL
CCn1cc(S(=O)(=O)[N-]c2ccccc2-c2nn[n-]n2)c([N+](=O)[O-])n1	ZINC000825805107	669469002	/nfs/dbraw/zinc/46/90/02/669469002.db2.gz	RYNZDHPYJBKANT-UHFFFAOYSA-N	-2	3	364.347	0.792	20	5		FCBDHL
CCn1ncc(-c2nnn[n-]2)c1[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC001604617894	1287692655	/nfs/dbraw/zinc/69/26/55/1287692655.db2.gz	LNFWGOSEKFWTNU-UHFFFAOYSA-N	-2	3	370.376	0.854	20	5		FCBDHL
O=C(CC1CCC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001606499134	1288343514	/nfs/dbraw/zinc/34/35/14/1288343514.db2.gz	YFZXQWJMKCFZKB-UHFFFAOYSA-N	-2	3	366.359	0.770	20	5		FCBDHL
CO[C@@H]1CCC[C@H]([C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C(=O)[O-])C1	ZINC001606739893	1288480387	/nfs/dbraw/zinc/48/03/87/1288480387.db2.gz	OODYUPYQYOFFEO-NDMJEZRESA-N	-2	3	373.387	0.927	20	5		FCBDHL
O=c1[n-]c([C@@H]2CCCN(c3cccc(-c4nnn[n-]4)c3[N+](=O)[O-])C2)n[nH]1	ZINC001609605171	1289260310	/nfs/dbraw/zinc/26/03/10/1289260310.db2.gz	MEZYSDMWRSCEHO-MRVPVSSYSA-N	-2	3	357.334	0.983	20	5		FCBDHL
Cc1cc(S(=O)(=O)[N-]C2(C(=O)[O-])CCOCC2)c(F)cc1[N+](=O)[O-]	ZINC001594329214	958204266	/nfs/dbraw/zinc/20/42/66/958204266.db2.gz	SRRVJUJLLQPHHQ-UHFFFAOYSA-N	-2	3	362.335	0.954	20	5		FCBDHL
COc1cc(CN[C@@H]2CCCCN(CC(=O)[O-])C2=O)c([N+](=O)[O-])cc1[O-]	ZINC001604709324	973908756	/nfs/dbraw/zinc/90/87/56/973908756.db2.gz	IWNUQSFSYVIXBD-LLVKDONJSA-N	-2	3	367.358	0.864	20	5		FCBDHL
COc1cc(CN[C@H]2CCCCN(CC(=O)[O-])C2=O)c([N+](=O)[O-])cc1[O-]	ZINC001604709325	973909955	/nfs/dbraw/zinc/90/99/55/973909955.db2.gz	IWNUQSFSYVIXBD-NSHDSACASA-N	-2	3	367.358	0.864	20	5		FCBDHL
COC(=O)CC[C@H]([N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C(=O)[O-]	ZINC000277370331	212354321	/nfs/dbraw/zinc/35/43/21/212354321.db2.gz	ZIGRMHLGNZLMFN-JTQLQIEISA-N	-2	3	374.371	0.896	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1ncccc1[O-]	ZINC000480731326	250280257	/nfs/dbraw/zinc/28/02/57/250280257.db2.gz	QNEXBXVXVXUIQS-UHFFFAOYSA-N	-2	3	367.339	0.961	20	5		FCBDHL
O=C([O-])[C@@]1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCOC1	ZINC000316143259	488897527	/nfs/dbraw/zinc/89/75/27/488897527.db2.gz	VHGMPHMZVXVIPM-LLVKDONJSA-N	-2	3	350.736	0.770	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCSCC(=O)[O-]	ZINC000274917454	488743726	/nfs/dbraw/zinc/74/37/26/488743726.db2.gz	AELAEINZUMMGLR-UHFFFAOYSA-N	-2	3	350.374	0.700	20	5		FCBDHL
O=C([O-])C[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000275027323	488754711	/nfs/dbraw/zinc/75/47/11/488754711.db2.gz	STQVINXDVPUCPO-LURJTMIESA-N	-3	3	366.735	0.702	20	5		FCBDHL
NC(=O)CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000275093532	488761245	/nfs/dbraw/zinc/76/12/45/488761245.db2.gz	PNNYSNXAZRTIFY-MRVPVSSYSA-N	-2	3	365.751	0.245	20	5		FCBDHL
CCOC(=O)CC[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000277864572	488790713	/nfs/dbraw/zinc/79/07/13/488790713.db2.gz	AKULLIFKXXXAJB-VIFPVBQESA-N	-2	3	360.344	0.670	20	5		FCBDHL
O=C(C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])[N-]O[C@@H]1CCCCO1	ZINC000280749048	489028751	/nfs/dbraw/zinc/02/87/51/489028751.db2.gz	KKFIVKVECAJMJH-CYBMUJFWSA-N	-2	3	359.360	0.448	20	5		FCBDHL
C[C@@]1(C[C@H]2CCCN2C(=O)c2cccc([O-])c2[N+](=O)[O-])NC(=O)[N-]C1=O	ZINC000286275566	489375512	/nfs/dbraw/zinc/37/55/12/489375512.db2.gz	QTMAKZLDYWKMKA-ABKXIKBNSA-N	-2	3	362.342	0.893	20	5		FCBDHL
COC(=O)Cc1nc([N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])n[n-]1	ZINC000460534979	489872366	/nfs/dbraw/zinc/87/23/66/489872366.db2.gz	TVCNHJVXRFXQGA-UHFFFAOYSA-N	-2	3	355.332	0.370	20	5		FCBDHL
COC(=O)c1cc(S(=O)(=O)[N-]c2ccncc2[N+](=O)[O-])ccc1[O-]	ZINC000436593097	490008470	/nfs/dbraw/zinc/00/84/70/490008470.db2.gz	AAKJFRSVNGWQGN-UHFFFAOYSA-N	-2	3	353.312	0.705	20	5		FCBDHL
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])[C@@H]1OC	ZINC000571528281	491313699	/nfs/dbraw/zinc/31/36/99/491313699.db2.gz	WTVBWZDEEOLCFR-XWIASGKRSA-N	-2	3	374.371	0.764	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@H](C[C@@H]2CCOC2)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000547874343	490372355	/nfs/dbraw/zinc/37/23/55/490372355.db2.gz	ZKUVDRNQTVUFFG-GXSJLCMTSA-N	-2	3	374.371	0.762	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@H](Cc2cnn(C)c2)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000547895295	490378824	/nfs/dbraw/zinc/37/88/24/490378824.db2.gz	RTIPJBGZMQAETA-SECBINFHSA-N	-2	3	374.400	0.672	20	5		FCBDHL
C[C@](CO)(C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC(=O)[O-]	ZINC000548028030	490410168	/nfs/dbraw/zinc/41/01/68/490410168.db2.gz	BOOJSULKYLRMOU-GFCCVEGCSA-N	-2	3	366.779	1.000	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C(=O)[O-])[C@H]1CCOC1	ZINC000548205446	490439225	/nfs/dbraw/zinc/43/92/25/490439225.db2.gz	YWQXVMOWCZGLPM-UFBFGSQYSA-N	-2	3	360.344	0.371	20	5		FCBDHL
CO[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000548540514	490501364	/nfs/dbraw/zinc/50/13/64/490501364.db2.gz	QFUKCQQEHHQNSU-QMMMGPOBSA-N	-2	3	372.277	0.992	20	5		FCBDHL
O=C([O-])[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000573962630	491465907	/nfs/dbraw/zinc/46/59/07/491465907.db2.gz	MAPULXZLCFMCLN-BDAKNGLRSA-N	-2	3	372.355	0.898	20	5		FCBDHL
Cc1noc(CCC[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])n1	ZINC000568006356	491546936	/nfs/dbraw/zinc/54/69/36/491546936.db2.gz	ARBZCSLNGPOTOD-UHFFFAOYSA-N	-2	3	370.343	0.896	20	5		FCBDHL
O=C([O-])[C@@H](CO)[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000560896736	491562980	/nfs/dbraw/zinc/56/29/80/491562980.db2.gz	ZAZVRNOBMYUZCI-ZCFIWIBFSA-N	-2	3	358.250	0.337	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC(=O)N2CCCCC2)c1	ZINC000575993145	491574789	/nfs/dbraw/zinc/57/47/89/491574789.db2.gz	VTYLNZIFAKSEQH-UHFFFAOYSA-N	-2	3	371.371	0.584	20	5		FCBDHL
Cc1cnn(C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C(=O)[O-])c1	ZINC000562320641	491665850	/nfs/dbraw/zinc/66/58/50/491665850.db2.gz	KQMDRVUHCVANJN-LLVKDONJSA-N	-2	3	372.334	0.671	20	5		FCBDHL
Cc1noc(CCC[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])n1	ZINC000584842512	491716989	/nfs/dbraw/zinc/71/69/89/491716989.db2.gz	VYSNLBBJBHRVRP-UHFFFAOYSA-N	-2	3	370.343	0.896	20	5		FCBDHL
COC(=O)Cc1nnc([N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)[n-]1	ZINC000598734788	492116155	/nfs/dbraw/zinc/11/61/55/492116155.db2.gz	OHKIOFNUOYBLCB-UHFFFAOYSA-N	-2	3	369.359	0.846	20	5		FCBDHL
CCC[C@@H](O)[C@@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC)C(=O)[O-]	ZINC000619470674	492264382	/nfs/dbraw/zinc/26/43/82/492264382.db2.gz	BEYKZIBWVCACKB-MWLCHTKSSA-N	-2	3	362.360	0.496	20	5		FCBDHL
CC(C)(CCNC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000424228236	535030736	/nfs/dbraw/zinc/03/07/36/535030736.db2.gz	HTDOGGHZNXAXDT-UHFFFAOYSA-N	-2	3	373.387	0.490	20	5		FCBDHL
O=C([O-])[C@@H]1CC[C@H](NC(=O)C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000592469102	546951996	/nfs/dbraw/zinc/95/19/96/546951996.db2.gz	HFDMFHCZTYOFCE-ZJUUUORDSA-N	-2	3	371.371	0.243	20	5		FCBDHL
C[C@@H](C(=O)[O-])C1([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000593273658	546964934	/nfs/dbraw/zinc/96/49/34/546964934.db2.gz	KPBQOWLXMOFYIV-QMMMGPOBSA-N	-2	3	372.355	0.898	20	5		FCBDHL
C[C@@]1(C[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])CCC(=O)N1	ZINC000593312263	546966091	/nfs/dbraw/zinc/96/60/91/546966091.db2.gz	SZFBGFAXNVINBQ-ZDUSSCGKSA-N	-2	3	357.344	0.240	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]CC[C@@]2(O)CCOC2)c([N+](=O)[O-])c1	ZINC000593315863	546967022	/nfs/dbraw/zinc/96/70/22/546967022.db2.gz	NMVFSUHTZLZDJX-CYBMUJFWSA-N	-2	3	360.344	0.113	20	5		FCBDHL
COCc1nc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)n[n-]1	ZINC000594826464	547014361	/nfs/dbraw/zinc/01/43/61/547014361.db2.gz	ASIBDLCHTZHACH-UHFFFAOYSA-N	-2	3	361.767	0.991	20	5		FCBDHL
COCc1nc(C[N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])n[n-]1	ZINC000594827872	547015402	/nfs/dbraw/zinc/01/54/02/547015402.db2.gz	OTGGQXFCUBLCOK-UHFFFAOYSA-N	-2	3	355.376	0.955	20	5		FCBDHL
O=C([O-])COc1ccc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])cc1	ZINC000759169639	602309514	/nfs/dbraw/zinc/30/95/14/602309514.db2.gz	SPPZYYRHYCIQKU-UHFFFAOYSA-N	-2	3	368.327	0.759	20	5		FCBDHL
O=[N+]([O-])c1c(F)cccc1S(=O)(=O)[N-]c1n[nH]cc1-c1nnn[n-]1	ZINC000826497790	608305948	/nfs/dbraw/zinc/30/59/48/608305948.db2.gz	UYBHRTIRKVSKLE-UHFFFAOYSA-N	-2	3	354.283	0.438	20	5		FCBDHL
CCn1ncc(C[N-]S(=O)(=O)c2cc(C(=O)[O-])c(C)c([N+](=O)[O-])c2)n1	ZINC000863429861	672125572	/nfs/dbraw/zinc/12/55/72/672125572.db2.gz	XOYRYLVCXWXDRR-UHFFFAOYSA-N	-2	3	369.359	0.691	20	5		FCBDHL
Cn1nnc(C(=O)[N-]c2cc(-c3nn[n-]n3)cc([N+](=O)[O-])c2Cl)n1	ZINC001581844775	1280598705	/nfs/dbraw/zinc/59/87/05/1280598705.db2.gz	JJTZSHIFWJPBCF-UHFFFAOYSA-N	-2	3	350.686	0.204	20	5		FCBDHL
O=[N+]([O-])c1cccnc1S(=O)(=O)[N-]Cc1cncc(-c2nnn[n-]2)c1	ZINC001593486854	1286176512	/nfs/dbraw/zinc/17/65/12/1286176512.db2.gz	QUDWGFUUZNDICM-UHFFFAOYSA-N	-2	3	362.331	0.043	20	5		FCBDHL
O=[N+]([O-])c1cccnc1S(=O)(=O)[N-]Cc1cncc(-c2nn[n-]n2)c1	ZINC001593486854	1286176517	/nfs/dbraw/zinc/17/65/17/1286176517.db2.gz	QUDWGFUUZNDICM-UHFFFAOYSA-N	-2	3	362.331	0.043	20	5		FCBDHL
O=c1[n-]c(C2CCN(c3cc(-c4nnn[n-]4)ccc3[N+](=O)[O-])CC2)n[nH]1	ZINC001609605305	1289260632	/nfs/dbraw/zinc/26/06/32/1289260632.db2.gz	UNUNKSNCTXKIDZ-UHFFFAOYSA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=c1[n-]c(C2CCN(c3cc(-c4nn[n-]n4)ccc3[N+](=O)[O-])CC2)n[nH]1	ZINC001609605305	1289260638	/nfs/dbraw/zinc/26/06/38/1289260638.db2.gz	UNUNKSNCTXKIDZ-UHFFFAOYSA-N	-2	3	357.334	0.983	20	5		FCBDHL
C[C@@](CO)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC001592755199	979327400	/nfs/dbraw/zinc/32/74/00/979327400.db2.gz	AYTPTVBBWYXUHG-JTQLQIEISA-N	-2	3	372.277	0.728	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](Cc2c[nH]cn2)C(=O)[O-])c1[N+](=O)[O-]	ZINC000277305917	212348654	/nfs/dbraw/zinc/34/86/54/212348654.db2.gz	SLXUOHOJGRIJEZ-LLVKDONJSA-N	-2	3	368.371	0.909	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@](C)(CO)CC(=O)[O-])c1C	ZINC000275669093	212070194	/nfs/dbraw/zinc/07/01/94/212070194.db2.gz	PPKKFZUQWALKAQ-AWEZNQCLSA-N	-2	3	360.388	0.963	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1(C(=O)[O-])CCOCC1	ZINC000274999348	211945606	/nfs/dbraw/zinc/94/56/06/211945606.db2.gz	NUMWNEQEGCIUED-UHFFFAOYSA-N	-2	3	374.371	0.763	20	5		FCBDHL
O=C([N-]CC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(F)(F)C(F)F	ZINC000176743516	209010229	/nfs/dbraw/zinc/01/02/29/209010229.db2.gz	JZRMSBGGCXFUMG-UHFFFAOYSA-N	-2	3	373.284	0.890	20	5		FCBDHL
O=C([O-])C[C@@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000316858099	488897571	/nfs/dbraw/zinc/89/75/71/488897571.db2.gz	VFANJSDLPOCDGM-ZCFIWIBFSA-N	-3	3	352.708	0.454	20	5		FCBDHL
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H](CCO)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000274897321	488741917	/nfs/dbraw/zinc/74/19/17/488741917.db2.gz	HGEFJWWEKNDTCQ-MRVPVSSYSA-N	-2	3	352.752	0.671	20	5		FCBDHL
NC(=O)CC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000275093540	488761028	/nfs/dbraw/zinc/76/10/28/488761028.db2.gz	PNNYSNXAZRTIFY-QMMMGPOBSA-N	-2	3	365.751	0.245	20	5		FCBDHL
C[C@]1(C[C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2[O-])NC(=O)[N-]C1=O	ZINC000286136872	489359917	/nfs/dbraw/zinc/35/99/17/489359917.db2.gz	HQCPZLPBOZUDGB-MGPLVRAMSA-N	-2	3	362.342	0.893	20	5		FCBDHL
C[C@@]1(C[C@@H]2CCCN2C(=O)c2cccc([O-])c2[N+](=O)[O-])NC(=O)[N-]C1=O	ZINC000286275570	489375538	/nfs/dbraw/zinc/37/55/38/489375538.db2.gz	QTMAKZLDYWKMKA-FVMDXXJSSA-N	-2	3	362.342	0.893	20	5		FCBDHL
COC(=O)Cc1nnc([N-]S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)[n-]1	ZINC000414451316	489499407	/nfs/dbraw/zinc/49/94/07/489499407.db2.gz	IBCIBNCSSNRYEG-UHFFFAOYSA-N	-2	3	369.359	0.846	20	5		FCBDHL
CCC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC)C(=O)[O-]	ZINC000417479043	489655888	/nfs/dbraw/zinc/65/58/88/489655888.db2.gz	ANSVFEDHGRJTKN-SNVBAGLBSA-N	-2	3	360.344	0.913	20	5		FCBDHL
COC(=O)Cc1nnc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2C)[n-]1	ZINC000460540373	489871871	/nfs/dbraw/zinc/87/18/71/489871871.db2.gz	TVCXPQZGVBHJJH-UHFFFAOYSA-N	-2	3	355.332	0.538	20	5		FCBDHL
Cc1ccc(S(=O)(=O)[N-]CCn2cc(C(=O)[O-])nn2)c([N+](=O)[O-])c1	ZINC000521528067	490272781	/nfs/dbraw/zinc/27/27/81/490272781.db2.gz	RGNQBLLHSHNQOY-UHFFFAOYSA-N	-2	3	355.332	0.171	20	5		FCBDHL
Cn1cc(C[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C(=O)[O-])cn1	ZINC000547893151	490379089	/nfs/dbraw/zinc/37/90/89/490379089.db2.gz	ZGEJTUPRTJPUIG-SNVBAGLBSA-N	-2	3	354.344	0.303	20	5		FCBDHL
O=C(NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1cncc([O-])c1	ZINC000522631209	490388504	/nfs/dbraw/zinc/38/85/04/490388504.db2.gz	PLFUFZKRRHSHBG-UHFFFAOYSA-N	-2	3	366.355	0.404	20	5		FCBDHL
CS(=O)(=O)c1nc([N-]C(=O)c2ccc([N+](=O)[O-])c3cccnc23)n[n-]1	ZINC000499115811	490389351	/nfs/dbraw/zinc/38/93/51/490389351.db2.gz	SSCINQYUCWIRDU-UHFFFAOYSA-N	-2	3	362.327	0.917	20	5		FCBDHL
Cc1nc(S(=O)(=O)[N-][C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])c[nH]1	ZINC000548206457	490438735	/nfs/dbraw/zinc/43/87/35/490438735.db2.gz	CLJOKYFWOZQBSS-NSHDSACASA-N	-2	3	354.344	0.601	20	5		FCBDHL
C[C@]1(C[C@@H]2CCCN2C(=O)c2cc([O-])cc([N+](=O)[O-])c2)NC(=O)[N-]C1=O	ZINC000557608883	491386706	/nfs/dbraw/zinc/38/67/06/491386706.db2.gz	JEZZCRZWPQHHNG-MGPLVRAMSA-N	-2	3	362.342	0.893	20	5		FCBDHL
C[C@H](CO[C@H]1CCOC1)[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000566316578	491435370	/nfs/dbraw/zinc/43/53/70/491435370.db2.gz	FOZOZMYFFMJZEX-KOLCDFICSA-N	-2	3	374.371	0.765	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](C(=O)[O-])[C@H]2CCOC2)c1[N+](=O)[O-]	ZINC000577036846	491582587	/nfs/dbraw/zinc/58/25/87/491582587.db2.gz	VCLPCKZGGLVLSN-QWRGUYRKSA-N	-2	3	358.372	0.980	20	5		FCBDHL
Cn1cc(CCC[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])cn1	ZINC000569367440	491656913	/nfs/dbraw/zinc/65/69/13/491656913.db2.gz	BTWSBUSLLYQKIN-UHFFFAOYSA-N	-2	3	368.371	0.938	20	5		FCBDHL
O=C([O-])[C@@H](O)C[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000581654533	491781698	/nfs/dbraw/zinc/78/16/98/491781698.db2.gz	IMJIBHDRQJLFOQ-ZETCQYMHSA-N	-2	3	358.250	0.337	20	5		FCBDHL
NC(=O)[C@H]([N-]S(=O)(=O)c1ccc([O-])c([N+](=O)[O-])c1)c1ccccc1	ZINC000590763043	491786035	/nfs/dbraw/zinc/78/60/35/491786035.db2.gz	LLOFNMGZFLPTRD-CYBMUJFWSA-N	-2	3	351.340	0.805	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](CCC(=O)[O-])C(=O)[O-])c1[N+](=O)[O-]	ZINC000616328741	492125938	/nfs/dbraw/zinc/12/59/38/492125938.db2.gz	XHMWPHVAXXUESD-SECBINFHSA-N	-3	3	360.344	0.808	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](CCF)C(=O)[O-]	ZINC000594573620	547001882	/nfs/dbraw/zinc/00/18/82/547001882.db2.gz	PAQRZBREDSZZCK-SECBINFHSA-N	-2	3	364.307	0.473	20	5		FCBDHL
COC(=O)c1ccc(S(=O)(=O)[N-][C@H](CCF)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000594573175	547001953	/nfs/dbraw/zinc/00/19/53/547001953.db2.gz	IOWPCWSRJDDCTE-SECBINFHSA-N	-2	3	364.307	0.473	20	5		FCBDHL
CC[C@@H]1C[C@H]1C(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001590869250	1283939876	/nfs/dbraw/zinc/93/98/76/1283939876.db2.gz	XUJPUWJYBGBKES-VXNVDRBHSA-N	-2	3	366.359	0.626	20	5		FCBDHL
O=[N+]([O-])c1cnccc1[N-]S(=O)(=O)c1ccc(-c2nnn[n-]2)c(F)c1	ZINC001593487848	1286176610	/nfs/dbraw/zinc/17/66/10/1286176610.db2.gz	SWQJHJHHEHGRHT-UHFFFAOYSA-N	-2	3	365.306	0.532	20	5		FCBDHL
O=[N+]([O-])c1cnccc1[N-]S(=O)(=O)c1ccc(-c2nn[n-]n2)c(F)c1	ZINC001593487848	1286176613	/nfs/dbraw/zinc/17/66/13/1286176613.db2.gz	SWQJHJHHEHGRHT-UHFFFAOYSA-N	-2	3	365.306	0.532	20	5		FCBDHL
O=c1[n-]c([C@@H]2CCCN(Cc3ccc(-c4nnn[n-]4)cc3[N+](=O)[O-])C2)n[nH]1	ZINC001593497982	1286180664	/nfs/dbraw/zinc/18/06/64/1286180664.db2.gz	ORBZFAUHOUKHMQ-LLVKDONJSA-N	-2	3	371.361	0.978	20	5		FCBDHL
O=c1[n-]c([C@@H]2CCCN(Cc3ccc(-c4nn[n-]n4)cc3[N+](=O)[O-])C2)n[nH]1	ZINC001593497982	1286180672	/nfs/dbraw/zinc/18/06/72/1286180672.db2.gz	ORBZFAUHOUKHMQ-LLVKDONJSA-N	-2	3	371.361	0.978	20	5		FCBDHL
O=c1[n-]c([C@H]2CCCN(c3ccc(-c4nnn[n-]4)c([N+](=O)[O-])c3)C2)n[nH]1	ZINC001593497748	1286181406	/nfs/dbraw/zinc/18/14/06/1286181406.db2.gz	KWMRUXJVSYSHMZ-QMMMGPOBSA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=c1[n-]c([C@H]2CCCN(c3ccc(-c4nn[n-]n4)c([N+](=O)[O-])c3)C2)n[nH]1	ZINC001593497748	1286181411	/nfs/dbraw/zinc/18/14/11/1286181411.db2.gz	KWMRUXJVSYSHMZ-QMMMGPOBSA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=c1[n-]c([C@H]2CCCN(c3ccc([N+](=O)[O-])cc3-c3nnn[n-]3)C2)n[nH]1	ZINC001593497926	1286181950	/nfs/dbraw/zinc/18/19/50/1286181950.db2.gz	NQKPXYPCAUMDOB-QMMMGPOBSA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=c1[n-]c([C@H]2CCCN(c3ccc([N+](=O)[O-])cc3-c3nn[n-]n3)C2)n[nH]1	ZINC001593497926	1286181952	/nfs/dbraw/zinc/18/19/52/1286181952.db2.gz	NQKPXYPCAUMDOB-QMMMGPOBSA-N	-2	3	357.334	0.983	20	5		FCBDHL
Cc1cc(S(=O)(=O)[N-][C@@]2(CC(=O)[O-])CCOC2)c([N+](=O)[O-])s1	ZINC001600297636	1286471791	/nfs/dbraw/zinc/47/17/91/1286471791.db2.gz	UQARUFMKRJWXMA-LLVKDONJSA-N	-2	3	350.374	0.877	20	5		FCBDHL
CC1(CC(=O)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC001609148597	1288949709	/nfs/dbraw/zinc/94/97/09/1288949709.db2.gz	DBMBYFJADFSKCN-UHFFFAOYSA-N	-2	3	366.359	0.770	20	5		FCBDHL
O=C([O-])C[C@H](O)C(=O)Oc1c([O-])cc(Br)cc1[N+](=O)[O-]	ZINC001234878194	857415110	/nfs/dbraw/zinc/41/51/10/857415110.db2.gz	SNPBBIBCMFIXBK-ZETCQYMHSA-N	-2	3	350.077	0.804	20	5		FCBDHL
Cc1cc(S(=O)(=O)[N-][C@H](C(=O)[O-])c2ccnn2C)c(F)cc1[N+](=O)[O-]	ZINC001594329234	958203117	/nfs/dbraw/zinc/20/31/17/958203117.db2.gz	WCUROXKOJRPUBR-LBPRGKRZSA-N	-2	3	372.334	0.880	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](CCC(N)=O)C(=O)[O-])c1[N+](=O)[O-]	ZINC000277352657	212352677	/nfs/dbraw/zinc/35/26/77/212352677.db2.gz	XQMIHCYWGHAWGT-VIFPVBQESA-N	-2	3	359.360	0.209	20	5		FCBDHL
O=C([O-])CCC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000278630230	488885768	/nfs/dbraw/zinc/88/57/68/488885768.db2.gz	IAWBGSVKGJDGJI-SECBINFHSA-N	-3	3	364.307	0.720	20	5		FCBDHL
O=C([O-])[C@H](Cc1c[nH]cn1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000324627899	488906245	/nfs/dbraw/zinc/90/62/45/488906245.db2.gz	SYFVKXWCAJMLBR-JTQLQIEISA-N	-2	3	358.307	0.431	20	5		FCBDHL
O=C([O-])[C@H](Cc1cnc[nH]1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000324627899	488906247	/nfs/dbraw/zinc/90/62/47/488906247.db2.gz	SYFVKXWCAJMLBR-JTQLQIEISA-N	-2	3	358.307	0.431	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C(=O)[O-])c1cnn(C)c1	ZINC000327075328	488917798	/nfs/dbraw/zinc/91/77/98/488917798.db2.gz	UKTSCVDWNVQTKF-GFCCVEGCSA-N	-2	3	370.343	0.441	20	5		FCBDHL
CC(C)OCCS(=O)(=O)[N-]CC(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000271497073	488522815	/nfs/dbraw/zinc/52/28/15/488522815.db2.gz	KSUUTWKSJZPGAX-UHFFFAOYSA-N	-2	3	361.376	0.583	20	5		FCBDHL
C[C@@]1(C(=O)[O-])CCN(C(=O)C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000263435031	488611891	/nfs/dbraw/zinc/61/18/91/488611891.db2.gz	OHYYQTKDCABLQA-CQSZACIVSA-N	-2	3	371.371	0.196	20	5		FCBDHL
CCn1cnnc1C[N-]S(=O)(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000273625562	488663051	/nfs/dbraw/zinc/66/30/51/488663051.db2.gz	BONSJWBZDSLHLR-UHFFFAOYSA-N	-2	3	355.332	0.383	20	5		FCBDHL
C[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)c1nncn1C	ZINC000273756903	488670220	/nfs/dbraw/zinc/67/02/20/488670220.db2.gz	VXOSFARHKYGETN-SSDOTTSWSA-N	-2	3	355.332	0.461	20	5		FCBDHL
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H](CC(=O)[O-])C(=O)[O-])cc1[N+](=O)[O-]	ZINC000274905488	488742441	/nfs/dbraw/zinc/74/24/41/488742441.db2.gz	JGOWMNBGCIFYID-ZETCQYMHSA-N	-3	3	366.735	0.763	20	5		FCBDHL
O=C([O-])[C@H]1C=C[C@H]([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000274916521	488743651	/nfs/dbraw/zinc/74/36/51/488743651.db2.gz	AAZBFTJAOODYCC-IUCAKERBSA-N	-2	3	370.339	0.674	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H](CC(=O)[O-])C(=O)[O-]	ZINC000274932000	488744898	/nfs/dbraw/zinc/74/48/98/488744898.db2.gz	DLGHKNLDTMEADT-ZETCQYMHSA-N	-3	3	362.316	0.057	20	5		FCBDHL
CCC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC)C(=O)[O-]	ZINC000274937154	488745501	/nfs/dbraw/zinc/74/55/01/488745501.db2.gz	QGIJBRDUYQIHCT-SNVBAGLBSA-N	-2	3	360.344	0.913	20	5		FCBDHL
Cn1cc(CCC[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])cn1	ZINC000414327310	489495958	/nfs/dbraw/zinc/49/59/58/489495958.db2.gz	YVZRLOBWRYZORF-UHFFFAOYSA-N	-2	3	368.371	0.938	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H]2CCCC(=O)N2)c1	ZINC000414340190	489496519	/nfs/dbraw/zinc/49/65/19/489496519.db2.gz	KLFHLWSPSOYZIA-VIFPVBQESA-N	-2	3	357.344	0.240	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H]2CCCC(=O)N2)c1	ZINC000414340189	489496863	/nfs/dbraw/zinc/49/68/63/489496863.db2.gz	KLFHLWSPSOYZIA-SECBINFHSA-N	-2	3	357.344	0.240	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@@H]2CCOC2)c1C	ZINC000547876265	490373737	/nfs/dbraw/zinc/37/37/37/490373737.db2.gz	YOUGNKLTOFSJDX-ZYHUDNBSSA-N	-2	3	358.372	0.980	20	5		FCBDHL
Cc1ccc(S(=O)(=O)[N-][C@H](C(=O)[O-])c2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000548200879	490436012	/nfs/dbraw/zinc/43/60/12/490436012.db2.gz	UMHFLTGNQVOYSF-LBPRGKRZSA-N	-2	3	354.344	0.741	20	5		FCBDHL
C[C@@H]([N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-])c1nncn1C	ZINC000565061934	491349784	/nfs/dbraw/zinc/34/97/84/491349784.db2.gz	QCJXMCNXFFANAM-SSDOTTSWSA-N	-2	3	355.332	0.461	20	5		FCBDHL
O=C(c1cc(Cl)cc([N+](=O)[O-])c1[O-])N1CCN2C(=O)[N-]C(=O)[C@@H]2C1	ZINC000516295550	490859976	/nfs/dbraw/zinc/85/99/76/490859976.db2.gz	TYGNKWGFLNBQIN-VIFPVBQESA-N	-2	3	354.706	0.330	20	5		FCBDHL
C[C@H](CO[C@H]1CCOC1)[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000519660094	490982907	/nfs/dbraw/zinc/98/29/07/490982907.db2.gz	WEJUKVQCLBSZJC-KOLCDFICSA-N	-2	3	374.371	0.765	20	5		FCBDHL
C[S@@](=O)CCC[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000574575997	491506438	/nfs/dbraw/zinc/50/64/38/491506438.db2.gz	DFIAZODYJBCBDM-OAQYLSRUSA-N	-2	3	350.374	0.340	20	5		FCBDHL
CCOC(=O)c1nc([N-]S(=O)(=O)c2cn(CC)nc2[N+](=O)[O-])c[n-]1	ZINC000585730903	491724422	/nfs/dbraw/zinc/72/44/22/491724422.db2.gz	OTEDWLRPOGBPNB-UHFFFAOYSA-N	-2	3	358.336	0.512	20	5		FCBDHL
CCOC(=O)c1ncc([N-]S(=O)(=O)c2cn(CC)nc2[N+](=O)[O-])[n-]1	ZINC000585730903	491724423	/nfs/dbraw/zinc/72/44/23/491724423.db2.gz	OTEDWLRPOGBPNB-UHFFFAOYSA-N	-2	3	358.336	0.512	20	5		FCBDHL
C[C@H](CO[C@H]1CCOC1)[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000593317286	546967119	/nfs/dbraw/zinc/96/71/19/546967119.db2.gz	REQVMGWXUOBMCF-ZJUUUORDSA-N	-2	3	374.371	0.765	20	5		FCBDHL
O=C([O-])CN(C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C1CCC1	ZINC000594464859	546999649	/nfs/dbraw/zinc/99/96/49/546999649.db2.gz	AUEFCNLVFJOVKM-UHFFFAOYSA-N	-2	3	371.371	0.339	20	5		FCBDHL
COCc1nc(C[N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])n[n-]1	ZINC000594828089	547015490	/nfs/dbraw/zinc/01/54/90/547015490.db2.gz	RFRMPIKLAHROPR-UHFFFAOYSA-N	-2	3	355.376	0.955	20	5		FCBDHL
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1n[nH]cc1-c1nnn[n-]1	ZINC000826272359	607462082	/nfs/dbraw/zinc/46/20/82/607462082.db2.gz	FTBCBRSAPFFSFR-UHFFFAOYSA-N	-2	3	350.320	0.607	20	5		FCBDHL
CCn1cc(S(=O)(=O)[N-]c2ccc(-c3nnn[n-]3)cn2)c([N+](=O)[O-])n1	ZINC000825805185	607692172	/nfs/dbraw/zinc/69/21/72/607692172.db2.gz	WNEDFXCGPSOWJL-UHFFFAOYSA-N	-2	3	365.335	0.187	20	5		FCBDHL
CCn1cc(S(=O)(=O)[N-]c2ccc(-c3nn[n-]n3)cn2)c([N+](=O)[O-])n1	ZINC000825805185	607692173	/nfs/dbraw/zinc/69/21/73/607692173.db2.gz	WNEDFXCGPSOWJL-UHFFFAOYSA-N	-2	3	365.335	0.187	20	5		FCBDHL
Cc1c([N-]S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])cnn1C	ZINC000822122116	606765165	/nfs/dbraw/zinc/76/51/65/606765165.db2.gz	JXKFSVJJVRNRET-UHFFFAOYSA-N	-2	3	364.347	0.618	20	5		FCBDHL
Cc1c([N-]S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])cnn1C	ZINC000822122116	606765167	/nfs/dbraw/zinc/76/51/67/606765167.db2.gz	JXKFSVJJVRNRET-UHFFFAOYSA-N	-2	3	364.347	0.618	20	5		FCBDHL
CCOCCS(=O)(=O)[N-]CC(=O)OCc1cc([O-])ccc1[N+](=O)[O-]	ZINC000837572076	670116877	/nfs/dbraw/zinc/11/68/77/670116877.db2.gz	IOYRWYKLHSOERN-UHFFFAOYSA-N	-2	3	362.360	0.300	20	5		FCBDHL
CCO[N-]C(=O)C[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000846003226	671065036	/nfs/dbraw/zinc/06/50/36/671065036.db2.gz	SWNJDHOJUWIMGY-UHFFFAOYSA-N	-2	3	371.293	0.960	20	5		FCBDHL
CC(C)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@H](O)C(=O)[O-]	ZINC001603685252	1287469667	/nfs/dbraw/zinc/46/96/67/1287469667.db2.gz	AAIHKTBOWKDMIE-SECBINFHSA-N	-2	3	352.752	0.751	20	5		FCBDHL
CC(C)(C(=O)[N-]Oc1cccc(-c2nnn[n-]2)c1)n1cc([N+](=O)[O-])cn1	ZINC001589054561	1282786558	/nfs/dbraw/zinc/78/65/58/1282786558.db2.gz	IOXOCLWJLGULCX-UHFFFAOYSA-N	-2	3	358.318	0.817	20	5		FCBDHL
CC(C)(C(=O)[N-]Oc1cccc(-c2nn[n-]n2)c1)n1cc([N+](=O)[O-])cn1	ZINC001589054561	1282786566	/nfs/dbraw/zinc/78/65/66/1282786566.db2.gz	IOXOCLWJLGULCX-UHFFFAOYSA-N	-2	3	358.318	0.817	20	5		FCBDHL
CNC(=O)Cn1nc([N-]c2nccc(-c3nnn[n-]3)c2[N+](=O)[O-])cc1C	ZINC001609288476	1289056649	/nfs/dbraw/zinc/05/66/49/1289056649.db2.gz	SQXJVQBQCXHJEC-UHFFFAOYSA-N	-2	3	358.322	0.164	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)C1CCC1	ZINC001609560546	1289224541	/nfs/dbraw/zinc/22/45/41/1289224541.db2.gz	USCUCZJWHRMTHM-UHFFFAOYSA-N	-2	3	352.332	0.380	20	5		FCBDHL
O=[N+]([O-])c1c([O-])cc([O-])cc1O[C@@H](C[n+]1ccccc1)CS(=O)(=O)[O-]	ZINC001228975235	857241570	/nfs/dbraw/zinc/24/15/70/857241570.db2.gz	YRGRBHVYJOJRHH-NSHDSACASA-O	-2	3	371.347	0.629	20	5		FCBDHL
C[C@](O)(C[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC001603262709	972448181	/nfs/dbraw/zinc/44/81/81/972448181.db2.gz	BQMKDFOCKJCPBU-JTQLQIEISA-N	-2	3	372.277	0.728	20	5		FCBDHL
CCC[C@@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)[O-]	ZINC000262632906	488583408	/nfs/dbraw/zinc/58/34/08/488583408.db2.gz	FQZCNDRAGUNDAQ-MRVPVSSYSA-N	-2	3	360.344	0.898	20	5		FCBDHL
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H](CC(=O)[O-])C(=O)[O-])cc1[N+](=O)[O-]	ZINC000274905485	488742221	/nfs/dbraw/zinc/74/22/21/488742221.db2.gz	JGOWMNBGCIFYID-SSDOTTSWSA-N	-3	3	366.735	0.763	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C(=O)[O-])C(C)C	ZINC000275005354	488752815	/nfs/dbraw/zinc/75/28/15/488752815.db2.gz	BDKIHDXFYHWGFU-NSHDSACASA-N	-2	3	360.344	0.769	20	5		FCBDHL
O=C([O-])[C@H](CCO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000275108222	488762491	/nfs/dbraw/zinc/76/24/91/488762491.db2.gz	ROGQNGZHXOWBIA-QMMMGPOBSA-N	-2	3	372.277	0.728	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CCC(N)=O)C(=O)[O-])cc1C	ZINC000275150117	488766736	/nfs/dbraw/zinc/76/67/36/488766736.db2.gz	YMWUUPUQRITARO-SECBINFHSA-N	-2	3	359.360	0.209	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CCC(N)=O)C(=O)[O-])cc1C	ZINC000275150129	488766831	/nfs/dbraw/zinc/76/68/31/488766831.db2.gz	YMWUUPUQRITARO-VIFPVBQESA-N	-2	3	359.360	0.209	20	5		FCBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](Cc1cnn(C)c1)C(=O)[O-]	ZINC000275189617	488770729	/nfs/dbraw/zinc/77/07/29/488770729.db2.gz	FJPVHJQCVXODHA-LLVKDONJSA-N	-2	3	368.371	0.611	20	5		FCBDHL
COC(=O)CC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000275198491	488771808	/nfs/dbraw/zinc/77/18/08/488771808.db2.gz	GJBJVNCWMKUXRW-VIFPVBQESA-N	-2	3	364.307	0.419	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-]CCC(=O)NCC(=O)[O-])c1[N+](=O)[O-]	ZINC000278161124	488803697	/nfs/dbraw/zinc/80/36/97/488803697.db2.gz	CFLWNJXKBMRCBN-UHFFFAOYSA-N	-2	3	359.360	0.081	20	5		FCBDHL
C[C@H](Cn1cncn1)[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000570454192	491242225	/nfs/dbraw/zinc/24/22/25/491242225.db2.gz	APWVJKIEZZRNOI-MRVPVSSYSA-N	-2	3	355.332	0.252	20	5		FCBDHL
COC(=O)C[C@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000299039158	489398436	/nfs/dbraw/zinc/39/84/36/489398436.db2.gz	JHPALUFSQIFXOM-VIFPVBQESA-N	-2	3	360.344	0.506	20	5		FCBDHL
CCn1cnnc1C[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000519816921	490088896	/nfs/dbraw/zinc/08/88/96/490088896.db2.gz	HPGPWSGRTQNBIP-UHFFFAOYSA-N	-2	3	355.332	0.383	20	5		FCBDHL
COC(=O)C[C@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000390032475	490135507	/nfs/dbraw/zinc/13/55/07/490135507.db2.gz	YXOUJJSZIFBBET-ZETCQYMHSA-N	-2	3	366.735	0.543	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-]Cc2cn(CC(=O)[O-])nn2)cc1[N+](=O)[O-]	ZINC000547911697	490384866	/nfs/dbraw/zinc/38/48/66/490384866.db2.gz	SFCOACJTRLPDGR-UHFFFAOYSA-N	-2	3	361.361	0.119	20	5		FCBDHL
C[N-]S(=O)(=O)c1ccc(CNC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)s1	ZINC000484258751	490405537	/nfs/dbraw/zinc/40/55/37/490405537.db2.gz	LYPJMOZJCXZGEW-UHFFFAOYSA-N	-2	3	372.384	0.595	20	5		FCBDHL
C[C@]1(C[C@H]2CCCN2C(=O)c2cc([O-])ccc2[N+](=O)[O-])NC(=O)[N-]C1=O	ZINC000557608912	491386793	/nfs/dbraw/zinc/38/67/93/491386793.db2.gz	KFUVSGVHQOLDFB-JDNHERCYSA-N	-2	3	362.342	0.893	20	5		FCBDHL
CC(C)[C@H](C(=O)[O-])C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000567987560	491545057	/nfs/dbraw/zinc/54/50/57/491545057.db2.gz	GBHMZZRMKHFAFD-LBPRGKRZSA-N	-2	3	373.387	0.346	20	5		FCBDHL
COC[C@@H]([N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000568843476	491613010	/nfs/dbraw/zinc/61/30/10/491613010.db2.gz	KSDMEJVEGHAMMH-SSDOTTSWSA-N	-2	3	372.277	0.992	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C(=O)[O-])[C@H]1CCCOC1	ZINC000577722068	491646091	/nfs/dbraw/zinc/64/60/91/491646091.db2.gz	FSNCENLVWYNCDN-ZANVPECISA-N	-2	3	374.371	0.762	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@H](C(=O)[O-])[C@H]2CCCOC2)c([N+](=O)[O-])c1	ZINC000569450028	491662104	/nfs/dbraw/zinc/66/21/04/491662104.db2.gz	RUJPYOINHOULJQ-ZANVPECISA-N	-2	3	374.371	0.762	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]CCN2CCCOCC2)c([N+](=O)[O-])c1	ZINC000578240676	491673065	/nfs/dbraw/zinc/67/30/65/491673065.db2.gz	CGCBDXTZAMQLGM-UHFFFAOYSA-N	-2	3	373.387	0.294	20	5		FCBDHL
C[C@H](O)[C@@H]([N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000581357268	491769706	/nfs/dbraw/zinc/76/97/06/491769706.db2.gz	ZALXPAYTTWTAMK-SSDLBLMSSA-N	-2	3	372.277	0.726	20	5		FCBDHL
O=C(NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ncccc1[O-]	ZINC000609743216	492221132	/nfs/dbraw/zinc/22/11/32/492221132.db2.gz	HUQAHRAJCBHOAE-UHFFFAOYSA-N	-2	3	366.355	0.404	20	5		FCBDHL
C[C@@H](CO[C@@H]1CCOC1)[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000593317285	546966629	/nfs/dbraw/zinc/96/66/29/546966629.db2.gz	REQVMGWXUOBMCF-VHSXEESVSA-N	-2	3	374.371	0.765	20	5		FCBDHL
Cc1cc([N-]S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])nn1C	ZINC000826271497	607664254	/nfs/dbraw/zinc/66/42/54/607664254.db2.gz	UNKPVAVKJDGPGD-UHFFFAOYSA-N	-2	3	364.347	0.618	20	5		FCBDHL
Cc1cc([N-]S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])nn1C	ZINC000826271497	607664256	/nfs/dbraw/zinc/66/42/56/607664256.db2.gz	UNKPVAVKJDGPGD-UHFFFAOYSA-N	-2	3	364.347	0.618	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1c[nH]c(-c2nnn[n-]2)c1	ZINC000826450331	669494062	/nfs/dbraw/zinc/49/40/62/669494062.db2.gz	HDDJIPZDOCLUKL-UHFFFAOYSA-N	-2	3	363.315	0.222	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1c[nH]c(-c2nn[n-]n2)c1	ZINC000826450331	669494068	/nfs/dbraw/zinc/49/40/68/669494068.db2.gz	HDDJIPZDOCLUKL-UHFFFAOYSA-N	-2	3	363.315	0.222	20	5		FCBDHL
Cc1cc(N2C[C@@H]3COC[C@]3(C(=O)[O-])C2)cc(-c2nnn[n-]2)c1[N+](=O)[O-]	ZINC001592010424	1285058830	/nfs/dbraw/zinc/05/88/30/1285058830.db2.gz	FRNPMJTZPBJFEG-RFAUZJTJSA-N	-2	3	360.330	0.621	20	5		FCBDHL
O=C([O-])[C@@H](CC1OCCO1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC001601646762	1286799083	/nfs/dbraw/zinc/79/90/83/1286799083.db2.gz	XOZXGJPZQNAHMW-SECBINFHSA-N	-2	3	364.307	0.228	20	5		FCBDHL
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)Oc1ccccc1	ZINC001602170004	1286956858	/nfs/dbraw/zinc/95/68/58/1286956858.db2.gz	URDJSKMKRVLSJD-GFCCVEGCSA-N	-2	3	367.339	0.800	20	5		FCBDHL
CO[C@@H]1CCC[C@@H]([C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C(=O)[O-])C1	ZINC001606739895	1288480220	/nfs/dbraw/zinc/48/02/20/1288480220.db2.gz	OODYUPYQYOFFEO-XWIASGKRSA-N	-2	3	373.387	0.927	20	5		FCBDHL
O=C([O-])CC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000321258032	488900860	/nfs/dbraw/zinc/90/08/60/488900860.db2.gz	XXPJEMBLFVZKDN-QMMMGPOBSA-N	-3	3	366.735	0.845	20	5		FCBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](Cc1c[nH]cn1)C(=O)[O-]	ZINC000325110932	488908624	/nfs/dbraw/zinc/90/86/24/488908624.db2.gz	FFQMWQNBTGAQAX-SNVBAGLBSA-N	-2	3	354.344	0.601	20	5		FCBDHL
C[C@@H](O)[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000274906505	488742788	/nfs/dbraw/zinc/74/27/88/488742788.db2.gz	JNCJLVQDZZZPCX-ANLVUFKYSA-N	-2	3	372.277	0.726	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1C=C[C@H](C(=O)[O-])C1	ZINC000274952603	488747415	/nfs/dbraw/zinc/74/74/15/488747415.db2.gz	GOCFDZJNKCBWIV-DTWKUNHWSA-N	-2	3	370.339	0.689	20	5		FCBDHL
CC(C)(C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)[O-]	ZINC000275261297	488777989	/nfs/dbraw/zinc/77/79/89/488777989.db2.gz	MHFIQISONBZNCW-UHFFFAOYSA-N	-2	3	360.344	0.755	20	5		FCBDHL
Cc1noc(CC[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])n1	ZINC000414315241	489495420	/nfs/dbraw/zinc/49/54/20/489495420.db2.gz	FRRMHVJLBCJBSS-UHFFFAOYSA-N	-2	3	356.316	0.505	20	5		FCBDHL
C[C@]1(C[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])CCC(=O)N1	ZINC000414345070	489497080	/nfs/dbraw/zinc/49/70/80/489497080.db2.gz	LAVNKOBKOZTTCD-CYBMUJFWSA-N	-2	3	357.344	0.240	20	5		FCBDHL
COC(=O)Cc1nnc([N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])[n-]1	ZINC000414462718	489499872	/nfs/dbraw/zinc/49/98/72/489499872.db2.gz	YTHAEWKSVGDZQC-UHFFFAOYSA-N	-2	3	369.359	0.846	20	5		FCBDHL
COC(=O)Cc1nnc([N-]S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)[n-]1	ZINC000414460097	489499928	/nfs/dbraw/zinc/49/99/28/489499928.db2.gz	WCBGZKOOMGQJEH-UHFFFAOYSA-N	-2	3	369.359	0.846	20	5		FCBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C(=O)[O-])c1cnn(C)c1	ZINC000392481574	490151628	/nfs/dbraw/zinc/15/16/28/490151628.db2.gz	AKJVAWSYIXKNOE-LLVKDONJSA-N	-2	3	354.344	0.741	20	5		FCBDHL
Cn1cnc(S(=O)(=O)[N-][C@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])c1	ZINC000547900177	490380644	/nfs/dbraw/zinc/38/06/44/490380644.db2.gz	NWNSNUMVDSQSFZ-LLVKDONJSA-N	-2	3	354.344	0.303	20	5		FCBDHL
Cc1cnn(C[C@H]([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C(=O)[O-])c1	ZINC000548203848	490437891	/nfs/dbraw/zinc/43/78/91/490437891.db2.gz	XVODEFIKGNGVKW-VIFPVBQESA-N	-2	3	374.400	0.901	20	5		FCBDHL
O=C([O-])[C@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br	ZINC000548528121	490496525	/nfs/dbraw/zinc/49/65/25/490496525.db2.gz	CBSAZHKVVJPIBA-ZETCQYMHSA-N	-2	3	369.149	0.081	20	5		FCBDHL
CS(=O)(=O)CCC[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000573211613	491419273	/nfs/dbraw/zinc/41/92/73/491419273.db2.gz	XEQWLYQNHKZKBF-UHFFFAOYSA-N	-2	3	366.373	0.006	20	5		FCBDHL
CC(C)C(=O)NCC[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000568872161	491615673	/nfs/dbraw/zinc/61/56/73/491615673.db2.gz	VHXZUACNINONOV-UHFFFAOYSA-N	-2	3	359.360	0.344	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]CC(=O)N2CCCCC2)c1[N+](=O)[O-]	ZINC000568889839	491617241	/nfs/dbraw/zinc/61/72/41/491617241.db2.gz	XMVXOGRJGQLPCT-UHFFFAOYSA-N	-2	3	371.371	0.584	20	5		FCBDHL
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])[C@H]1OC	ZINC000580571375	491736767	/nfs/dbraw/zinc/73/67/67/491736767.db2.gz	HREQHAYUBBFFLR-GIPNMCIBSA-N	-2	3	374.371	0.764	20	5		FCBDHL
Cc1nc(S(=O)(=O)[N-][C@@](C)(C(=O)[O-])c2cccc([N+](=O)[O-])c2)cn1C	ZINC000600666210	491874488	/nfs/dbraw/zinc/87/44/88/491874488.db2.gz	NDCCJWBHXYQTIE-CQSZACIVSA-N	-2	3	368.371	0.915	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1([C@H](C)C(=O)[O-])CC1	ZINC000593274735	546964304	/nfs/dbraw/zinc/96/43/04/546964304.db2.gz	VINXEQHGBBQOFR-MRVPVSSYSA-N	-2	3	372.355	0.913	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1([C@@H](C)C(=O)[O-])CC1	ZINC000593274736	546964400	/nfs/dbraw/zinc/96/44/00/546964400.db2.gz	VINXEQHGBBQOFR-QMMMGPOBSA-N	-2	3	372.355	0.913	20	5		FCBDHL
C[C@@H](CO[C@H]1CCOC1)[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000593317284	546966842	/nfs/dbraw/zinc/96/68/42/546966842.db2.gz	REQVMGWXUOBMCF-UWVGGRQHSA-N	-2	3	374.371	0.765	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2CCCC(=O)N2)c([N+](=O)[O-])c1	ZINC000593310073	546966884	/nfs/dbraw/zinc/96/68/84/546966884.db2.gz	LVZRWOLZLHKSPU-VIFPVBQESA-N	-2	3	357.344	0.240	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1cc([N+](=O)[O-])cs1)c1ccc(-c2nn[n-]n2)[nH]1	ZINC000826450252	607778234	/nfs/dbraw/zinc/77/82/34/607778234.db2.gz	DCKJIZGMAWRWSM-UHFFFAOYSA-N	-2	3	369.344	0.283	20	5		FCBDHL
O=c1[n-]c(CNc2cc(-c3nnn[n-]3)c3cc([N+](=O)[O-])ccc3n2)n[nH]1	ZINC000826501503	607522015	/nfs/dbraw/zinc/52/20/15/607522015.db2.gz	SYLYKAHAAYBMNL-UHFFFAOYSA-N	-2	3	354.290	0.759	20	5		FCBDHL
O=c1[n-]c(CNc2cc(-c3nn[n-]n3)c3cc([N+](=O)[O-])ccc3n2)n[nH]1	ZINC000826501503	607522016	/nfs/dbraw/zinc/52/20/16/607522016.db2.gz	SYLYKAHAAYBMNL-UHFFFAOYSA-N	-2	3	354.290	0.759	20	5		FCBDHL
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]c1nn(C)cc1-c1nnn[n-]1	ZINC000822130863	606709190	/nfs/dbraw/zinc/70/91/90/606709190.db2.gz	ZMEDDUNLWHGWBH-UHFFFAOYSA-N	-2	3	364.347	0.618	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1cc([N+](=O)[O-])cs1)c1ccc(-c2nnn[n-]2)[nH]1	ZINC000826450252	607778233	/nfs/dbraw/zinc/77/82/33/607778233.db2.gz	DCKJIZGMAWRWSM-UHFFFAOYSA-N	-2	3	369.344	0.283	20	5		FCBDHL
CCC=C(C)C(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001590536134	1283596255	/nfs/dbraw/zinc/59/62/55/1283596255.db2.gz	VLWKIZBJEYFSPO-YWEYNIOJSA-N	-2	3	366.359	0.936	20	5		FCBDHL
COCCCC(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001591407349	1284549654	/nfs/dbraw/zinc/54/96/54/1284549654.db2.gz	KHVCCTFJOZTVSN-UHFFFAOYSA-N	-2	3	370.347	0.006	20	5		FCBDHL
Cc1cc(S(=O)(=O)[N-]C2(C(=O)[O-])CC(CO)C2)c(F)cc1[N+](=O)[O-]	ZINC001600296903	1286471754	/nfs/dbraw/zinc/47/17/54/1286471754.db2.gz	HHASEOLPCDIFFY-UHFFFAOYSA-N	-2	3	362.335	0.546	20	5		FCBDHL
O=C([O-])[C@H](Cn1cncn1)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC001601661813	1286804115	/nfs/dbraw/zinc/80/41/15/1286804115.db2.gz	BZHWHCIJARFKOC-JTQLQIEISA-N	-2	3	355.257	0.548	20	5		FCBDHL
O=c1[n-]c(C2CCN(c3ccc([N+](=O)[O-])cc3-c3nnn[n-]3)CC2)n[nH]1	ZINC001607090787	1288656727	/nfs/dbraw/zinc/65/67/27/1288656727.db2.gz	VHVOJTYBGZJPSO-UHFFFAOYSA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=c1[n-]c(C2CCN(c3ccc([N+](=O)[O-])cc3-c3nn[n-]n3)CC2)n[nH]1	ZINC001607090787	1288656728	/nfs/dbraw/zinc/65/67/28/1288656728.db2.gz	VHVOJTYBGZJPSO-UHFFFAOYSA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=C([O-])C1([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC(CO)C1	ZINC001608577782	1288856790	/nfs/dbraw/zinc/85/67/90/1288856790.db2.gz	ZNIYQDZUPIERBU-UHFFFAOYSA-N	-2	3	364.763	0.752	20	5		FCBDHL
C[C@@]1([N-]C(=O)C(F)(F)F)CCN(C(=O)c2cc([N+](=O)[O-])c[n-]c2=O)C1	ZINC001306886753	866636536	/nfs/dbraw/zinc/63/65/36/866636536.db2.gz	BLFOWAZGZYTSTL-GFCCVEGCSA-N	-2	3	362.264	0.979	20	5		FCBDHL
O=C([O-])CN1CCC(NS(=O)(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC1	ZINC001595081330	951682026	/nfs/dbraw/zinc/68/20/26/951682026.db2.gz	QOQBWHLNERLIPQ-UHFFFAOYSA-N	-2	3	359.360	0.128	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@](C)(CO)CC(=O)[O-])c1[N+](=O)[O-]	ZINC000277319524	212349412	/nfs/dbraw/zinc/34/94/12/212349412.db2.gz	UFGPUZOVQMJICF-CQSZACIVSA-N	-2	3	360.388	0.963	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC(C)(C)C(=O)[O-]	ZINC000275175963	488769078	/nfs/dbraw/zinc/76/90/78/488769078.db2.gz	CRVHOJOUTYVIFP-UHFFFAOYSA-N	-2	3	360.344	0.771	20	5		FCBDHL
C[C@H](Cn1cncn1)[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414319969	489495914	/nfs/dbraw/zinc/49/59/14/489495914.db2.gz	OQCPJPZELGCJAF-MRVPVSSYSA-N	-2	3	355.332	0.252	20	5		FCBDHL
COC(=O)[C@@H](CC1CC1)[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414356150	489497658	/nfs/dbraw/zinc/49/76/58/489497658.db2.gz	YPBQTMWEXOUMFE-SNVBAGLBSA-N	-2	3	372.355	0.913	20	5		FCBDHL
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C(=O)[O-])C(C)C	ZINC000417435291	489653484	/nfs/dbraw/zinc/65/34/84/489653484.db2.gz	YDEYUULKLKQROA-LLVKDONJSA-N	-2	3	360.344	0.769	20	5		FCBDHL
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C(=O)[O-])C(C)C	ZINC000417435300	489653633	/nfs/dbraw/zinc/65/36/33/489653633.db2.gz	YDEYUULKLKQROA-NSHDSACASA-N	-2	3	360.344	0.769	20	5		FCBDHL
Cc1cc(=O)n2[n-]c([N-]S(=O)(=O)c3ccc([N+](=O)[O-])s3)nc2n1	ZINC000484425838	490425373	/nfs/dbraw/zinc/42/53/73/490425373.db2.gz	JYLMJWVZEJJDBS-UHFFFAOYSA-N	-2	3	356.345	0.497	20	5		FCBDHL
Cc1cc(=O)n2[n-]c([N-]S(=O)(=O)c3ccccc3[N+](=O)[O-])nc2n1	ZINC000484445059	490429605	/nfs/dbraw/zinc/42/96/05/490429605.db2.gz	KJWXRDYGVFFMTN-UHFFFAOYSA-N	-2	3	350.316	0.435	20	5		FCBDHL
Cc1cnn(C[C@@H]([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C(=O)[O-])c1	ZINC000548203759	490437740	/nfs/dbraw/zinc/43/77/40/490437740.db2.gz	XVODEFIKGNGVKW-SECBINFHSA-N	-2	3	374.400	0.901	20	5		FCBDHL
COC(=O)CC[C@@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000548226121	490444996	/nfs/dbraw/zinc/44/49/96/490444996.db2.gz	MJKBYHRWJRPWOO-SECBINFHSA-N	-2	3	360.344	0.588	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C(=O)[O-])C1CC1	ZINC000548555346	490505238	/nfs/dbraw/zinc/50/52/38/490505238.db2.gz	FYMDNUPNWVNAOM-NSHDSACASA-N	-2	3	358.328	0.523	20	5		FCBDHL
O=C(c1cccc([O-])c1)N1CCN(C(=O)c2cc([N+](=O)[O-])c[n-]c2=O)CC1	ZINC000513265287	490717928	/nfs/dbraw/zinc/71/79/28/490717928.db2.gz	ALIPOHOOMLZWRR-UHFFFAOYSA-N	-2	3	372.337	0.999	20	5		FCBDHL
C[C@H](CN1CCOCC1)[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000515064462	490806461	/nfs/dbraw/zinc/80/64/61/490806461.db2.gz	PQPUYATVOFBUKF-SNVBAGLBSA-N	-2	3	373.387	0.292	20	5		FCBDHL
O=C(C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])Nc1ncccc1[O-]	ZINC000540567018	490828391	/nfs/dbraw/zinc/82/83/91/490828391.db2.gz	KQGXUBXDBFVFRU-UHFFFAOYSA-N	-2	3	352.328	0.612	20	5		FCBDHL
COC(=O)[C@H](CC1CC1)[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000573377722	491429816	/nfs/dbraw/zinc/42/98/16/491429816.db2.gz	URAHRTKRKKRAAL-JTQLQIEISA-N	-2	3	372.355	0.913	20	5		FCBDHL
CCOC(=O)[C@@H](C)C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000573689319	491448635	/nfs/dbraw/zinc/44/86/35/491448635.db2.gz	PULXSCRNEHHVRM-QMMMGPOBSA-N	-2	3	360.344	0.771	20	5		FCBDHL
CN1C[C@@H]([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])CCC1=O	ZINC000567357185	491501687	/nfs/dbraw/zinc/50/16/87/491501687.db2.gz	BEGVCYFIAYIEQN-VIFPVBQESA-N	-2	3	357.344	0.192	20	5		FCBDHL
CSC[C@](C)(O)C[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000568006708	491546950	/nfs/dbraw/zinc/54/69/50/491546950.db2.gz	OKCUTGCLZAHZRW-GFCCVEGCSA-N	-2	3	364.401	0.685	20	5		FCBDHL
C[C@@H]([N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-])C(=O)NC(C)(C)C	ZINC000576164198	491588234	/nfs/dbraw/zinc/58/82/34/491588234.db2.gz	OPQNLQZTPAHIHF-MRVPVSSYSA-N	-2	3	373.387	0.875	20	5		FCBDHL
O=C([O-])COCC[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000584278943	491862115	/nfs/dbraw/zinc/86/21/15/491862115.db2.gz	SRHRNRJMXLGFCJ-UHFFFAOYSA-N	-2	3	372.277	0.993	20	5		FCBDHL
O=C([O-])C1(CNC(=O)C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCC1	ZINC000595999014	491971072	/nfs/dbraw/zinc/97/10/72/491971072.db2.gz	HKQMQHXKAMQTON-UHFFFAOYSA-N	-2	3	371.371	0.244	20	5		FCBDHL
COc1c(F)cc(S(=O)(=O)[N-]C[C@H](CC(=O)[O-])OC)cc1[N+](=O)[O-]	ZINC000616333634	492126311	/nfs/dbraw/zinc/12/63/11/492126311.db2.gz	UBIUNLZNSFCZEG-ZETCQYMHSA-N	-2	3	366.323	0.511	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCC(=O)NCC(=O)[O-])c1C	ZINC000278197682	546902162	/nfs/dbraw/zinc/90/21/62/546902162.db2.gz	GTVMRHFGTHESPG-UHFFFAOYSA-N	-2	3	359.360	0.081	20	5		FCBDHL
C[C@H](C(=O)[O-])C1([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000593273657	546964582	/nfs/dbraw/zinc/96/45/82/546964582.db2.gz	KPBQOWLXMOFYIV-MRVPVSSYSA-N	-2	3	372.355	0.898	20	5		FCBDHL
CC(=O)N1CCC([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1	ZINC000593312324	546965697	/nfs/dbraw/zinc/96/56/97/546965697.db2.gz	DNWSXAWNOOGFJJ-UHFFFAOYSA-N	-2	3	371.371	0.582	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]C[C@@H]2CCCC(=O)N2)c1[N+](=O)[O-]	ZINC000593310106	546966475	/nfs/dbraw/zinc/96/64/75/546966475.db2.gz	NVRIRVGIDVQUBT-QMMMGPOBSA-N	-2	3	357.344	0.240	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2CCCC(=O)N2)c([N+](=O)[O-])c1	ZINC000593310072	546967142	/nfs/dbraw/zinc/96/71/42/546967142.db2.gz	LVZRWOLZLHKSPU-SECBINFHSA-N	-2	3	357.344	0.240	20	5		FCBDHL
Cc1cnc(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2-c2nnn[n-]2)o1	ZINC000826318628	607658256	/nfs/dbraw/zinc/65/82/56/607658256.db2.gz	SKXWWYFEPATEPL-UHFFFAOYSA-N	-2	3	365.331	0.550	20	5		FCBDHL
Cc1cnc(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2-c2nn[n-]n2)o1	ZINC000826318628	607658258	/nfs/dbraw/zinc/65/82/58/607658258.db2.gz	SKXWWYFEPATEPL-UHFFFAOYSA-N	-2	3	365.331	0.550	20	5		FCBDHL
CCC1(C(=O)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC001609196368	1288979512	/nfs/dbraw/zinc/97/95/12/1288979512.db2.gz	FRJRKUHTMFOOSL-UHFFFAOYSA-N	-2	3	366.359	0.770	20	5		FCBDHL
O=C(CC1CC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001609520368	1289191864	/nfs/dbraw/zinc/19/18/64/1289191864.db2.gz	PHZZCWHFZUZSDT-UHFFFAOYSA-N	-2	3	352.332	0.380	20	5		FCBDHL
C[C@]1([N-]C(=O)C(F)(F)F)CCN(C(=O)c2cc([N+](=O)[O-])c[n-]c2=O)C1	ZINC001306886759	866636623	/nfs/dbraw/zinc/63/66/23/866636623.db2.gz	BLFOWAZGZYTSTL-LBPRGKRZSA-N	-2	3	362.264	0.979	20	5		FCBDHL
Cc1cc(S(=O)(=O)[N-]C2(C(=O)[O-])CCOCC2)c([N+](=O)[O-])s1	ZINC001594329218	958203189	/nfs/dbraw/zinc/20/31/89/958203189.db2.gz	UAIVFBQUOXMFSC-UHFFFAOYSA-N	-2	3	350.374	0.877	20	5		FCBDHL
COC(=O)C[C@@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000297241510	214388496	/nfs/dbraw/zinc/38/84/96/214388496.db2.gz	PTRIZBACQLMJBA-SECBINFHSA-N	-2	3	360.344	0.506	20	5		FCBDHL
CCOC[C@@H]([N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000291005990	214009125	/nfs/dbraw/zinc/00/91/25/214009125.db2.gz	UJCMIFAOORFUQZ-SECBINFHSA-N	-2	3	366.323	0.511	20	5		FCBDHL
C[C@]1(C[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2[O-])NC(=O)[N-]C1=O	ZINC000288066324	488939899	/nfs/dbraw/zinc/93/98/99/488939899.db2.gz	YPIGKIYLZGCTET-QLJPJBMISA-N	-2	3	362.342	0.893	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H](CC(=O)[O-])C(=O)[O-]	ZINC000274931998	488744886	/nfs/dbraw/zinc/74/48/86/488744886.db2.gz	DLGHKNLDTMEADT-SSDOTTSWSA-N	-3	3	362.316	0.057	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C(=O)[O-])C(C)C	ZINC000275005345	488752584	/nfs/dbraw/zinc/75/25/84/488752584.db2.gz	BDKIHDXFYHWGFU-LLVKDONJSA-N	-2	3	360.344	0.769	20	5		FCBDHL
O=C([O-])C[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000275046813	488756344	/nfs/dbraw/zinc/75/63/44/488756344.db2.gz	WKDYYGYEIWWDMJ-LURJTMIESA-N	-3	3	350.280	0.188	20	5		FCBDHL
O=C([O-])C[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000275046815	488756400	/nfs/dbraw/zinc/75/64/00/488756400.db2.gz	WKDYYGYEIWWDMJ-ZCFIWIBFSA-N	-3	3	350.280	0.188	20	5		FCBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](Cc1cnn(C)c1)C(=O)[O-]	ZINC000275189618	488770597	/nfs/dbraw/zinc/77/05/97/488770597.db2.gz	FJPVHJQCVXODHA-NSHDSACASA-N	-2	3	368.371	0.611	20	5		FCBDHL
CO[C@H]1COCC[C@@H]1C[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000570401406	491238541	/nfs/dbraw/zinc/23/85/41/491238541.db2.gz	RRQKPZNCFNDTRU-KOLCDFICSA-N	-2	3	374.371	0.623	20	5		FCBDHL
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1nnc(CC(=O)OC)[n-]1	ZINC000414450702	489499456	/nfs/dbraw/zinc/49/94/56/489499456.db2.gz	GRKMZNQKSLRVEE-UHFFFAOYSA-N	-2	3	369.359	0.792	20	5		FCBDHL
O=C([O-])[C@@H](CF)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000571044112	491282344	/nfs/dbraw/zinc/28/23/44/491282344.db2.gz	XPLROPUCSGVAMB-ZCFIWIBFSA-N	-2	3	350.280	0.067	20	5		FCBDHL
O=C1[N-]C(=O)c2cc(S(=O)(=O)[N-]c3cc([N+](=O)[O-])ccc3O)ccc21	ZINC000467767576	490338597	/nfs/dbraw/zinc/33/85/97/490338597.db2.gz	GRGSYMJYZYNFLB-UHFFFAOYSA-N	-2	3	363.307	0.985	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C(=O)[O-])[C@H]1CCOC1	ZINC000547877980	490373999	/nfs/dbraw/zinc/37/39/99/490373999.db2.gz	TVHYQWQSLZQYSU-UFBFGSQYSA-N	-2	3	360.344	0.371	20	5		FCBDHL
CCC[C@@H](O)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(=O)[O-]	ZINC000548593332	490515050	/nfs/dbraw/zinc/51/50/50/490515050.db2.gz	ZQCSNNJHAOLRRP-BXKDBHETSA-N	-2	3	362.360	0.496	20	5		FCBDHL
CCC[C@@H](O)[C@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000548593240	490515083	/nfs/dbraw/zinc/51/50/83/490515083.db2.gz	ZBXIAXRRJGBOFQ-PWSUYJOCSA-N	-2	3	362.360	0.496	20	5		FCBDHL
O=C([O-])C1(C[N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CCC1	ZINC000556773605	491335604	/nfs/dbraw/zinc/33/56/04/491335604.db2.gz	LGEGMGILRZXWBQ-UHFFFAOYSA-N	-2	3	372.355	0.899	20	5		FCBDHL
CN(C)C(=O)C1([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])CC1	ZINC000516870690	490881954	/nfs/dbraw/zinc/88/19/54/490881954.db2.gz	KRNZVQWWFXBTFX-UHFFFAOYSA-N	-2	3	357.344	0.192	20	5		FCBDHL
C[C@@H](O)[C@H]([N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000565586160	491386586	/nfs/dbraw/zinc/38/65/86/491386586.db2.gz	ZALXPAYTTWTAMK-ANLVUFKYSA-N	-2	3	372.277	0.726	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@@H]2CCCOC2)c([N+](=O)[O-])c1	ZINC000569450024	491662264	/nfs/dbraw/zinc/66/22/64/491662264.db2.gz	RUJPYOINHOULJQ-NOZJJQNGSA-N	-2	3	374.371	0.762	20	5		FCBDHL
CCn1cnnc1C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000578197534	491671987	/nfs/dbraw/zinc/67/19/87/491671987.db2.gz	OIQWFJCNANXPRU-UHFFFAOYSA-N	-2	3	355.332	0.383	20	5		FCBDHL
CSC[C@](C)(O)C[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000581432846	491772661	/nfs/dbraw/zinc/77/26/61/491772661.db2.gz	MULBGIMLSSJNIJ-GFCCVEGCSA-N	-2	3	364.401	0.685	20	5		FCBDHL
NC(=O)CC1([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])CCC1	ZINC000581492611	491775045	/nfs/dbraw/zinc/77/50/45/491775045.db2.gz	MGBIHNSHYYZTBB-UHFFFAOYSA-N	-2	3	357.344	0.369	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]CC[C@@]2(O)CCCOC2)c([N+](=O)[O-])c1	ZINC000593314451	546966450	/nfs/dbraw/zinc/96/64/50/546966450.db2.gz	BIIAPVSAWHGSIA-AWEZNQCLSA-N	-2	3	374.371	0.503	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]CC[C@]2(O)CCCOC2)c1[N+](=O)[O-]	ZINC000593316410	546966514	/nfs/dbraw/zinc/96/65/14/546966514.db2.gz	OUFJJPQVKWGYJL-CQSZACIVSA-N	-2	3	374.371	0.503	20	5		FCBDHL
O=C([O-])[C@H](Cc1c[nH]cn1)[N-]S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000776437826	668261774	/nfs/dbraw/zinc/26/17/74/668261774.db2.gz	MWFSQNHANGEDHC-VIFPVBQESA-N	-2	3	374.762	0.946	20	5		FCBDHL
O=C([O-])[C@H](Cc1cnc[nH]1)[N-]S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000776437826	668261778	/nfs/dbraw/zinc/26/17/78/668261778.db2.gz	MWFSQNHANGEDHC-VIFPVBQESA-N	-2	3	374.762	0.946	20	5		FCBDHL
O=C([O-])[C@H](F)C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000837297045	670097511	/nfs/dbraw/zinc/09/75/11/670097511.db2.gz	XOVMBHMUMLPFIP-ZCFIWIBFSA-N	-2	3	350.280	0.067	20	5		FCBDHL
O=C(CCCF)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001606519655	1288360543	/nfs/dbraw/zinc/36/05/43/1288360543.db2.gz	UBGSQUJGTPKKBT-UHFFFAOYSA-N	-2	3	358.311	0.330	20	5		FCBDHL
CC1(C)C[C@@H]1C(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001609144265	1288946922	/nfs/dbraw/zinc/94/69/22/1288946922.db2.gz	OSSJBHQIRCRQPE-SECBINFHSA-N	-2	3	366.359	0.626	20	5		FCBDHL
CN1CCN(CCN(CC(=O)[O-])C(=O)c2cc([O-])cc([N+](=O)[O-])c2)CC1	ZINC001598615910	993878298	/nfs/dbraw/zinc/87/82/98/993878298.db2.gz	HALXJLGLFYJSTI-UHFFFAOYSA-N	-2	3	366.374	0.075	20	5		FCBDHL
C[C@](CO)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)CC(=O)[O-]	ZINC000275639245	212065588	/nfs/dbraw/zinc/06/55/88/212065588.db2.gz	NAHHOZNTZXLUHB-GFCCVEGCSA-N	-2	3	366.779	1.000	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](CC(F)F)C(=O)[O-]	ZINC000275310055	212004501	/nfs/dbraw/zinc/00/45/01/212004501.db2.gz	REWBQRMFTUQVDP-SSDOTTSWSA-N	-2	3	354.287	0.990	20	5		FCBDHL
O=C([O-])[C@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000274946965	211935949	/nfs/dbraw/zinc/93/59/49/211935949.db2.gz	RZIFFFOASAFHBF-ZETCQYMHSA-N	-2	3	358.250	0.337	20	5		FCBDHL
C[C@@]1(C[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2[O-])NC(=O)[N-]C1=O	ZINC000288066307	488940016	/nfs/dbraw/zinc/94/00/16/488940016.db2.gz	YPIGKIYLZGCTET-HWPZZCPQSA-N	-2	3	362.342	0.893	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H](CC(=O)[O-])C(=O)[O-]	ZINC000274921648	488743836	/nfs/dbraw/zinc/74/38/36/488743836.db2.gz	BHFLCZVVDOUOKH-SSDOTTSWSA-N	-3	3	362.316	0.057	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC1(C(=O)[O-])CCOCC1	ZINC000275001100	488752319	/nfs/dbraw/zinc/75/23/19/488752319.db2.gz	OEOJICZBVXOVEQ-UHFFFAOYSA-N	-2	3	374.371	0.763	20	5		FCBDHL
C[C@]1(C[C@@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2[O-])NC(=O)[N-]C1=O	ZINC000286313530	489379356	/nfs/dbraw/zinc/37/93/56/489379356.db2.gz	UDDFIKHYXFRETL-XXFAHNHDSA-N	-2	3	362.342	0.893	20	5		FCBDHL
C[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-])C(=O)NC(C)(C)C	ZINC000414314891	489495504	/nfs/dbraw/zinc/49/55/04/489495504.db2.gz	FBEREXGBNXSRKP-MRVPVSSYSA-N	-2	3	373.387	0.875	20	5		FCBDHL
NC(=O)CC1([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])CCC1	ZINC000414334742	489496660	/nfs/dbraw/zinc/49/66/60/489496660.db2.gz	GNAPFLYDYSTOHB-UHFFFAOYSA-N	-2	3	357.344	0.369	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@@H](C(=O)[O-])c2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000392716071	490155808	/nfs/dbraw/zinc/15/58/08/490155808.db2.gz	CSMWSTOPOPUXEG-GFCCVEGCSA-N	-2	3	370.343	0.441	20	5		FCBDHL
COCC[C@@H]([N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000521143034	490229767	/nfs/dbraw/zinc/22/97/67/490229767.db2.gz	LRCVITQRIUOBNG-SECBINFHSA-N	-2	3	366.323	0.511	20	5		FCBDHL
COC(=O)CC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C(=O)[O-]	ZINC000547898578	490380652	/nfs/dbraw/zinc/38/06/52/490380652.db2.gz	PKKGIMLJQOJWNW-SSDOTTSWSA-N	-2	3	366.373	0.649	20	5		FCBDHL
Cc1ccc(S(=O)(=O)[N-]C[C@@](C)(CC(=O)[O-])C(=O)[O-])c([N+](=O)[O-])c1	ZINC000548589947	490513615	/nfs/dbraw/zinc/51/36/15/490513615.db2.gz	MADBDGOCGKTIGQ-CYBMUJFWSA-N	-3	3	360.344	0.747	20	5		FCBDHL
Cc1ccc(S(=O)(=O)[N-]C[C@](C)(CC(=O)[O-])C(=O)[O-])c([N+](=O)[O-])c1	ZINC000548589949	490513780	/nfs/dbraw/zinc/51/37/80/490513780.db2.gz	MADBDGOCGKTIGQ-ZDUSSCGKSA-N	-3	3	360.344	0.747	20	5		FCBDHL
CCOC(=O)CCC[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000565061649	491349921	/nfs/dbraw/zinc/34/99/21/491349921.db2.gz	KJAIKPRCXBADII-UHFFFAOYSA-N	-2	3	360.344	0.915	20	5		FCBDHL
C[C@@H](CN1CCOCC1)[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000515064461	490806453	/nfs/dbraw/zinc/80/64/53/490806453.db2.gz	PQPUYATVOFBUKF-JTQLQIEISA-N	-2	3	373.387	0.292	20	5		FCBDHL
Cc1ccc(S(=O)(=O)[N-][C@H](CCCC(=O)[O-])C(=O)[O-])c([N+](=O)[O-])c1	ZINC000515401695	490824207	/nfs/dbraw/zinc/82/42/07/490824207.db2.gz	LMYRNTKVMPIJDJ-SECBINFHSA-N	-3	3	360.344	0.890	20	5		FCBDHL
C[C@@]1(C[C@@H]2CCCN2C(=O)c2cc([O-])ccc2[N+](=O)[O-])NC(=O)[N-]C1=O	ZINC000557608911	491387035	/nfs/dbraw/zinc/38/70/35/491387035.db2.gz	KFUVSGVHQOLDFB-FVMDXXJSSA-N	-2	3	362.342	0.893	20	5		FCBDHL
O=C([O-])[C@H]1C[C@H]([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000565888815	491405626	/nfs/dbraw/zinc/40/56/26/491405626.db2.gz	ROUUYMFKJANFBL-ZKCHVHJHSA-N	-2	3	358.328	0.508	20	5		FCBDHL
CS(=O)(=O)CCC[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000567617366	491518400	/nfs/dbraw/zinc/51/84/00/491518400.db2.gz	IECJIXGTJKMNOD-UHFFFAOYSA-N	-2	3	366.373	0.006	20	5		FCBDHL
COC[C@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000569116915	491635368	/nfs/dbraw/zinc/63/53/68/491635368.db2.gz	CWKGZIJQWMJQTQ-ZDUSSCGKSA-N	-2	3	362.360	0.762	20	5		FCBDHL
CN1C[C@@H]([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])CCC1=O	ZINC000576760491	491642709	/nfs/dbraw/zinc/64/27/09/491642709.db2.gz	VGJDNMXGXUFKBJ-QMMMGPOBSA-N	-2	3	357.344	0.192	20	5		FCBDHL
C[C@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-])C(=O)NC(C)(C)C	ZINC000577955710	491665711	/nfs/dbraw/zinc/66/57/11/491665711.db2.gz	FASDJLFKKMZQOR-QMMMGPOBSA-N	-2	3	373.387	0.875	20	5		FCBDHL
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])[C@H]1OC	ZINC000580571376	491736704	/nfs/dbraw/zinc/73/67/04/491736704.db2.gz	HREQHAYUBBFFLR-OPQQBVKSSA-N	-2	3	374.371	0.764	20	5		FCBDHL
O=C(NCCCNC(=O)c1cc([N+](=O)[O-])c[n-]c1=O)c1cccc([O-])c1	ZINC000608839510	492193771	/nfs/dbraw/zinc/19/37/71/492193771.db2.gz	NFUFCBOOZSTQAH-UHFFFAOYSA-N	-2	3	360.326	0.951	20	5		FCBDHL
CC(C)(C(=O)[O-])C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000592992840	546962197	/nfs/dbraw/zinc/96/21/97/546962197.db2.gz	IGQPAGFLVYRTHL-UHFFFAOYSA-N	-2	3	359.360	0.100	20	5		FCBDHL
Cn1cnc(CCC[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])n1	ZINC000593312481	546965891	/nfs/dbraw/zinc/96/58/91/546965891.db2.gz	ODHGYVLXTHQEMR-UHFFFAOYSA-N	-2	3	369.359	0.333	20	5		FCBDHL
CC[C@@H](C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-])C(=O)OC	ZINC000593312604	546966065	/nfs/dbraw/zinc/96/60/65/546966065.db2.gz	YKBPHWGEDYVTAH-QMMMGPOBSA-N	-2	3	360.344	0.771	20	5		FCBDHL
CO[C@@H](C[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-])CC(=O)[O-]	ZINC000594671427	547002371	/nfs/dbraw/zinc/00/23/71/547002371.db2.gz	POBIXDFYWGDWDH-SECBINFHSA-N	-2	3	369.355	0.911	20	5		FCBDHL
COCC[C@@H]([N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-])C(=O)[O-]	ZINC000594673689	547002598	/nfs/dbraw/zinc/00/25/98/547002598.db2.gz	TUEWMFPHURJHFL-LLVKDONJSA-N	-2	3	369.355	0.911	20	5		FCBDHL
CO[C@H](C[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-])CC(=O)[O-]	ZINC000594671428	547002612	/nfs/dbraw/zinc/00/26/12/547002612.db2.gz	POBIXDFYWGDWDH-VIFPVBQESA-N	-2	3	369.355	0.911	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]c2n[nH]cc2-c2nnn[n-]2)c1C	ZINC000826293496	607461871	/nfs/dbraw/zinc/46/18/71/607461871.db2.gz	QYRFUNOTTYTQTB-UHFFFAOYSA-N	-2	3	364.347	0.916	20	5		FCBDHL
O=C([O-])c1cc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])ccc1O	ZINC000833304005	602309791	/nfs/dbraw/zinc/30/97/91/602309791.db2.gz	HTBGJWWTLCRFAB-UHFFFAOYSA-N	-2	3	354.300	0.699	20	5		FCBDHL
CCn1ncc(C[N-]S(=O)(=O)c2ccc(C(=O)[O-])c([N+](=O)[O-])c2)n1	ZINC000863429585	672125589	/nfs/dbraw/zinc/12/55/89/672125589.db2.gz	RKWBAMIYWXVYFN-UHFFFAOYSA-N	-2	3	355.332	0.383	20	5		FCBDHL
Cc1cc(S(=O)(=O)[N-]C[C@H](C(=O)[O-])[C@@H]2CCOC2)c([N+](=O)[O-])s1	ZINC001600298766	1286472643	/nfs/dbraw/zinc/47/26/43/1286472643.db2.gz	BLXLTFOAYFYLHY-BDAKNGLRSA-N	-2	3	364.401	0.980	20	5		FCBDHL
Cc1nn(CC(=O)[O-])c(C)c1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC001600782797	1286544413	/nfs/dbraw/zinc/54/44/13/1286544413.db2.gz	YPFVNCYBRLQBSP-UHFFFAOYSA-N	-2	3	368.371	0.971	20	5		FCBDHL
O=C([O-])C1CC2(C1)CC[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)O2	ZINC001594907295	954686540	/nfs/dbraw/zinc/68/65/40/954686540.db2.gz	LJPQDUSCUUXIQP-ZQDGQSPWSA-N	-2	3	371.371	0.681	20	5		FCBDHL
CC(C)C[C@@H](NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000296861578	214367373	/nfs/dbraw/zinc/36/73/73/214367373.db2.gz	VBRBPJIYAIWKGJ-SNVBAGLBSA-N	-2	3	373.387	0.489	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@](C)(CO)CC(=O)[O-]	ZINC000275552101	212049369	/nfs/dbraw/zinc/04/93/69/212049369.db2.gz	DXQRCDUFAJALAB-CYBMUJFWSA-N	-2	3	362.360	0.355	20	5		FCBDHL
COC(=O)C[C@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000275293960	212002056	/nfs/dbraw/zinc/00/20/56/212002056.db2.gz	PTRIZBACQLMJBA-VIFPVBQESA-N	-2	3	360.344	0.506	20	5		FCBDHL
CC(C)N(CC(=O)[O-])C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000263427802	488611858	/nfs/dbraw/zinc/61/18/58/488611858.db2.gz	MNFCRDRMOOZIPX-UHFFFAOYSA-N	-2	3	359.360	0.195	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](Cc2c[nH]cn2)C(=O)[O-])c1C	ZINC000274883364	488740706	/nfs/dbraw/zinc/74/07/06/488740706.db2.gz	DIMZWIZHUFQGHZ-NSHDSACASA-N	-2	3	368.371	0.909	20	5		FCBDHL
O=C([O-])[C@@H](O)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000274921826	488743941	/nfs/dbraw/zinc/74/39/41/488743941.db2.gz	NDLNURRCGQZJJX-QMMMGPOBSA-N	-2	3	372.277	0.728	20	5		FCBDHL
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H](C(=O)[O-])[C@@H](C)O)cc1[N+](=O)[O-]	ZINC000274924924	488744546	/nfs/dbraw/zinc/74/45/46/488744546.db2.gz	NRMBEMGOMOYTMW-LDWIPMOCSA-N	-2	3	352.752	0.669	20	5		FCBDHL
CCC(=O)C[C@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000275082331	488759769	/nfs/dbraw/zinc/75/97/69/488759769.db2.gz	YWNHIDGUKLWWQN-JTQLQIEISA-N	-2	3	360.344	0.704	20	5		FCBDHL
NC(=O)CC1(C[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000563232351	491229984	/nfs/dbraw/zinc/22/99/84/491229984.db2.gz	WPBJEMDJWXXJQL-UHFFFAOYSA-N	-2	3	357.344	0.227	20	5		FCBDHL
C[C@]1(C[C@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2[O-])NC(=O)[N-]C1=O	ZINC000286313526	489378911	/nfs/dbraw/zinc/37/89/11/489378911.db2.gz	UDDFIKHYXFRETL-JDNHERCYSA-N	-2	3	362.342	0.893	20	5		FCBDHL
COC(=O)C[C@@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000379275127	490124243	/nfs/dbraw/zinc/12/42/43/490124243.db2.gz	YXOUJJSZIFBBET-SSDOTTSWSA-N	-2	3	366.735	0.543	20	5		FCBDHL
Cn1cc(C[C@H](C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C(=O)[O-])cn1	ZINC000547884507	490376998	/nfs/dbraw/zinc/37/69/98/490376998.db2.gz	IQYOSWBHEUFTTJ-LLVKDONJSA-N	-2	3	368.371	0.550	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@H]1CCOC1	ZINC000548205445	490438554	/nfs/dbraw/zinc/43/85/54/490438554.db2.gz	YWQXVMOWCZGLPM-QPUJVOFHSA-N	-2	3	360.344	0.371	20	5		FCBDHL
O=C([O-])[C@@H](CO)[N-]S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1	ZINC000548537005	490500864	/nfs/dbraw/zinc/50/08/64/490500864.db2.gz	FCFHJSULQSAGRR-MRVPVSSYSA-N	-2	3	369.149	0.081	20	5		FCBDHL
CO[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000548540513	490501526	/nfs/dbraw/zinc/50/15/26/490501526.db2.gz	QFUKCQQEHHQNSU-MRVPVSSYSA-N	-2	3	372.277	0.992	20	5		FCBDHL
O=C([O-])[C@@H](O)CC[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000571889579	491335448	/nfs/dbraw/zinc/33/54/48/491335448.db2.gz	NCWKMPRZLYGXPY-QMMMGPOBSA-N	-2	3	372.277	0.728	20	5		FCBDHL
CC(=O)N1CCC([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000565060452	491349388	/nfs/dbraw/zinc/34/93/88/491349388.db2.gz	JHVBMMKTEZDGRT-UHFFFAOYSA-N	-2	3	371.371	0.582	20	5		FCBDHL
Cc1nnc(CC[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])s1	ZINC000517238741	490900748	/nfs/dbraw/zinc/90/07/48/490900748.db2.gz	HYSQIAHRQVOOGD-UHFFFAOYSA-N	-2	3	372.384	0.974	20	5		FCBDHL
C[C@H](CS(C)(=O)=O)[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000566013633	491412470	/nfs/dbraw/zinc/41/24/70/491412470.db2.gz	VYCAUQNFUIOSEH-SSDOTTSWSA-N	-2	3	366.373	0.004	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@]1(CC(=O)[O-])CCOC1	ZINC000573110646	491413661	/nfs/dbraw/zinc/41/36/61/491413661.db2.gz	AJMDBZPCUQZURH-ZDUSSCGKSA-N	-2	3	360.344	0.516	20	5		FCBDHL
CCOC(=O)CCC[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000566317586	491435601	/nfs/dbraw/zinc/43/56/01/491435601.db2.gz	URKFFTNUFHJKEU-UHFFFAOYSA-N	-2	3	360.344	0.915	20	5		FCBDHL
CC(=O)N1CCC([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])CC1	ZINC000567476422	491508488	/nfs/dbraw/zinc/50/84/88/491508488.db2.gz	LVKDBMDBAPSQMK-UHFFFAOYSA-N	-2	3	371.371	0.582	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@H]2CCOC2)c1[N+](=O)[O-]	ZINC000577036847	491583049	/nfs/dbraw/zinc/58/30/49/491583049.db2.gz	VCLPCKZGGLVLSN-WDEREUQCSA-N	-2	3	358.372	0.980	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@H]1CCCOC1	ZINC000569232265	491644357	/nfs/dbraw/zinc/64/43/57/491644357.db2.gz	QXTAENHELGWRSO-TVQRCGJNSA-N	-2	3	374.371	0.762	20	5		FCBDHL
CO[C@H]1COCC[C@@H]1C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000582305040	491806686	/nfs/dbraw/zinc/80/66/86/491806686.db2.gz	LHNIORHPVNHIIB-PWSUYJOCSA-N	-2	3	374.371	0.623	20	5		FCBDHL
CS(=O)(=O)c1nc([N-]C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)n[n-]1	ZINC000609599546	492215492	/nfs/dbraw/zinc/21/54/92/492215492.db2.gz	JNWJZELIERQWGF-UHFFFAOYSA-N	-2	3	369.315	0.140	20	5		FCBDHL
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](C(=O)[O-])c1cnn(C)c1	ZINC000619470280	492264257	/nfs/dbraw/zinc/26/42/57/492264257.db2.gz	FFOZVHCHMFBRGZ-LLVKDONJSA-N	-2	3	370.343	0.441	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@@]2(O)CCCOC2)c1	ZINC000593317636	546700870	/nfs/dbraw/zinc/70/08/70/546700870.db2.gz	ZLRQWYNEFPBQJA-AWEZNQCLSA-N	-2	3	374.371	0.503	20	5		FCBDHL
CCC(CC)([N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-])C(N)=O	ZINC000593308895	546965322	/nfs/dbraw/zinc/96/53/22/546965322.db2.gz	GEMKWHYWYFMVIC-UHFFFAOYSA-N	-2	3	359.360	0.615	20	5		FCBDHL
C[C@H](CO[C@@H]1CCOC1)[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000593317283	546966940	/nfs/dbraw/zinc/96/69/40/546966940.db2.gz	REQVMGWXUOBMCF-NXEZZACHSA-N	-2	3	374.371	0.765	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@]2(O)CCOC2)c1	ZINC000593315829	546967100	/nfs/dbraw/zinc/96/71/00/546967100.db2.gz	NBYQHZAWROLSJO-ZDUSSCGKSA-N	-2	3	360.344	0.113	20	5		FCBDHL
COCC[C@H]([N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-])C(=O)[O-]	ZINC000594673690	547002622	/nfs/dbraw/zinc/00/26/22/547002622.db2.gz	TUEWMFPHURJHFL-NSHDSACASA-N	-2	3	369.355	0.911	20	5		FCBDHL
CCn1cc(C[N-]S(=O)(=O)c2ccc(C(=O)[O-])c([N+](=O)[O-])c2)nn1	ZINC000594721572	547004266	/nfs/dbraw/zinc/00/42/66/547004266.db2.gz	XPIDBELGVITRBK-UHFFFAOYSA-N	-2	3	355.332	0.383	20	5		FCBDHL
CN(C)C(=O)Cn1ccc([N-]c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)n1	ZINC000825846034	609550057	/nfs/dbraw/zinc/55/00/57/609550057.db2.gz	PVPZOAIJRHZHAK-UHFFFAOYSA-N	-2	3	358.322	0.198	20	5		FCBDHL
COC(=O)C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000294404954	214243479	/nfs/dbraw/zinc/24/34/79/214243479.db2.gz	MNZGGQNAZRGYPX-MRVPVSSYSA-N	-2	3	366.735	0.543	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-]C[C@](C)(CO)CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000275633866	212064211	/nfs/dbraw/zinc/06/42/11/212064211.db2.gz	MLJXPVIEJGGTSN-CYBMUJFWSA-N	-2	3	362.360	0.355	20	5		FCBDHL
O=C(NCC[N-]S(=O)(=O)c1cccs1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000472918290	250188519	/nfs/dbraw/zinc/18/85/19/250188519.db2.gz	BABBYOYOHXCEMG-UHFFFAOYSA-N	-2	3	372.384	0.465	20	5		FCBDHL
O=C([O-])[C@@H](CC1CC1)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000287717402	488898492	/nfs/dbraw/zinc/89/84/92/488898492.db2.gz	YJNGZHSRTNVZAH-SECBINFHSA-N	-2	3	372.355	0.898	20	5		FCBDHL
C[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)c1nncn1C	ZINC000273756905	488670435	/nfs/dbraw/zinc/67/04/35/488670435.db2.gz	VXOSFARHKYGETN-ZETCQYMHSA-N	-2	3	355.332	0.461	20	5		FCBDHL
COC(=O)CC[C@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000275176273	488769206	/nfs/dbraw/zinc/76/92/06/488769206.db2.gz	CVCWNJJUBDMPSG-JTQLQIEISA-N	-2	3	374.371	0.896	20	5		FCBDHL
C[C@]1(C[C@H]2CCCN2C(=O)c2ccc([O-])c([N+](=O)[O-])c2)NC(=O)[N-]C1=O	ZINC000286208543	489368633	/nfs/dbraw/zinc/36/86/33/489368633.db2.gz	MSPMDSYZMSHGQX-QLJPJBMISA-N	-2	3	362.342	0.893	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CCC(=O)[O-])C(=O)[O-])cc1C	ZINC000299033587	489398067	/nfs/dbraw/zinc/39/80/67/489398067.db2.gz	IFWDDOCPALLEQX-VIFPVBQESA-N	-3	3	360.344	0.808	20	5		FCBDHL
Cn1cc([C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C(=O)[O-])cn1	ZINC000392512086	490152004	/nfs/dbraw/zinc/15/20/04/490152004.db2.gz	LGDWTHHHVHBMFB-NSHDSACASA-N	-2	3	358.307	0.572	20	5		FCBDHL
COCC[C@H]([N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000521143035	490230286	/nfs/dbraw/zinc/23/02/86/490230286.db2.gz	LRCVITQRIUOBNG-VIFPVBQESA-N	-2	3	366.323	0.511	20	5		FCBDHL
Cn1cnc(S(=O)(=O)[N-][C@@H](Cc2ccccc2[N+](=O)[O-])C(=O)[O-])c1	ZINC000547895243	490378919	/nfs/dbraw/zinc/37/89/19/490378919.db2.gz	CXHXBDMISUWPOQ-JTQLQIEISA-N	-2	3	354.344	0.303	20	5		FCBDHL
O=C(c1cccc([O-])c1)N1CCN(C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)CC1	ZINC000484267356	490404727	/nfs/dbraw/zinc/40/47/27/490404727.db2.gz	JNGBNPCUVIBUPE-UHFFFAOYSA-N	-2	3	372.337	0.999	20	5		FCBDHL
CC[C@](C)([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)[O-]	ZINC000564917606	491336416	/nfs/dbraw/zinc/33/64/16/491336416.db2.gz	YTUOOGQNCJJWKS-ZDUSSCGKSA-N	-2	3	360.344	0.898	20	5		FCBDHL
CS(=O)(=O)[N-]c1nnc([N-]C(=O)c2cccc([O-])c2[N+](=O)[O-])s1	ZINC000537207806	490660485	/nfs/dbraw/zinc/66/04/85/490660485.db2.gz	JNTZPDPULPEEOY-UHFFFAOYSA-N	-3	3	359.345	0.776	20	5		FCBDHL
CN1CC[C@@H](C[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])CC1=O	ZINC000565061404	491349680	/nfs/dbraw/zinc/34/96/80/491349680.db2.gz	YXKNVDYEFPPLJB-SECBINFHSA-N	-2	3	371.371	0.440	20	5		FCBDHL
CN1C[C@H]([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])CCC1=O	ZINC000567357184	491501821	/nfs/dbraw/zinc/50/18/21/491501821.db2.gz	BEGVCYFIAYIEQN-SECBINFHSA-N	-2	3	357.344	0.192	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](C(=O)[O-])c2ccnn2C)cc1[N+](=O)[O-]	ZINC000567692105	491523079	/nfs/dbraw/zinc/52/30/79/491523079.db2.gz	OPRHGRAFFMTMHU-SNVBAGLBSA-N	-2	3	360.373	0.802	20	5		FCBDHL
CC(C)(C)NC(=O)C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000577735424	491646989	/nfs/dbraw/zinc/64/69/89/491646989.db2.gz	GGUNPUWBJHMNJV-UHFFFAOYSA-N	-2	3	359.360	0.486	20	5		FCBDHL
CC[C@H](C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)[O-]	ZINC000614343555	492024996	/nfs/dbraw/zinc/02/49/96/492024996.db2.gz	LSAJKGBFJKEUPY-MRVPVSSYSA-N	-2	3	360.344	0.755	20	5		FCBDHL
C[N-]S(=O)(=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)s1	ZINC000603501020	492035888	/nfs/dbraw/zinc/03/58/88/492035888.db2.gz	PJBHGUNXIGJNJY-UHFFFAOYSA-N	-2	3	372.384	0.595	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@]2(O)CCCOC2)c1	ZINC000593317637	546701016	/nfs/dbraw/zinc/70/10/16/546701016.db2.gz	ZLRQWYNEFPBQJA-CQSZACIVSA-N	-2	3	374.371	0.503	20	5		FCBDHL
C[C@]1(C[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])CCC(=O)N1	ZINC000593312262	546965527	/nfs/dbraw/zinc/96/55/27/546965527.db2.gz	SZFBGFAXNVINBQ-CYBMUJFWSA-N	-2	3	357.344	0.240	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]CC[C@]2(O)CCOC2)c1[N+](=O)[O-]	ZINC000593316539	546966645	/nfs/dbraw/zinc/96/66/45/546966645.db2.gz	QDFRZURJIQLYFE-ZDUSSCGKSA-N	-2	3	360.344	0.113	20	5		FCBDHL
Cc1ncc([N-]S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])cn1	ZINC000737502826	599043022	/nfs/dbraw/zinc/04/30/22/599043022.db2.gz	YQMOXBYAHQLNCP-UHFFFAOYSA-N	-2	3	362.331	0.674	20	5		FCBDHL
Cc1ncc([N-]S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])cn1	ZINC000737502826	599043025	/nfs/dbraw/zinc/04/30/25/599043025.db2.gz	YQMOXBYAHQLNCP-UHFFFAOYSA-N	-2	3	362.331	0.674	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1nn(C)cc1-c1nnn[n-]1	ZINC000822271271	606711172	/nfs/dbraw/zinc/71/11/72/606711172.db2.gz	UMQOPOIGRVHWNW-UHFFFAOYSA-N	-2	3	364.347	0.618	20	5		FCBDHL
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2n[nH]cc2-c2nnn[n-]2)c(F)c1	ZINC000826499585	608307848	/nfs/dbraw/zinc/30/78/48/608307848.db2.gz	OGRNWOBBRLVWDZ-UHFFFAOYSA-N	-2	3	354.283	0.438	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H](F)C(=O)[O-]	ZINC000837296040	670097439	/nfs/dbraw/zinc/09/74/39/670097439.db2.gz	WUGBHSKHILHQLZ-MRVPVSSYSA-N	-2	3	350.280	0.082	20	5		FCBDHL
CC1(C)O[C@H]2O[C@@H]3[C@H](Oc4cc([O-])cc([O-])c4[N+](=O)[O-])C(=O)O[C@@H]3[C@H]2O1	ZINC001228969807	1225968650	/nfs/dbraw/zinc/96/86/50/1225968650.db2.gz	CTOYRWCKGLCWGH-ZXPJVPCYSA-N	-2	3	369.282	0.555	20	5		FCBDHL
O=C(C=C1CCC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001592786506	1285711772	/nfs/dbraw/zinc/71/17/72/1285711772.db2.gz	AXIXUARWODHWSS-UHFFFAOYSA-N	-2	3	364.343	0.690	20	5		FCBDHL
O=c1[n-]c([C@H]2CCCN(Cc3ccc(-c4nnn[n-]4)cc3[N+](=O)[O-])C2)n[nH]1	ZINC001593497985	1286180696	/nfs/dbraw/zinc/18/06/96/1286180696.db2.gz	ORBZFAUHOUKHMQ-NSHDSACASA-N	-2	3	371.361	0.978	20	5		FCBDHL
O=c1[n-]c([C@H]2CCCN(Cc3ccc(-c4nn[n-]n4)cc3[N+](=O)[O-])C2)n[nH]1	ZINC001593497985	1286180702	/nfs/dbraw/zinc/18/07/02/1286180702.db2.gz	ORBZFAUHOUKHMQ-NSHDSACASA-N	-2	3	371.361	0.978	20	5		FCBDHL
O=c1[n-]c([C@@H]2CCCN(c3ccc(-c4nnn[n-]4)cc3[N+](=O)[O-])C2)n[nH]1	ZINC001593497742	1286181908	/nfs/dbraw/zinc/18/19/08/1286181908.db2.gz	KTGWGAFWGQLUFZ-SECBINFHSA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=c1[n-]c([C@@H]2CCCN(c3ccc(-c4nn[n-]n4)cc3[N+](=O)[O-])C2)n[nH]1	ZINC001593497742	1286181912	/nfs/dbraw/zinc/18/19/12/1286181912.db2.gz	KTGWGAFWGQLUFZ-SECBINFHSA-N	-2	3	357.334	0.983	20	5		FCBDHL
Cc1ccc(-c2nnn[n-]2)cc1S(=O)(=O)[N-]c1ccncc1[N+](=O)[O-]	ZINC001609417062	1289143357	/nfs/dbraw/zinc/14/33/57/1289143357.db2.gz	JROJYWARCHJYOC-UHFFFAOYSA-N	-2	3	361.343	0.701	20	5		FCBDHL
Cc1ccc(-c2nn[n-]n2)cc1S(=O)(=O)[N-]c1ccncc1[N+](=O)[O-]	ZINC001609417062	1289143360	/nfs/dbraw/zinc/14/33/60/1289143360.db2.gz	JROJYWARCHJYOC-UHFFFAOYSA-N	-2	3	361.343	0.701	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-]CCn2cc(C(=O)[O-])nn2)c1[N+](=O)[O-]	ZINC000277525139	212370066	/nfs/dbraw/zinc/37/00/66/212370066.db2.gz	XGGAGQWXEOJYBK-UHFFFAOYSA-N	-2	3	369.359	0.480	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@](C)(CO)CC(=O)[O-])c1[N+](=O)[O-]	ZINC000277319521	212349872	/nfs/dbraw/zinc/34/98/72/212349872.db2.gz	UFGPUZOVQMJICF-AWEZNQCLSA-N	-2	3	360.388	0.963	20	5		FCBDHL
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-]Cc1ncccc1[O-])OCCO2	ZINC000480752265	250281735	/nfs/dbraw/zinc/28/17/35/250281735.db2.gz	FPKUIKQXRYOXLU-UHFFFAOYSA-N	-2	3	367.339	0.945	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@]1(C(=O)[O-])CCSC1	ZINC000321558222	488901876	/nfs/dbraw/zinc/90/18/76/488901876.db2.gz	MITMTWOIOHJODV-LBPRGKRZSA-N	-2	3	362.385	0.842	20	5		FCBDHL
C[C@@]1(C[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2[O-])NC(=O)[N-]C1=O	ZINC000288066318	488939883	/nfs/dbraw/zinc/93/98/83/488939883.db2.gz	YPIGKIYLZGCTET-QFYYESIMSA-N	-2	3	362.342	0.893	20	5		FCBDHL
CC(C)OCCS(=O)(=O)[N-]CC(=O)Nc1ccc([O-])c([N+](=O)[O-])c1	ZINC000483437321	490317172	/nfs/dbraw/zinc/31/71/72/490317172.db2.gz	GGKFVYDWOJZXNH-UHFFFAOYSA-N	-2	3	361.376	0.583	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C(=O)[O-])[C@@H]2CCOC2)c1C	ZINC000547876264	490374375	/nfs/dbraw/zinc/37/43/75/490374375.db2.gz	YOUGNKLTOFSJDX-PWSUYJOCSA-N	-2	3	358.372	0.980	20	5		FCBDHL
CCn1cc(S(=O)(=O)[N-]c2ccc(-c3nnn[n-]3)cc2)c([N+](=O)[O-])n1	ZINC000535235210	490467163	/nfs/dbraw/zinc/46/71/63/490467163.db2.gz	YSDMFJCDEGCIOE-UHFFFAOYSA-N	-2	3	364.347	0.792	20	5		FCBDHL
CCn1cc(S(=O)(=O)[N-]c2ccc(-c3nn[n-]n3)cc2)c([N+](=O)[O-])n1	ZINC000535235210	490467169	/nfs/dbraw/zinc/46/71/69/490467169.db2.gz	YSDMFJCDEGCIOE-UHFFFAOYSA-N	-2	3	364.347	0.792	20	5		FCBDHL
CCC[C@@H](O)[C@@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000548593244	490514896	/nfs/dbraw/zinc/51/48/96/490514896.db2.gz	ZBXIAXRRJGBOFQ-ZYHUDNBSSA-N	-2	3	362.360	0.496	20	5		FCBDHL
CCC[C@H](O)[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(=O)[O-]	ZINC000548593333	490514920	/nfs/dbraw/zinc/51/49/20/490514920.db2.gz	ZQCSNNJHAOLRRP-CABZTGNLSA-N	-2	3	362.360	0.496	20	5		FCBDHL
Cc1nc(S(=O)(=O)[N-]CC(=O)Nc2cc([N+](=O)[O-])ccc2[O-])cn1C	ZINC000536202617	490560739	/nfs/dbraw/zinc/56/07/39/490560739.db2.gz	CWQUIPPPPLHCPI-UHFFFAOYSA-N	-2	3	369.359	0.259	20	5		FCBDHL
CN(C)c1nc(N)nc(C(=O)[N-]c2cc(Cl)cc([N+](=O)[O-])c2[O-])n1	ZINC000565261612	491366361	/nfs/dbraw/zinc/36/63/61/491366361.db2.gz	BGTUKYJQDNEQMZ-UHFFFAOYSA-N	-2	3	353.726	1.039	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCn3ccnc3C2)c([N+](=O)[O-])c1	ZINC000574210392	491481470	/nfs/dbraw/zinc/48/14/70/491481470.db2.gz	JMOSGGDLRCOCCM-SNVBAGLBSA-N	-2	3	366.355	0.783	20	5		FCBDHL
O=C([O-])CC1([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000568002331	491546270	/nfs/dbraw/zinc/54/62/70/491546270.db2.gz	ZENRAXFYRAWRKH-UHFFFAOYSA-N	-2	3	358.328	0.652	20	5		FCBDHL
CN(C)C(=O)C1([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000578136008	491670790	/nfs/dbraw/zinc/67/07/90/491670790.db2.gz	WVGRDDNTNSXVAW-UHFFFAOYSA-N	-2	3	357.344	0.192	20	5		FCBDHL
C[S@](=O)CCC[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000583325572	491842468	/nfs/dbraw/zinc/84/24/68/491842468.db2.gz	RAHBDODNLWOSRL-NRFANRHFSA-N	-2	3	350.374	0.340	20	5		FCBDHL
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@]1(CC(=O)[O-])CCOC1	ZINC000591745333	546939858	/nfs/dbraw/zinc/93/98/58/546939858.db2.gz	RWUSAYQRMVLJOE-ZDUSSCGKSA-N	-2	3	360.344	0.516	20	5		FCBDHL
COC(=O)c1ccc(S(=O)(=O)[N-][C@@H](CCF)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000594573176	547001613	/nfs/dbraw/zinc/00/16/13/547001613.db2.gz	IOWPCWSRJDDCTE-VIFPVBQESA-N	-2	3	364.307	0.473	20	5		FCBDHL
Cn1cc(-c2nnn[n-]2)c([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1	ZINC000822622791	606710966	/nfs/dbraw/zinc/71/09/66/606710966.db2.gz	JEOLWUWESWHKHI-UHFFFAOYSA-N	-2	3	350.320	0.309	20	5		FCBDHL
Cc1[nH]nc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)c1-c1nnn[n-]1	ZINC000826272484	669489490	/nfs/dbraw/zinc/48/94/90/669489490.db2.gz	LRMIEHYODWNQHB-UHFFFAOYSA-N	-2	3	364.347	0.916	20	5		FCBDHL
O=[N+]([O-])c1cccnc1S(=O)(=O)[N-]Cc1ccc(-c2nnn[n-]2)cn1	ZINC001593487441	1286175580	/nfs/dbraw/zinc/17/55/80/1286175580.db2.gz	XWQKVLVRIAJDIC-UHFFFAOYSA-N	-2	3	362.331	0.043	20	5		FCBDHL
O=[N+]([O-])c1cccnc1S(=O)(=O)[N-]Cc1ccc(-c2nn[n-]n2)cn1	ZINC001593487441	1286175583	/nfs/dbraw/zinc/17/55/83/1286175583.db2.gz	XWQKVLVRIAJDIC-UHFFFAOYSA-N	-2	3	362.331	0.043	20	5		FCBDHL
Cc1cc(S(=O)(=O)[N-][C@@H](C(=O)[O-])c2ccnn2C)c(F)cc1[N+](=O)[O-]	ZINC001594329233	958204085	/nfs/dbraw/zinc/20/40/85/958204085.db2.gz	WCUROXKOJRPUBR-GFCCVEGCSA-N	-2	3	372.334	0.880	20	5		FCBDHL
CCCC[C@H](NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000296875743	214367304	/nfs/dbraw/zinc/36/73/04/214367304.db2.gz	WHVFBWQEXYIJIT-JTQLQIEISA-N	-2	3	373.387	0.633	20	5		FCBDHL
O=C([O-])[C@H](Cc1c[nH]cn1)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000323880422	488904357	/nfs/dbraw/zinc/90/43/57/488904357.db2.gz	UKLXRSKQFGZJJV-VIFPVBQESA-N	-2	3	374.762	0.946	20	5		FCBDHL
O=C([O-])[C@H](Cc1cnc[nH]1)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000323880422	488904360	/nfs/dbraw/zinc/90/43/60/488904360.db2.gz	UKLXRSKQFGZJJV-VIFPVBQESA-N	-2	3	374.762	0.946	20	5		FCBDHL
C[C@@]1(C[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c([O-])c2)NC(=O)[N-]C1=O	ZINC000288017595	488933001	/nfs/dbraw/zinc/93/30/01/488933001.db2.gz	WJJLNEFSHYQJJX-QFYYESIMSA-N	-2	3	362.342	0.893	20	5		FCBDHL
CCCN(CC(=O)[O-])C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000263436454	488611656	/nfs/dbraw/zinc/61/16/56/488611656.db2.gz	OTDAUOXSDUDHBB-UHFFFAOYSA-N	-2	3	359.360	0.196	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H](C(=O)[O-])[C@H](C)O)c1	ZINC000274870954	488739314	/nfs/dbraw/zinc/73/93/14/488739314.db2.gz	APORESSMSYAALF-WKEGUHRASA-N	-2	3	352.752	0.669	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H](CC(=O)[O-])C(=O)[O-]	ZINC000274921650	488744060	/nfs/dbraw/zinc/74/40/60/488744060.db2.gz	BHFLCZVVDOUOKH-ZETCQYMHSA-N	-3	3	362.316	0.057	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H](CCO)C(=O)[O-])c1	ZINC000274966058	488749031	/nfs/dbraw/zinc/74/90/31/488749031.db2.gz	VRAMATRSCIXWKC-SSDOTTSWSA-N	-2	3	352.752	0.671	20	5		FCBDHL
CCC(=O)C[C@@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000275082335	488759857	/nfs/dbraw/zinc/75/98/57/488759857.db2.gz	YWNHIDGUKLWWQN-SNVBAGLBSA-N	-2	3	360.344	0.704	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CCC(N)=O)C(=O)[O-])c1C	ZINC000275134027	488765024	/nfs/dbraw/zinc/76/50/24/488765024.db2.gz	VWDPUXVIZCDKFD-SECBINFHSA-N	-2	3	359.360	0.209	20	5		FCBDHL
COC(=O)CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000275198489	488771757	/nfs/dbraw/zinc/77/17/57/488771757.db2.gz	GJBJVNCWMKUXRW-SECBINFHSA-N	-2	3	364.307	0.419	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1(CC(=O)[O-])CCOCC1	ZINC000570393719	491238140	/nfs/dbraw/zinc/23/81/40/491238140.db2.gz	MOUUECBEQYCIDY-UHFFFAOYSA-N	-2	3	374.371	0.906	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1(C(=O)[O-])CC1	ZINC000297326542	489200585	/nfs/dbraw/zinc/20/05/85/489200585.db2.gz	XIJOFFPXKGJGLF-UHFFFAOYSA-N	-2	3	358.328	0.525	20	5		FCBDHL
COc1c(F)cc(S(=O)(=O)[N-]CCSCC(=O)[O-])cc1[N+](=O)[O-]	ZINC000555374969	491248570	/nfs/dbraw/zinc/24/85/70/491248570.db2.gz	TZNXJPUDTKVGKP-UHFFFAOYSA-N	-2	3	368.364	0.839	20	5		FCBDHL
COC(=O)CCCC[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414318708	489496308	/nfs/dbraw/zinc/49/63/08/489496308.db2.gz	MTKIQLNSDPRAMD-UHFFFAOYSA-N	-2	3	360.344	0.915	20	5		FCBDHL
CO[C@@H]1COCC[C@H]1C[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414331798	489496314	/nfs/dbraw/zinc/49/63/14/489496314.db2.gz	QZNJTSQLQUVCPL-CMPLNLGQSA-N	-2	3	374.371	0.623	20	5		FCBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C(=O)[O-])c1cnn(C)c1	ZINC000392481577	490151878	/nfs/dbraw/zinc/15/18/78/490151878.db2.gz	AKJVAWSYIXKNOE-NSHDSACASA-N	-2	3	354.344	0.741	20	5		FCBDHL
CCn1cnnc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000571407896	491305866	/nfs/dbraw/zinc/30/58/66/491305866.db2.gz	IMVUGKNTBONUAI-UHFFFAOYSA-N	-2	3	355.332	0.383	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-][C@H]2CCn3ccnc3C2)c1[N+](=O)[O-]	ZINC000521882506	490306542	/nfs/dbraw/zinc/30/65/42/490306542.db2.gz	JJSWCPYNZRKDAA-VIFPVBQESA-N	-2	3	366.355	0.783	20	5		FCBDHL
Cc1nc(S(=O)(=O)[N-][C@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])c[nH]1	ZINC000548213881	490442561	/nfs/dbraw/zinc/44/25/61/490442561.db2.gz	CLJOKYFWOZQBSS-LLVKDONJSA-N	-2	3	354.344	0.601	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@H]2CCOC2)cc1C	ZINC000548530601	490496412	/nfs/dbraw/zinc/49/64/12/490496412.db2.gz	RDAHBXPRXDKJNS-GXFFZTMASA-N	-2	3	358.372	0.980	20	5		FCBDHL
O=C([O-])[C@@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C1CCC1	ZINC000548597149	490515543	/nfs/dbraw/zinc/51/55/43/490515543.db2.gz	DTKLQDFJJXQGMD-ZDUSSCGKSA-N	-2	3	372.355	0.898	20	5		FCBDHL
Cc1c([C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)C(=O)[O-])cnn1C	ZINC000530540789	490912057	/nfs/dbraw/zinc/91/20/57/490912057.db2.gz	GCOZWCWPZHIAQX-SNVBAGLBSA-N	-2	3	360.373	0.802	20	5		FCBDHL
NC(=O)CC1(C[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])CC1	ZINC000517945110	490925876	/nfs/dbraw/zinc/92/58/76/490925876.db2.gz	SPFOYOPYQLXACO-UHFFFAOYSA-N	-2	3	357.344	0.227	20	5		FCBDHL
C[C@@H](CO[C@@H]1CCOC1)[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000519660078	490982776	/nfs/dbraw/zinc/98/27/76/490982776.db2.gz	WEJUKVQCLBSZJC-GXSJLCMTSA-N	-2	3	374.371	0.765	20	5		FCBDHL
C[C@@]1(C[C@H]2CCCN2C(=O)c2cc([O-])ccc2[N+](=O)[O-])NC(=O)[N-]C1=O	ZINC000557608910	491386564	/nfs/dbraw/zinc/38/65/64/491386564.db2.gz	KFUVSGVHQOLDFB-ABKXIKBNSA-N	-2	3	362.342	0.893	20	5		FCBDHL
COC(=O)[C@@H](CC1CC1)[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000574814747	491521879	/nfs/dbraw/zinc/52/18/79/491521879.db2.gz	JDWCVTGTUNVOPC-SNVBAGLBSA-N	-2	3	372.355	0.913	20	5		FCBDHL
CSC[C@@](C)(O)C[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000568006709	491546728	/nfs/dbraw/zinc/54/67/28/491546728.db2.gz	OKCUTGCLZAHZRW-LBPRGKRZSA-N	-2	3	364.401	0.685	20	5		FCBDHL
COC[C@@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000569116898	491635216	/nfs/dbraw/zinc/63/52/16/491635216.db2.gz	CWKGZIJQWMJQTQ-CYBMUJFWSA-N	-2	3	362.360	0.762	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]CCCN2CCCC2=O)c1[N+](=O)[O-]	ZINC000569227504	491643646	/nfs/dbraw/zinc/64/36/46/491643646.db2.gz	UMRJCALFAVPMIT-UHFFFAOYSA-N	-2	3	371.371	0.584	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@@H]1CCCOC1	ZINC000569232263	491644219	/nfs/dbraw/zinc/64/42/19/491644219.db2.gz	QXTAENHELGWRSO-NOZJJQNGSA-N	-2	3	374.371	0.762	20	5		FCBDHL
C[C@H](Cn1cncn1)[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000578197299	491671978	/nfs/dbraw/zinc/67/19/78/491671978.db2.gz	GCPYLZLTWMQYAG-MRVPVSSYSA-N	-2	3	355.332	0.252	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](CCC(N)=O)C(=O)[O-])c1[N+](=O)[O-]	ZINC000580269156	491723658	/nfs/dbraw/zinc/72/36/58/491723658.db2.gz	XQMIHCYWGHAWGT-SECBINFHSA-N	-2	3	359.360	0.209	20	5		FCBDHL
C[S@@](=O)CCC[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000580332830	491726554	/nfs/dbraw/zinc/72/65/54/491726554.db2.gz	FNNXIGSQVCSILF-OAQYLSRUSA-N	-2	3	350.374	0.340	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CCC(=O)[O-])C(=O)[O-])c1C	ZINC000614327762	492024864	/nfs/dbraw/zinc/02/48/64/492024864.db2.gz	YQBRLFWZQNAFOV-SECBINFHSA-N	-3	3	360.344	0.808	20	5		FCBDHL
Cn1cnc(CCC[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])n1	ZINC000592444765	546950362	/nfs/dbraw/zinc/95/03/62/546950362.db2.gz	GPLOPYRXBSCUDC-UHFFFAOYSA-N	-2	3	369.359	0.333	20	5		FCBDHL
CCOC[C@@H]([N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-])C(=O)[O-]	ZINC000594671500	547002216	/nfs/dbraw/zinc/00/22/16/547002216.db2.gz	SNHFPAWKWRIAKE-LLVKDONJSA-N	-2	3	369.355	0.911	20	5		FCBDHL
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2n[nH]cc2-c2nnn[n-]2)c(Cl)c1	ZINC000826499715	607462576	/nfs/dbraw/zinc/46/25/76/607462576.db2.gz	UHVOLLJUEBEQSJ-UHFFFAOYSA-N	-2	3	370.738	0.952	20	5		FCBDHL
Cc1[nH]nc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1-c1nnn[n-]1	ZINC000826322443	669490095	/nfs/dbraw/zinc/49/00/95/669490095.db2.gz	MHKZXVMRWJVMID-UHFFFAOYSA-N	-2	3	350.320	0.607	20	5		FCBDHL
C[C@H]1C[C@@H]1C(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001591776443	1284898760	/nfs/dbraw/zinc/89/87/60/1284898760.db2.gz	VFRVGCTXVATHHS-XPUUQOCRSA-N	-2	3	352.332	0.236	20	5		FCBDHL
O=C([O-])[C@@H](Cn1cncn1)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC001601661815	1286803695	/nfs/dbraw/zinc/80/36/95/1286803695.db2.gz	BZHWHCIJARFKOC-SNVBAGLBSA-N	-2	3	355.257	0.548	20	5		FCBDHL
CO[C@@H](C)CC(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001605002326	1287832421	/nfs/dbraw/zinc/83/24/21/1287832421.db2.gz	JEYKAMURHBBIKX-ZETCQYMHSA-N	-2	3	370.347	0.005	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1cccc(-c2nnn[n-]2)c1	ZINC001609560591	1289225404	/nfs/dbraw/zinc/22/54/04/1289225404.db2.gz	XQIPSYZSFMPFNS-UHFFFAOYSA-N	-2	3	374.338	0.894	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1cccc(-c2nn[n-]n2)c1	ZINC001609560591	1289225406	/nfs/dbraw/zinc/22/54/06/1289225406.db2.gz	XQIPSYZSFMPFNS-UHFFFAOYSA-N	-2	3	374.338	0.894	20	5		FCBDHL
COC(=O)CC[C@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000275288633	212000780	/nfs/dbraw/zinc/00/07/80/212000780.db2.gz	PCHLSIFOZBCITF-JTQLQIEISA-N	-2	3	374.371	0.896	20	5		FCBDHL
O=C(c1ccc([O-])cc1)N1CCN(C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)CC1	ZINC000444852999	248370260	/nfs/dbraw/zinc/37/02/60/248370260.db2.gz	DRSFQMCKPUUGNF-UHFFFAOYSA-N	-2	3	372.337	0.999	20	5		FCBDHL
O=C([O-])[C@@H](Cc1c[nH]cn1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000324627901	488905993	/nfs/dbraw/zinc/90/59/93/488905993.db2.gz	SYFVKXWCAJMLBR-SNVBAGLBSA-N	-2	3	358.307	0.431	20	5		FCBDHL
O=C([O-])[C@@H](Cc1cnc[nH]1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000324627901	488905998	/nfs/dbraw/zinc/90/59/98/488905998.db2.gz	SYFVKXWCAJMLBR-SNVBAGLBSA-N	-2	3	358.307	0.431	20	5		FCBDHL
CCC[C@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)[O-]	ZINC000262632911	488583236	/nfs/dbraw/zinc/58/32/36/488583236.db2.gz	FQZCNDRAGUNDAQ-QMMMGPOBSA-N	-2	3	360.344	0.898	20	5		FCBDHL
CCC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC)C(=O)[O-]	ZINC000274937150	488745787	/nfs/dbraw/zinc/74/57/87/488745787.db2.gz	QGIJBRDUYQIHCT-JTQLQIEISA-N	-2	3	360.344	0.913	20	5		FCBDHL
Cc1nc(S(=O)(=O)[N-][C@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])cn1C	ZINC000275255435	488777636	/nfs/dbraw/zinc/77/76/36/488777636.db2.gz	LPKJAPAQFUNKJT-GFCCVEGCSA-N	-2	3	368.371	0.611	20	5		FCBDHL
CO[C@@H]1COCC[C@H]1C[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000570401405	491238560	/nfs/dbraw/zinc/23/85/60/491238560.db2.gz	RRQKPZNCFNDTRU-GXSJLCMTSA-N	-2	3	374.371	0.623	20	5		FCBDHL
COC[C@@](C)(O)CC[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414330163	489496167	/nfs/dbraw/zinc/49/61/67/489496167.db2.gz	RWTDWNQDXOLPMK-ZDUSSCGKSA-N	-2	3	362.360	0.359	20	5		FCBDHL
NC(=O)[C@@H]1CC[C@H]([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])C1	ZINC000563892099	491275342	/nfs/dbraw/zinc/27/53/42/491275342.db2.gz	WSVBUOZVQWJSDI-SFYZADRCSA-N	-2	3	357.344	0.225	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@]1(CC(=O)[O-])CCOC1	ZINC000520397513	490142080	/nfs/dbraw/zinc/14/20/80/490142080.db2.gz	HEHOUQLANUMTJB-ZDUSSCGKSA-N	-2	3	360.344	0.516	20	5		FCBDHL
Cn1cc(CCC[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])cn1	ZINC000521444322	490263340	/nfs/dbraw/zinc/26/33/40/490263340.db2.gz	XRVXPDWZWWEDKQ-UHFFFAOYSA-N	-2	3	368.371	0.938	20	5		FCBDHL
C[C@@]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)(C(=O)[O-])C1CC1	ZINC000515643484	490834114	/nfs/dbraw/zinc/83/41/14/490834114.db2.gz	UOOBGAJYRVIWGG-AWEZNQCLSA-N	-2	3	372.355	0.898	20	5		FCBDHL
C[C@@H](CN1CCOCC1)[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000516574906	490869257	/nfs/dbraw/zinc/86/92/57/490869257.db2.gz	WOLLTGWKHHLJMF-JTQLQIEISA-N	-2	3	373.387	0.292	20	5		FCBDHL
O=C([O-])[C@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000519549599	490975648	/nfs/dbraw/zinc/97/56/48/490975648.db2.gz	LERQEBXNBDLAAI-SSDOTTSWSA-N	-2	3	358.250	0.337	20	5		FCBDHL
CSC[C@](C)(O)C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000572607355	491381437	/nfs/dbraw/zinc/38/14/37/491381437.db2.gz	VIBWVONGJPKUMG-GFCCVEGCSA-N	-2	3	364.401	0.685	20	5		FCBDHL
COC(=O)C[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C(=O)[O-]	ZINC000573329602	491426711	/nfs/dbraw/zinc/42/67/11/491426711.db2.gz	SHSVGHSEBVZGGT-ZCFIWIBFSA-N	-2	3	352.346	0.259	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1(C(=O)[O-])CCC1	ZINC000560416842	491538549	/nfs/dbraw/zinc/53/85/49/491538549.db2.gz	HRAKZRMVNSALDC-UHFFFAOYSA-N	-2	3	372.355	0.915	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)[C@@H](C)C(=O)[O-]	ZINC000576240489	491596256	/nfs/dbraw/zinc/59/62/56/491596256.db2.gz	QRSWNAAAUDKWFN-HTQZYQBOSA-N	-2	3	360.344	0.769	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@H](C(=O)[O-])[C@@H]2CCCOC2)c([N+](=O)[O-])c1	ZINC000569450025	491662416	/nfs/dbraw/zinc/66/24/16/491662416.db2.gz	RUJPYOINHOULJQ-RNCFNFMXSA-N	-2	3	374.371	0.762	20	5		FCBDHL
CSC[C@@](C)(O)C[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000581432847	491772666	/nfs/dbraw/zinc/77/26/66/491772666.db2.gz	MULBGIMLSSJNIJ-LBPRGKRZSA-N	-2	3	364.401	0.685	20	5		FCBDHL
CCOC(=O)CC[C@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000580753714	491744214	/nfs/dbraw/zinc/74/42/14/491744214.db2.gz	FGSSCRFRSCQGJY-JTQLQIEISA-N	-2	3	374.371	0.978	20	5		FCBDHL
CC(C)(C)[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-])C(N)=O	ZINC000414312528	526709946	/nfs/dbraw/zinc/70/99/46/526709946.db2.gz	ANXYLIUZOSGUIO-SNVBAGLBSA-N	-2	3	359.360	0.471	20	5		FCBDHL
CCn1cnnc1C[N-]S(=O)(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000546266614	546888456	/nfs/dbraw/zinc/88/84/56/546888456.db2.gz	GSKURQIMJPKLEY-UHFFFAOYSA-N	-2	3	369.359	0.691	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@H](Cc2ncccn2)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000593272470	546965589	/nfs/dbraw/zinc/96/55/89/546965589.db2.gz	KAUYXVMUGJZSIM-MRVPVSSYSA-N	-2	3	372.384	0.729	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](Cc2ncccn2)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000593272475	546965672	/nfs/dbraw/zinc/96/56/72/546965672.db2.gz	KAUYXVMUGJZSIM-QMMMGPOBSA-N	-2	3	372.384	0.729	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]CCOC[C@H]2CCOC2)c1[N+](=O)[O-]	ZINC000593313001	546965811	/nfs/dbraw/zinc/96/58/11/546965811.db2.gz	SHRKYUKCGQPCHO-JTQLQIEISA-N	-2	3	374.371	0.624	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]CCOC[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000593312800	546965872	/nfs/dbraw/zinc/96/58/72/546965872.db2.gz	IXDVRWZDRSEXTD-SNVBAGLBSA-N	-2	3	374.371	0.624	20	5		FCBDHL
CC[C@H](C(=O)[O-])N(C)C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000593924886	546995277	/nfs/dbraw/zinc/99/52/77/546995277.db2.gz	KKTSNLBTBHSSHK-SECBINFHSA-N	-2	3	359.360	0.195	20	5		FCBDHL
COCc1nc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)n[n-]1	ZINC000594828961	547015434	/nfs/dbraw/zinc/01/54/34/547015434.db2.gz	YRBSNECFRWNRKO-UHFFFAOYSA-N	-2	3	357.348	0.346	20	5		FCBDHL
COC[C@@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000831591212	601266494	/nfs/dbraw/zinc/26/64/94/601266494.db2.gz	SEERPDROXSYKCS-GFCCVEGCSA-N	-2	3	350.324	0.892	20	5		FCBDHL
Cn1cc(-c2nnn[n-]2)c([N-]S(=O)(=O)c2ccc([O-])c([N+](=O)[O-])c2)n1	ZINC000822623304	606710104	/nfs/dbraw/zinc/71/01/04/606710104.db2.gz	SRQLIYYUABLAOD-UHFFFAOYSA-N	-3	3	366.319	0.015	20	5		FCBDHL
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1n[nH]cc1-c1nnn[n-]1	ZINC000825718310	608306651	/nfs/dbraw/zinc/30/66/51/608306651.db2.gz	ZQXYTYFJCQXHEI-UHFFFAOYSA-N	-2	3	364.347	0.861	20	5		FCBDHL
Cc1[nH]nc([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c1-c1nnn[n-]1	ZINC000826293359	669490144	/nfs/dbraw/zinc/49/01/44/669490144.db2.gz	LZUMHMWYFKLRRM-UHFFFAOYSA-N	-2	3	364.347	0.916	20	5		FCBDHL
CCn1ncc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(=O)[O-])n1	ZINC000863428595	672125578	/nfs/dbraw/zinc/12/55/78/672125578.db2.gz	AHVNNQWJFLBYQY-UHFFFAOYSA-N	-2	3	355.332	0.383	20	5		FCBDHL
CCC=C(C)C(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001590536133	1283595100	/nfs/dbraw/zinc/59/51/00/1283595100.db2.gz	VLWKIZBJEYFSPO-XBXARRHUSA-N	-2	3	366.359	0.936	20	5		FCBDHL
Cn1cc(-c2nnn[n-]2)c([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)n1	ZINC001606222368	1288214801	/nfs/dbraw/zinc/21/48/01/1288214801.db2.gz	DIBCTBVOIASQKG-UHFFFAOYSA-N	-2	3	350.320	0.309	20	5		FCBDHL
CO[C@@H]1CCC[C@@H]([C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C(=O)[O-])C1	ZINC001606739892	1288479878	/nfs/dbraw/zinc/47/98/78/1288479878.db2.gz	OODYUPYQYOFFEO-IRUJWGPZSA-N	-2	3	373.387	0.927	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)c1cccc([N+](=O)[O-])c1	ZINC001609560431	1289225880	/nfs/dbraw/zinc/22/58/80/1289225880.db2.gz	NPXBOQKDYQMDTK-UHFFFAOYSA-N	-2	3	374.338	0.894	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)c1cccc([N+](=O)[O-])c1	ZINC001609560431	1289225885	/nfs/dbraw/zinc/22/58/85/1289225885.db2.gz	NPXBOQKDYQMDTK-UHFFFAOYSA-N	-2	3	374.338	0.894	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1cccc(-c2nnn[n-]2)c1	ZINC001609560380	1289226160	/nfs/dbraw/zinc/22/61/60/1289226160.db2.gz	LIQQTVOSUNNLPF-UHFFFAOYSA-N	-2	3	374.338	0.894	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1cccc(-c2nn[n-]n2)c1	ZINC001609560380	1289226169	/nfs/dbraw/zinc/22/61/69/1289226169.db2.gz	LIQQTVOSUNNLPF-UHFFFAOYSA-N	-2	3	374.338	0.894	20	5		FCBDHL
COC(=O)C[C@@H]([N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C(=O)[O-]	ZINC000297218597	214387017	/nfs/dbraw/zinc/38/70/17/214387017.db2.gz	NYEHALWHYWLXDR-SECBINFHSA-N	-2	3	360.344	0.506	20	5		FCBDHL
COC(=O)C[C@H]([N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C(=O)[O-]	ZINC000277265919	212345399	/nfs/dbraw/zinc/34/53/99/212345399.db2.gz	NYEHALWHYWLXDR-VIFPVBQESA-N	-2	3	360.344	0.506	20	5		FCBDHL
COC(=O)CC[C@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)[O-]	ZINC000275372383	212014653	/nfs/dbraw/zinc/01/46/53/212014653.db2.gz	YWAXOPMPFWNRDK-VIFPVBQESA-N	-2	3	360.344	0.588	20	5		FCBDHL
O=C(c1ccc([O-])cc1)N1CCN(C(=O)c2cc([N+](=O)[O-])c[n-]c2=O)CC1	ZINC000436653574	248046680	/nfs/dbraw/zinc/04/66/80/248046680.db2.gz	FTBWHBXATIBITL-UHFFFAOYSA-N	-2	3	372.337	0.999	20	5		FCBDHL
C[C@]1(C[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2[O-])NC(=O)[N-]C1=O	ZINC000288066313	488940183	/nfs/dbraw/zinc/94/01/83/488940183.db2.gz	YPIGKIYLZGCTET-MGPLVRAMSA-N	-2	3	362.342	0.893	20	5		FCBDHL
C[C@H](O)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000274906508	488742647	/nfs/dbraw/zinc/74/26/47/488742647.db2.gz	JNCJLVQDZZZPCX-SSDLBLMSSA-N	-2	3	372.277	0.726	20	5		FCBDHL
O=C([O-])[C@@H]1C=C[C@H]([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000274916514	488743097	/nfs/dbraw/zinc/74/30/97/488743097.db2.gz	AAZBFTJAOODYCC-BDAKNGLRSA-N	-2	3	370.339	0.674	20	5		FCBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCN1C[C@@H](C(=O)[O-])CC1=O	ZINC000275056003	488757042	/nfs/dbraw/zinc/75/70/42/488757042.db2.gz	YAQKOAOQUUTTFD-JTQLQIEISA-N	-2	3	371.371	0.115	20	5		FCBDHL
COC[C@@H]([N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000555374905	491248447	/nfs/dbraw/zinc/24/84/47/491248447.db2.gz	OFLSCTISXQZZHM-MRVPVSSYSA-N	-2	3	352.296	0.120	20	5		FCBDHL
CN(C)C(=O)C1([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1	ZINC000414356445	489497667	/nfs/dbraw/zinc/49/76/67/489497667.db2.gz	ZSCHYMRXVRLSRV-UHFFFAOYSA-N	-2	3	357.344	0.192	20	5		FCBDHL
COC(=O)Cc1nnc([N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])[n-]1	ZINC000414457532	489499815	/nfs/dbraw/zinc/49/98/15/489499815.db2.gz	SCUTXRJPCUSUIJ-UHFFFAOYSA-N	-2	3	369.359	0.846	20	5		FCBDHL
COC[C@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000571043168	491281793	/nfs/dbraw/zinc/28/17/93/491281793.db2.gz	BLWWSODEKOYKBX-ZDUSSCGKSA-N	-2	3	362.360	0.762	20	5		FCBDHL
Cn1cc([C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C(=O)[O-])cn1	ZINC000392512085	490151550	/nfs/dbraw/zinc/15/15/50/490151550.db2.gz	LGDWTHHHVHBMFB-LLVKDONJSA-N	-2	3	358.307	0.572	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C[C@H]1CCOC1)C(=O)[O-]	ZINC000548203673	490437831	/nfs/dbraw/zinc/43/78/31/490437831.db2.gz	VKNLFKVFPYHHSS-MWLCHTKSSA-N	-2	3	374.371	0.762	20	5		FCBDHL
COC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000548551522	490504611	/nfs/dbraw/zinc/50/46/11/490504611.db2.gz	LGCCDGLMSVHBDG-QMMMGPOBSA-N	-2	3	372.277	0.992	20	5		FCBDHL
O=C([O-])[C@@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C1CC1	ZINC000516525087	490867046	/nfs/dbraw/zinc/86/70/46/490867046.db2.gz	HCLWEIHRQJBEBN-LBPRGKRZSA-N	-2	3	358.328	0.508	20	5		FCBDHL
COC(=O)[C@@H](CC1CC1)[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000573377724	491429961	/nfs/dbraw/zinc/42/99/61/491429961.db2.gz	URAHRTKRKKRAAL-SNVBAGLBSA-N	-2	3	372.355	0.913	20	5		FCBDHL
COCCOCCC[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000566317576	491435382	/nfs/dbraw/zinc/43/53/82/491435382.db2.gz	UHLZPXHCHQBDJT-UHFFFAOYSA-N	-2	3	362.360	0.624	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]CCN2CC=CCC2)c1[N+](=O)[O-]	ZINC000576588395	491627301	/nfs/dbraw/zinc/62/73/01/491627301.db2.gz	PITIPVQCKUAQHH-UHFFFAOYSA-N	-2	3	355.372	0.833	20	5		FCBDHL
COc1c(F)cc(S(=O)(=O)[N-]C[C@@H](OC)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000616330065	492126151	/nfs/dbraw/zinc/12/61/51/492126151.db2.gz	HBCMUOGWTGBQCW-SECBINFHSA-N	-2	3	352.296	0.120	20	5		FCBDHL
CC[C@H](C[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-])C(=O)OC	ZINC000592446148	546950540	/nfs/dbraw/zinc/95/05/40/546950540.db2.gz	WZNOLFGSDHXSSU-MRVPVSSYSA-N	-2	3	360.344	0.771	20	5		FCBDHL
CC(C)[C@@H](CNC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000594459838	546999101	/nfs/dbraw/zinc/99/91/01/546999101.db2.gz	GZUQFWJVKCMMHK-SNVBAGLBSA-N	-2	3	373.387	0.346	20	5		FCBDHL
O=C([O-])[C@H](CCF)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000594573178	547001622	/nfs/dbraw/zinc/00/16/22/547001622.db2.gz	IWNAGDOSAVZWBV-ZETCQYMHSA-N	-2	3	364.307	0.457	20	5		FCBDHL
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]c1n[nH]cc1-c1nnn[n-]1	ZINC000826242707	607460463	/nfs/dbraw/zinc/46/04/63/607460463.db2.gz	BNWWFLRVCMWOOJ-UHFFFAOYSA-N	-2	3	350.320	0.607	20	5		FCBDHL
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)[N-]c1n[nH]cc1-c1nnn[n-]1	ZINC000826272374	608307171	/nfs/dbraw/zinc/30/71/71/608307171.db2.gz	GGQRGIZDOAAPIM-UHFFFAOYSA-N	-2	3	364.347	0.916	20	5		FCBDHL
CCn1nc(C)c(C[N-]S(=O)(=O)c2ccc(C(=O)[O-])c([N+](=O)[O-])c2)n1	ZINC000829707252	669719636	/nfs/dbraw/zinc/71/96/36/669719636.db2.gz	XOMNYVKFJRFGLB-UHFFFAOYSA-N	-2	3	369.359	0.691	20	5		FCBDHL
CC[C@H](OC)C(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001590478052	1283557608	/nfs/dbraw/zinc/55/76/08/1283557608.db2.gz	AQZFMCQIXKQILM-VIFPVBQESA-N	-2	3	370.347	0.005	20	5		FCBDHL
Cc1cc(S(=O)(=O)[N-]c2ccncc2[N+](=O)[O-])ccc1-c1nn[n-]n1	ZINC001592064284	1285101831	/nfs/dbraw/zinc/10/18/31/1285101831.db2.gz	FHIUTSNUQSVMCJ-UHFFFAOYSA-N	-2	3	361.343	0.701	20	5		FCBDHL
O=c1[n-]c([C@@H]2CCCN(c3cc(-c4nnn[n-]4)ccc3[N+](=O)[O-])C2)n[nH]1	ZINC001593497393	1286180980	/nfs/dbraw/zinc/18/09/80/1286180980.db2.gz	BAIDHGCXKCBTEH-SECBINFHSA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=c1[n-]c([C@@H]2CCCN(c3cc(-c4nn[n-]n4)ccc3[N+](=O)[O-])C2)n[nH]1	ZINC001593497393	1286180983	/nfs/dbraw/zinc/18/09/83/1286180983.db2.gz	BAIDHGCXKCBTEH-SECBINFHSA-N	-2	3	357.334	0.983	20	5		FCBDHL
CO[C@@H]1CCC[C@H]([C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C(=O)[O-])C1	ZINC001606739894	1288480284	/nfs/dbraw/zinc/48/02/84/1288480284.db2.gz	OODYUPYQYOFFEO-UFGOTCBOSA-N	-2	3	373.387	0.927	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1cccc(-c2nnn[n-]2)c1)c1cccc([N+](=O)[O-])c1	ZINC001609560625	1289225441	/nfs/dbraw/zinc/22/54/41/1289225441.db2.gz	ZENRBNLGSSYMPG-UHFFFAOYSA-N	-2	3	374.338	0.894	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1cccc(-c2nn[n-]n2)c1)c1cccc([N+](=O)[O-])c1	ZINC001609560625	1289225445	/nfs/dbraw/zinc/22/54/45/1289225445.db2.gz	ZENRBNLGSSYMPG-UHFFFAOYSA-N	-2	3	374.338	0.894	20	5		FCBDHL
CC(C)[C@@H](NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000296701005	214359977	/nfs/dbraw/zinc/35/99/77/214359977.db2.gz	BVTZVKBSVPWIPN-GFCCVEGCSA-N	-2	3	359.360	0.099	20	5		FCBDHL
O=C(NCCCNC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)c1cccc([O-])c1	ZINC000445190958	248375508	/nfs/dbraw/zinc/37/55/08/248375508.db2.gz	QJLOVPKWAYBKBB-UHFFFAOYSA-N	-2	3	360.326	0.951	20	5		FCBDHL
O=C([O-])[C@H](Cc1c[nH]cn1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000328431375	488922212	/nfs/dbraw/zinc/92/22/12/488922212.db2.gz	NKOINOFMJGSRHL-JTQLQIEISA-N	-2	3	374.762	0.946	20	5		FCBDHL
O=C([O-])[C@H](Cc1cnc[nH]1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000328431375	488922214	/nfs/dbraw/zinc/92/22/14/488922214.db2.gz	NKOINOFMJGSRHL-JTQLQIEISA-N	-2	3	374.762	0.946	20	5		FCBDHL
C[C@H](O)[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000274906506	488742721	/nfs/dbraw/zinc/74/27/21/488742721.db2.gz	JNCJLVQDZZZPCX-CDUCUWFYSA-N	-2	3	372.277	0.726	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](CC(=O)[O-])C(=O)[O-])cc1C	ZINC000275063504	488757886	/nfs/dbraw/zinc/75/78/86/488757886.db2.gz	ZHQRKIYDIUYEQG-SECBINFHSA-N	-3	3	360.344	0.665	20	5		FCBDHL
Cc1nc(S(=O)(=O)[N-][C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])cn1C	ZINC000275072673	488758781	/nfs/dbraw/zinc/75/87/81/488758781.db2.gz	LPKJAPAQFUNKJT-LBPRGKRZSA-N	-2	3	368.371	0.611	20	5		FCBDHL
NC(=O)[C@@H]1CC[C@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1	ZINC000414326024	489496009	/nfs/dbraw/zinc/49/60/09/489496009.db2.gz	AFWASCQWJKQKGB-APPZFPTMSA-N	-2	3	357.344	0.225	20	5		FCBDHL
COC(=O)Cc1nnc([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)[n-]1	ZINC000414463051	489500279	/nfs/dbraw/zinc/50/02/79/489500279.db2.gz	ZUSPYXMZLGBFQB-UHFFFAOYSA-N	-2	3	369.359	0.846	20	5		FCBDHL
Cc1nc(S(=O)(=O)[N-][C@@H](Cc2ccccc2[N+](=O)[O-])C(=O)[O-])c[nH]1	ZINC000547886856	490377375	/nfs/dbraw/zinc/37/73/75/490377375.db2.gz	JOPYELMRPPQXNS-JTQLQIEISA-N	-2	3	354.344	0.601	20	5		FCBDHL
Cn1cnc(S(=O)(=O)[N-][C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])c1	ZINC000547900178	490380566	/nfs/dbraw/zinc/38/05/66/490380566.db2.gz	NWNSNUMVDSQSFZ-NSHDSACASA-N	-2	3	354.344	0.303	20	5		FCBDHL
C[C@@](CO)(C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC(=O)[O-]	ZINC000548028031	490409467	/nfs/dbraw/zinc/40/94/67/490409467.db2.gz	BOOJSULKYLRMOU-LBPRGKRZSA-N	-2	3	366.779	1.000	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C[C@@H]1CCOC1)C(=O)[O-]	ZINC000548203674	490437898	/nfs/dbraw/zinc/43/78/98/490437898.db2.gz	VKNLFKVFPYHHSS-ONGXEEELSA-N	-2	3	374.371	0.762	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCCO[C@@H]2CCOC2)c1	ZINC000566316899	491435421	/nfs/dbraw/zinc/43/54/21/491435421.db2.gz	SJGPHVRTAMSNHD-LLVKDONJSA-N	-2	3	374.371	0.767	20	5		FCBDHL
CN1CC[C@@H](C[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])CC1=O	ZINC000568007712	491546662	/nfs/dbraw/zinc/54/66/62/491546662.db2.gz	YCFCCQWHJDTPTQ-SECBINFHSA-N	-2	3	371.371	0.440	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@@H]2CCOC2)c1[N+](=O)[O-]	ZINC000577036844	491583002	/nfs/dbraw/zinc/58/30/02/491583002.db2.gz	VCLPCKZGGLVLSN-GHMZBOCLSA-N	-2	3	358.372	0.980	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@H]1CCCOC1	ZINC000577722067	491645686	/nfs/dbraw/zinc/64/56/86/491645686.db2.gz	FSNCENLVWYNCDN-TVQRCGJNSA-N	-2	3	374.371	0.762	20	5		FCBDHL
C[C@H](CS(C)(=O)=O)[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000577758152	491649934	/nfs/dbraw/zinc/64/99/34/491649934.db2.gz	SVRALZWKIUJQGT-SSDOTTSWSA-N	-2	3	366.373	0.004	20	5		FCBDHL
Cn1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])c1=O	ZINC000739042893	600694738	/nfs/dbraw/zinc/69/47/38/600694738.db2.gz	KPTMNBIYUIRPNN-UHFFFAOYSA-N	-2	3	353.312	0.793	20	5		FCBDHL
O=C(NCCNc1ncccc1-c1nnn[n-]1)c1cccc([N+](=O)[O-])c1[O-]	ZINC000823206125	606646641	/nfs/dbraw/zinc/64/66/41/606646641.db2.gz	KMFUEKTZEMRWMO-UHFFFAOYSA-N	-2	3	370.329	0.717	20	5		FCBDHL
O=C(NCCNc1ncccc1-c1nn[n-]n1)c1cccc([N+](=O)[O-])c1[O-]	ZINC000823206125	606646642	/nfs/dbraw/zinc/64/66/42/606646642.db2.gz	KMFUEKTZEMRWMO-UHFFFAOYSA-N	-2	3	370.329	0.717	20	5		FCBDHL
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)[N-]c2n[nH]cc2-c2nnn[n-]2)c1C	ZINC000826272276	608307112	/nfs/dbraw/zinc/30/71/12/608307112.db2.gz	BMBACYGAWJMZLF-UHFFFAOYSA-N	-2	3	364.347	0.916	20	5		FCBDHL
O=C(NCCNc1ncccc1-c1nnn[n-]1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000826437937	609500188	/nfs/dbraw/zinc/50/01/88/609500188.db2.gz	HWOYNCYNANOOKN-UHFFFAOYSA-N	-2	3	370.329	0.717	20	5		FCBDHL
O=C(NCCNc1ncccc1-c1nn[n-]n1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000826437937	609500189	/nfs/dbraw/zinc/50/01/89/609500189.db2.gz	HWOYNCYNANOOKN-UHFFFAOYSA-N	-2	3	370.329	0.717	20	5		FCBDHL
Cc1nc(C)c(CC(=O)[N-]S(=O)(=O)c2cc([N+](=O)[O-])cs2)c(=O)[n-]1	ZINC000732622731	666891404	/nfs/dbraw/zinc/89/14/04/666891404.db2.gz	XNTUUDNFRBLPQY-UHFFFAOYSA-N	-2	3	372.384	0.816	20	5		FCBDHL
CCn1nc(C)c(C[N-]S(=O)(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)n1	ZINC000819158461	668984509	/nfs/dbraw/zinc/98/45/09/668984509.db2.gz	QBWQNXFCVPMJJB-UHFFFAOYSA-N	-2	3	369.359	0.691	20	5		FCBDHL
Cc1[nH]nc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)c1-c1nnn[n-]1	ZINC000826272291	669489515	/nfs/dbraw/zinc/48/95/15/669489515.db2.gz	CGFURMDTJDZLDT-UHFFFAOYSA-N	-2	3	364.347	0.916	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCCCNC2=O)c1	ZINC000840889823	670524051	/nfs/dbraw/zinc/52/40/51/670524051.db2.gz	OFWWRXNCEPGMNJ-SECBINFHSA-N	-2	3	357.344	0.240	20	5		FCBDHL
Cc1cc(S(=O)(=O)[N-]C[C@@H](C(=O)[O-])[C@@H]2CCOC2)c([N+](=O)[O-])s1	ZINC001600298770	1286472505	/nfs/dbraw/zinc/47/25/05/1286472505.db2.gz	BLXLTFOAYFYLHY-RKDXNWHRSA-N	-2	3	364.401	0.980	20	5		FCBDHL
O=c1[n-]c([C@H]2CCCN(c3cccc(-c4nnn[n-]4)c3[N+](=O)[O-])C2)n[nH]1	ZINC001609605172	1289259788	/nfs/dbraw/zinc/25/97/88/1289259788.db2.gz	MEZYSDMWRSCEHO-QMMMGPOBSA-N	-2	3	357.334	0.983	20	5		FCBDHL
Cc1nc([C@@H](C)[N-]S(=O)(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)n[nH]1	ZINC000285384756	213334493	/nfs/dbraw/zinc/33/44/93/213334493.db2.gz	JCNCJBPYDGZKQN-ZCFIWIBFSA-N	-2	3	355.332	0.759	20	5		FCBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCn1cc(C(=O)[O-])nn1	ZINC000277453513	212361837	/nfs/dbraw/zinc/36/18/37/212361837.db2.gz	RIHPMNLOPVKEJY-UHFFFAOYSA-N	-2	3	355.332	0.171	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H](CC(=O)[O-])C(=O)[O-])c1[N+](=O)[O-]	ZINC000277352493	212352584	/nfs/dbraw/zinc/35/25/84/212352584.db2.gz	XONXNYGCAFBWEO-VIFPVBQESA-N	-3	3	360.344	0.665	20	5		FCBDHL
O=C([O-])[C@]1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCOC1	ZINC000316143261	488897597	/nfs/dbraw/zinc/89/75/97/488897597.db2.gz	VHGMPHMZVXVIPM-NSHDSACASA-N	-2	3	350.736	0.770	20	5		FCBDHL
C[C@H](CCC(=O)[O-])[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000274945399	488746434	/nfs/dbraw/zinc/74/64/34/488746434.db2.gz	FQVDMPPQANJYAJ-MRVPVSSYSA-N	-2	3	360.344	0.898	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCCCC(=O)[O-]	ZINC000274955161	488747808	/nfs/dbraw/zinc/74/78/08/488747808.db2.gz	UDPYZRYIDSKEQN-UHFFFAOYSA-N	-2	3	360.344	0.915	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](CC(=O)[O-])C(=O)[O-])c1C	ZINC000275057473	488757121	/nfs/dbraw/zinc/75/71/21/488757121.db2.gz	YGKSEGUPPIQUEE-VIFPVBQESA-N	-3	3	360.344	0.665	20	5		FCBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCN1C[C@H](C(=O)[O-])CC1=O	ZINC000275056007	488757260	/nfs/dbraw/zinc/75/72/60/488757260.db2.gz	YAQKOAOQUUTTFD-SNVBAGLBSA-N	-2	3	371.371	0.115	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1(C(=O)[O-])CCC1	ZINC000282363485	489157986	/nfs/dbraw/zinc/15/79/86/489157986.db2.gz	BKNJAGYUZKJQAR-UHFFFAOYSA-N	-2	3	358.328	0.667	20	5		FCBDHL
CO[C@@H]1COCC[C@@H]1C[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000570401407	491238468	/nfs/dbraw/zinc/23/84/68/491238468.db2.gz	RRQKPZNCFNDTRU-MWLCHTKSSA-N	-2	3	374.371	0.623	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@H]1CCOC1	ZINC000547877979	490373675	/nfs/dbraw/zinc/37/36/75/490373675.db2.gz	TVHYQWQSLZQYSU-QPUJVOFHSA-N	-2	3	360.344	0.371	20	5		FCBDHL
Cc1cnn(C[C@H]([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C(=O)[O-])c1	ZINC000547881512	490375411	/nfs/dbraw/zinc/37/54/11/490375411.db2.gz	HSVFHVNAHDDFSC-NSHDSACASA-N	-2	3	368.371	0.840	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C(=O)[O-])[C@H]2CCOC2)cc1C	ZINC000548530593	490496969	/nfs/dbraw/zinc/49/69/69/490496969.db2.gz	RDAHBXPRXDKJNS-GWCFXTLKSA-N	-2	3	358.372	0.980	20	5		FCBDHL
C[C@](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)(CC(=O)[O-])C(=O)[O-]	ZINC000548589004	490513406	/nfs/dbraw/zinc/51/34/06/490513406.db2.gz	YTBVICMHVKXCAF-GFCCVEGCSA-N	-3	3	364.307	0.578	20	5		FCBDHL
O=C([O-])c1ccc(S(=O)(=O)[N-]CCC2(O)CCOCC2)c([N+](=O)[O-])c1	ZINC000571886264	491335274	/nfs/dbraw/zinc/33/52/74/491335274.db2.gz	NPUQLCUVAWCWLM-UHFFFAOYSA-N	-2	3	374.371	0.503	20	5		FCBDHL
COC[C@@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000514861073	490793586	/nfs/dbraw/zinc/79/35/86/490793586.db2.gz	PKETYIOZFOJBNZ-CYBMUJFWSA-N	-2	3	362.360	0.762	20	5		FCBDHL
C[C@H](CO[C@@H]1CCOC1)[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000519660097	490983015	/nfs/dbraw/zinc/98/30/15/490983015.db2.gz	WEJUKVQCLBSZJC-MWLCHTKSSA-N	-2	3	374.371	0.765	20	5		FCBDHL
COC[C@](C)(O)CC[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000574280790	491486013	/nfs/dbraw/zinc/48/60/13/491486013.db2.gz	AMPNKKBNEBOKGZ-CYBMUJFWSA-N	-2	3	362.360	0.359	20	5		FCBDHL
COC(=O)[C@H](CC1CC1)[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000574814738	491521843	/nfs/dbraw/zinc/52/18/43/491521843.db2.gz	JDWCVTGTUNVOPC-JTQLQIEISA-N	-2	3	372.355	0.913	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@H](C(=O)[O-])[C@H]2CCOC2)cc1[N+](=O)[O-]	ZINC000574974894	491531308	/nfs/dbraw/zinc/53/13/08/491531308.db2.gz	FHJCTPMNIJMUAS-XVKPBYJWSA-N	-2	3	350.374	0.733	20	5		FCBDHL
CC(C)(C)NC(=O)C[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000568007559	491546702	/nfs/dbraw/zinc/54/67/02/491546702.db2.gz	QSZXFYHODDGBQA-UHFFFAOYSA-N	-2	3	359.360	0.486	20	5		FCBDHL
C[C@@H](CS(C)(=O)=O)[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000577758153	491650205	/nfs/dbraw/zinc/65/02/05/491650205.db2.gz	SVRALZWKIUJQGT-ZETCQYMHSA-N	-2	3	366.373	0.004	20	5		FCBDHL
C[C@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-])c1nncn1C	ZINC000584841909	491716680	/nfs/dbraw/zinc/71/66/80/491716680.db2.gz	LQTJCXPYOJQKKC-ZETCQYMHSA-N	-2	3	355.332	0.461	20	5		FCBDHL
O=C([O-])[C@@H](C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C1CC1	ZINC000595994573	491970514	/nfs/dbraw/zinc/97/05/14/491970514.db2.gz	IPGVCFJWAUCVHY-GFCCVEGCSA-N	-2	3	371.371	0.100	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]CC[C@@]2(O)CCCOC2)c1[N+](=O)[O-]	ZINC000593316408	546966656	/nfs/dbraw/zinc/96/66/56/546966656.db2.gz	OUFJJPQVKWGYJL-AWEZNQCLSA-N	-2	3	374.371	0.503	20	5		FCBDHL
COc1c(F)cc(S(=O)(=O)[N-][C@H](CCF)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000594572811	547001454	/nfs/dbraw/zinc/00/14/54/547001454.db2.gz	CSRWQCKIFAFMGA-MRVPVSSYSA-N	-2	3	354.287	0.834	20	5		FCBDHL
O=C([O-])[C@@H](CCF)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000594573177	547001987	/nfs/dbraw/zinc/00/19/87/547001987.db2.gz	IWNAGDOSAVZWBV-SSDOTTSWSA-N	-2	3	364.307	0.457	20	5		FCBDHL
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]c1n[nH]cc1-c1nnn[n-]1	ZINC000826498517	607462368	/nfs/dbraw/zinc/46/23/68/607462368.db2.gz	YMEGRXAFQRALPU-UHFFFAOYSA-N	-2	3	370.738	0.952	20	5		FCBDHL
Cc1oncc1[N-]S(=O)(=O)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000826349496	607634606	/nfs/dbraw/zinc/63/46/06/607634606.db2.gz	JQLKSRKSZBSBAL-UHFFFAOYSA-N	-2	3	351.304	0.872	20	5		FCBDHL
Cc1oncc1[N-]S(=O)(=O)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000826349496	607634608	/nfs/dbraw/zinc/63/46/08/607634608.db2.gz	JQLKSRKSZBSBAL-UHFFFAOYSA-N	-2	3	351.304	0.872	20	5		FCBDHL
O=C(NCCNc1ccc(-c2nnn[n-]2)cn1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000826437943	609500594	/nfs/dbraw/zinc/50/05/94/609500594.db2.gz	HXMPIFGYWPMPPW-UHFFFAOYSA-N	-2	3	370.329	0.717	20	5		FCBDHL
O=C(NCCNc1ccc(-c2nn[n-]n2)cn1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000826437943	609500595	/nfs/dbraw/zinc/50/05/95/609500595.db2.gz	HXMPIFGYWPMPPW-UHFFFAOYSA-N	-2	3	370.329	0.717	20	5		FCBDHL
CCOC(=O)c1cnn(Cc2cc([O-])ccc2[N+](=O)[O-])c1-c1nnn[n-]1	ZINC001578254601	1275554994	/nfs/dbraw/zinc/55/49/94/1275554994.db2.gz	XUPBQHJQYALQMJ-UHFFFAOYSA-N	-2	3	359.302	0.902	20	5		FCBDHL
CCOC(=O)c1cnn(Cc2cc([O-])ccc2[N+](=O)[O-])c1-c1nn[n-]n1	ZINC001578254601	1275555002	/nfs/dbraw/zinc/55/50/02/1275555002.db2.gz	XUPBQHJQYALQMJ-UHFFFAOYSA-N	-2	3	359.302	0.902	20	5		FCBDHL
CC[C@@H](OC)C(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001590478051	1283556569	/nfs/dbraw/zinc/55/65/69/1283556569.db2.gz	AQZFMCQIXKQILM-SECBINFHSA-N	-2	3	370.347	0.005	20	5		FCBDHL
Cn1cc(-c2nnn[n-]2)c([N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])n1	ZINC001592559742	1285471305	/nfs/dbraw/zinc/47/13/05/1285471305.db2.gz	CFSYYMNHQRGHEV-UHFFFAOYSA-N	-2	3	364.347	0.450	20	5		FCBDHL
CO[C@H](C)CC(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001605002323	1287832051	/nfs/dbraw/zinc/83/20/51/1287832051.db2.gz	JEYKAMURHBBIKX-SSDOTTSWSA-N	-2	3	370.347	0.005	20	5		FCBDHL
Cc1nc([N-]S(=O)(=O)c2cncc(-c3nnn[n-]3)c2)ccc1[N+](=O)[O-]	ZINC001609453840	1289159743	/nfs/dbraw/zinc/15/97/43/1289159743.db2.gz	WVKIAYQQSCTWQU-UHFFFAOYSA-N	-2	3	362.331	0.674	20	5		FCBDHL
Cc1nc([N-]S(=O)(=O)c2cncc(-c3nn[n-]n3)c2)ccc1[N+](=O)[O-]	ZINC001609453840	1289159748	/nfs/dbraw/zinc/15/97/48/1289159748.db2.gz	WVKIAYQQSCTWQU-UHFFFAOYSA-N	-2	3	362.331	0.674	20	5		FCBDHL
O=C([O-])[C@@H]1CCCCN1C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000263382663	488610883	/nfs/dbraw/zinc/61/08/83/488610883.db2.gz	BYUUOTWTAWMOCH-NSHDSACASA-N	-2	3	371.371	0.339	20	5		FCBDHL
O=C([O-])[C@@H]1C=C[C@@H]([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000274916525	488743481	/nfs/dbraw/zinc/74/34/81/488743481.db2.gz	AAZBFTJAOODYCC-RKDXNWHRSA-N	-2	3	370.339	0.674	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)CCC(=O)[O-]	ZINC000274946835	488747058	/nfs/dbraw/zinc/74/70/58/488747058.db2.gz	FWGSBNXPUHUTRA-MRVPVSSYSA-N	-2	3	360.344	0.913	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](Cc2c[nH]cn2)C(=O)[O-])cc1C	ZINC000275018341	488753947	/nfs/dbraw/zinc/75/39/47/488753947.db2.gz	CXFRRZZSHOUNPS-LLVKDONJSA-N	-2	3	368.371	0.909	20	5		FCBDHL
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H](CCO)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000275043677	488756065	/nfs/dbraw/zinc/75/60/65/488756065.db2.gz	HGEFJWWEKNDTCQ-QMMMGPOBSA-N	-2	3	352.752	0.671	20	5		FCBDHL
CCC(=O)C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(=O)[O-]	ZINC000275076651	488759101	/nfs/dbraw/zinc/75/91/01/488759101.db2.gz	XTQKCGPLXKDUSA-JTQLQIEISA-N	-2	3	360.344	0.704	20	5		FCBDHL
C[C@@]1(C[C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2[O-])NC(=O)[N-]C1=O	ZINC000286136862	489360290	/nfs/dbraw/zinc/36/02/90/489360290.db2.gz	HQCPZLPBOZUDGB-HWPZZCPQSA-N	-2	3	362.342	0.893	20	5		FCBDHL
C[C@@]1(C[C@@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2[O-])NC(=O)[N-]C1=O	ZINC000286313519	489378890	/nfs/dbraw/zinc/37/88/90/489378890.db2.gz	UDDFIKHYXFRETL-FVMDXXJSSA-N	-2	3	362.342	0.893	20	5		FCBDHL
CCOC(=O)[C@H](C)C[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414318225	489495593	/nfs/dbraw/zinc/49/55/93/489495593.db2.gz	LMRRFJIWCYFTOO-MRVPVSSYSA-N	-2	3	360.344	0.771	20	5		FCBDHL
CN1C[C@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])CCC1=O	ZINC000414321037	489496288	/nfs/dbraw/zinc/49/62/88/489496288.db2.gz	QJYLRVIYYPDPFX-SECBINFHSA-N	-2	3	357.344	0.192	20	5		FCBDHL
COC(=O)Cc1nnc([N-]S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)[n-]1	ZINC000414448873	489499116	/nfs/dbraw/zinc/49/91/16/489499116.db2.gz	BXKWUZZEOLOBGP-UHFFFAOYSA-N	-2	3	369.359	0.846	20	5		FCBDHL
COC(=O)Cc1nnc([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)[n-]1	ZINC000460541205	489872070	/nfs/dbraw/zinc/87/20/70/489872070.db2.gz	ZYYPMPZOBVCNQP-UHFFFAOYSA-N	-2	3	355.332	0.538	20	5		FCBDHL
O=C(NCC[N-]S(=O)(=O)c1cccs1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000437459543	490023226	/nfs/dbraw/zinc/02/32/26/490023226.db2.gz	NNRKZZSSIXASMO-UHFFFAOYSA-N	-2	3	372.384	0.465	20	5		FCBDHL
COc1cc(S(=O)(=O)[N-][C@H](CC(F)F)C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000547881363	490375137	/nfs/dbraw/zinc/37/51/37/490375137.db2.gz	BVMWQJLZXIQAPW-SSDOTTSWSA-N	-2	3	354.287	0.990	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](C(=O)[O-])c2cnn(C)c2)cc1[N+](=O)[O-]	ZINC000548530865	490496384	/nfs/dbraw/zinc/49/63/84/490496384.db2.gz	VSWBCEDYWHHRCN-SNVBAGLBSA-N	-2	3	360.373	0.802	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C[C@@H]1CCOC1)C(=O)[O-]	ZINC000548531905	490497677	/nfs/dbraw/zinc/49/76/77/490497677.db2.gz	WEKUOWHLLVIHMO-GXSJLCMTSA-N	-2	3	374.371	0.762	20	5		FCBDHL
COC[C@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000514861074	490793611	/nfs/dbraw/zinc/79/36/11/490793611.db2.gz	PKETYIOZFOJBNZ-ZDUSSCGKSA-N	-2	3	362.360	0.762	20	5		FCBDHL
COc1c(F)cc(S(=O)(=O)[N-]CCOCC(=O)[O-])cc1[N+](=O)[O-]	ZINC000514982477	490801246	/nfs/dbraw/zinc/80/12/46/490801246.db2.gz	ICGMJUUPEPLFMA-UHFFFAOYSA-N	-2	3	352.296	0.122	20	5		FCBDHL
O=C([O-])CNC(=O)CC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000572348658	491364227	/nfs/dbraw/zinc/36/42/27/491364227.db2.gz	KMJVVPCZIKPMGD-UHFFFAOYSA-N	-2	3	365.751	0.117	20	5		FCBDHL
CCC(CC)([N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-])C(N)=O	ZINC000566317282	491435568	/nfs/dbraw/zinc/43/55/68/491435568.db2.gz	ZJVDGXUZLDBOOQ-UHFFFAOYSA-N	-2	3	359.360	0.615	20	5		FCBDHL
C[S@](=O)CCC[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000574575996	491506452	/nfs/dbraw/zinc/50/64/52/491506452.db2.gz	DFIAZODYJBCBDM-NRFANRHFSA-N	-2	3	350.374	0.340	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@H](C(=O)[O-])[C@@H]2CCOC2)cc1[N+](=O)[O-]	ZINC000574974893	491531079	/nfs/dbraw/zinc/53/10/79/491531079.db2.gz	FHJCTPMNIJMUAS-XCBNKYQSSA-N	-2	3	350.374	0.733	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@H](C(=O)[O-])c2ccnn2C)cc1[N+](=O)[O-]	ZINC000567692104	491522957	/nfs/dbraw/zinc/52/29/57/491522957.db2.gz	OPRHGRAFFMTMHU-JTQLQIEISA-N	-2	3	360.373	0.802	20	5		FCBDHL
CCOC(=O)[C@@H](C)C[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000577284755	491609711	/nfs/dbraw/zinc/60/97/11/491609711.db2.gz	GSRKOQYHORNJSN-QMMMGPOBSA-N	-2	3	360.344	0.771	20	5		FCBDHL
COC[C@H]([N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000568843477	491612562	/nfs/dbraw/zinc/61/25/62/491612562.db2.gz	KSDMEJVEGHAMMH-ZETCQYMHSA-N	-2	3	372.277	0.992	20	5		FCBDHL
CCc1ccc(S(=O)(=O)[N-]c2nnc(CC(=O)OC)[n-]2)cc1[N+](=O)[O-]	ZINC000577751462	491649523	/nfs/dbraw/zinc/64/95/23/491649523.db2.gz	GMQGHCWSDFKRFY-UHFFFAOYSA-N	-2	3	369.359	0.792	20	5		FCBDHL
C[C@@H](Cn1cncn1)[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000578197300	491671895	/nfs/dbraw/zinc/67/18/95/491671895.db2.gz	GCPYLZLTWMQYAG-QMMMGPOBSA-N	-2	3	355.332	0.252	20	5		FCBDHL
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])[C@@H]1OC	ZINC000580571373	491736761	/nfs/dbraw/zinc/73/67/61/491736761.db2.gz	HREQHAYUBBFFLR-BREBYQMCSA-N	-2	3	374.371	0.764	20	5		FCBDHL
CCC[C@H](O)[C@@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC)C(=O)[O-]	ZINC000619470672	492264407	/nfs/dbraw/zinc/26/44/07/492264407.db2.gz	BEYKZIBWVCACKB-GXSJLCMTSA-N	-2	3	362.360	0.496	20	5		FCBDHL
Cn1cnc(CCC[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])n1	ZINC000593312542	546965616	/nfs/dbraw/zinc/96/56/16/546965616.db2.gz	SCAKDRUAMLDBNU-UHFFFAOYSA-N	-2	3	369.359	0.333	20	5		FCBDHL
CC[C@@H](C(=O)[O-])N(C)C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000593924887	546995213	/nfs/dbraw/zinc/99/52/13/546995213.db2.gz	KKTSNLBTBHSSHK-VIFPVBQESA-N	-2	3	359.360	0.195	20	5		FCBDHL
CCn1cc(S(=O)(=O)[N-]c2ncc(-c3nnn[n-]3)s2)c([N+](=O)[O-])n1	ZINC000825804711	607693794	/nfs/dbraw/zinc/69/37/94/607693794.db2.gz	DYJOPZUVNDYLDM-UHFFFAOYSA-N	-2	3	371.364	0.249	20	5		FCBDHL
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1nn(C)cc1-c1nnn[n-]1	ZINC000822212993	606711146	/nfs/dbraw/zinc/71/11/46/606711146.db2.gz	PUIHGRNAONDWBX-UHFFFAOYSA-N	-2	3	364.347	0.618	20	5		FCBDHL
O=[N+]([O-])c1ccccc1CCS(=O)(=O)[N-]c1n[nH]cc1-c1nnn[n-]1	ZINC000826500287	609162250	/nfs/dbraw/zinc/16/22/50/609162250.db2.gz	SAFPUNPDRAWZPO-UHFFFAOYSA-N	-2	3	364.347	0.482	20	5		FCBDHL
O=[N+]([O-])c1ccccc1CCS(=O)(=O)[N-]c1n[nH]cc1-c1nn[n-]n1	ZINC000826500287	609162251	/nfs/dbraw/zinc/16/22/51/609162251.db2.gz	SAFPUNPDRAWZPO-UHFFFAOYSA-N	-2	3	364.347	0.482	20	5		FCBDHL
CC(=O)C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000787934634	668815853	/nfs/dbraw/zinc/81/58/53/668815853.db2.gz	JOXPCHYXMSBUFA-SECBINFHSA-N	-2	3	350.736	0.959	20	5		FCBDHL
O=[N+]([O-])c1cccnc1S(=O)(=O)[N-]Cc1ccnc(-c2nnn[n-]2)c1	ZINC001593487126	1286176541	/nfs/dbraw/zinc/17/65/41/1286176541.db2.gz	VLXKPJPUXPPQFN-UHFFFAOYSA-N	-2	3	362.331	0.043	20	5		FCBDHL
O=[N+]([O-])c1cccnc1S(=O)(=O)[N-]Cc1ccnc(-c2nn[n-]n2)c1	ZINC001593487126	1286176544	/nfs/dbraw/zinc/17/65/44/1286176544.db2.gz	VLXKPJPUXPPQFN-UHFFFAOYSA-N	-2	3	362.331	0.043	20	5		FCBDHL
CC(C)(CCC(=O)[O-])NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000296780233	214363413	/nfs/dbraw/zinc/36/34/13/214363413.db2.gz	LTGMLPOVQHIARO-UHFFFAOYSA-N	-2	3	373.387	0.633	20	5		FCBDHL
C[C@@](O)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000263499089	209731567	/nfs/dbraw/zinc/73/15/67/209731567.db2.gz	SESOVILSJXNNSB-SNVBAGLBSA-N	-2	3	372.277	0.728	20	5		FCBDHL
COC[C@](C)(O)CC[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414330162	237467448	/nfs/dbraw/zinc/46/74/48/237467448.db2.gz	RWTDWNQDXOLPMK-CYBMUJFWSA-N	-2	3	362.360	0.359	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-]C[C@@](C)(CO)CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000275633870	212064844	/nfs/dbraw/zinc/06/48/44/212064844.db2.gz	MLJXPVIEJGGTSN-ZDUSSCGKSA-N	-2	3	362.360	0.355	20	5		FCBDHL
O=C([O-])[C@@H](Cc1c[nH]cn1)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000323880418	488904687	/nfs/dbraw/zinc/90/46/87/488904687.db2.gz	UKLXRSKQFGZJJV-SECBINFHSA-N	-2	3	374.762	0.946	20	5		FCBDHL
O=C([O-])[C@@H](Cc1cnc[nH]1)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000323880418	488904691	/nfs/dbraw/zinc/90/46/91/488904691.db2.gz	UKLXRSKQFGZJJV-SECBINFHSA-N	-2	3	374.762	0.946	20	5		FCBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]Cc1cn(CC(=O)[O-])nn1	ZINC000325419032	488910044	/nfs/dbraw/zinc/91/00/44/488910044.db2.gz	NHOKDXBZPGAZKM-UHFFFAOYSA-N	-2	3	355.332	0.058	20	5		FCBDHL
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H](CC(N)=O)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000274878373	488740118	/nfs/dbraw/zinc/74/01/18/488740118.db2.gz	CCGHSBWIARFZRJ-ZETCQYMHSA-N	-2	3	365.751	0.164	20	5		FCBDHL
C[C@@]1(C[C@H]2CCCN2C(=O)c2ccc([O-])c([N+](=O)[O-])c2)NC(=O)[N-]C1=O	ZINC000286208536	489368930	/nfs/dbraw/zinc/36/89/30/489368930.db2.gz	MSPMDSYZMSHGQX-HWPZZCPQSA-N	-2	3	362.342	0.893	20	5		FCBDHL
COC(=O)C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000298854315	489374341	/nfs/dbraw/zinc/37/43/41/489374341.db2.gz	MNZGGQNAZRGYPX-QMMMGPOBSA-N	-2	3	366.735	0.543	20	5		FCBDHL
C[C@]1(C[C@H]2CCCN2C(=O)c2cccc([O-])c2[N+](=O)[O-])NC(=O)[N-]C1=O	ZINC000286275573	489375710	/nfs/dbraw/zinc/37/57/10/489375710.db2.gz	QTMAKZLDYWKMKA-JDNHERCYSA-N	-2	3	362.342	0.893	20	5		FCBDHL
CC(C)C(=O)NCC[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414324864	489496101	/nfs/dbraw/zinc/49/61/01/489496101.db2.gz	WJTWAXWZFOJAJD-UHFFFAOYSA-N	-2	3	359.360	0.344	20	5		FCBDHL
CN1C[C@@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])CCC1=O	ZINC000414321039	489496200	/nfs/dbraw/zinc/49/62/00/489496200.db2.gz	QJYLRVIYYPDPFX-VIFPVBQESA-N	-2	3	357.344	0.192	20	5		FCBDHL
CO[C@@H]1COCC[C@@H]1C[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414331808	489496244	/nfs/dbraw/zinc/49/62/44/489496244.db2.gz	QZNJTSQLQUVCPL-ZYHUDNBSSA-N	-2	3	374.371	0.623	20	5		FCBDHL
COCCOCCC[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414321555	489496322	/nfs/dbraw/zinc/49/63/22/489496322.db2.gz	RCDBPONXZZKQGR-UHFFFAOYSA-N	-2	3	362.360	0.624	20	5		FCBDHL
O=C([O-])[C@H](CF)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000571044111	491282220	/nfs/dbraw/zinc/28/22/20/491282220.db2.gz	XPLROPUCSGVAMB-LURJTMIESA-N	-2	3	350.280	0.067	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@H](C[C@H]2CCOC2)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000547874345	490372309	/nfs/dbraw/zinc/37/23/09/490372309.db2.gz	ZKUVDRNQTVUFFG-MWLCHTKSSA-N	-2	3	374.371	0.762	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](CCC(=O)[O-])C(=O)[O-])cc1[N+](=O)[O-]	ZINC000547925524	490388189	/nfs/dbraw/zinc/38/81/89/490388189.db2.gz	UXLHQICSXUUXPS-LURJTMIESA-N	-3	3	352.346	0.561	20	5		FCBDHL
O=C([O-])[C@@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br	ZINC000548201101	490437790	/nfs/dbraw/zinc/43/77/90/490437790.db2.gz	CBSAZHKVVJPIBA-SSDOTTSWSA-N	-2	3	369.149	0.081	20	5		FCBDHL
CCC[C@@H](O)[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(=O)[O-]	ZINC000548593335	490514627	/nfs/dbraw/zinc/51/46/27/490514627.db2.gz	ZQCSNNJHAOLRRP-SKDRFNHKSA-N	-2	3	362.360	0.496	20	5		FCBDHL
O=C(c1cc(Cl)cc([N+](=O)[O-])c1[O-])N1CCN2C(=O)[N-]C(=O)[C@H]2C1	ZINC000516295549	490859745	/nfs/dbraw/zinc/85/97/45/490859745.db2.gz	TYGNKWGFLNBQIN-SECBINFHSA-N	-2	3	354.706	0.330	20	5		FCBDHL
Cc1c([C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C(=O)[O-])cnn1C	ZINC000530488023	490908905	/nfs/dbraw/zinc/90/89/05/490908905.db2.gz	VOUZYDYDCYMPJD-LBPRGKRZSA-N	-2	3	354.344	0.741	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@H]2CCOC2)cc1[N+](=O)[O-]	ZINC000574974892	491531324	/nfs/dbraw/zinc/53/13/24/491531324.db2.gz	FHJCTPMNIJMUAS-OIBJUYFYSA-N	-2	3	350.374	0.733	20	5		FCBDHL
Cc1cnn(C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C(=O)[O-])c1	ZINC000562320642	491665817	/nfs/dbraw/zinc/66/58/17/491665817.db2.gz	KQMDRVUHCVANJN-NSHDSACASA-N	-2	3	372.334	0.671	20	5		FCBDHL
C[C@@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-])c1nncn1C	ZINC000584841908	491716656	/nfs/dbraw/zinc/71/66/56/491716656.db2.gz	LQTJCXPYOJQKKC-SSDOTTSWSA-N	-2	3	355.332	0.461	20	5		FCBDHL
O=C([O-])[C@@H](Cc1ccncc1)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000590599832	491780647	/nfs/dbraw/zinc/78/06/47/491780647.db2.gz	GHKIOBRTCLMVRX-LLVKDONJSA-N	-2	3	351.340	0.964	20	5		FCBDHL
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](CC(F)F)C(=O)[O-]	ZINC000619470323	492264220	/nfs/dbraw/zinc/26/42/20/492264220.db2.gz	IRQSFWWHUYXSDE-ZCFIWIBFSA-N	-2	3	354.287	0.990	20	5		FCBDHL
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](C(=O)[O-])c1cnn(C)c1	ZINC000619470281	492264306	/nfs/dbraw/zinc/26/43/06/492264306.db2.gz	FFOZVHCHMFBRGZ-NSHDSACASA-N	-2	3	370.343	0.441	20	5		FCBDHL
CN1CC[C@@H](C[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1=O	ZINC000424600781	536450616	/nfs/dbraw/zinc/45/06/16/536450616.db2.gz	OMTYELQZJICALA-SECBINFHSA-N	-2	3	371.371	0.440	20	5		FCBDHL
CCOC[C@H]([N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-])C(=O)[O-]	ZINC000594671501	547002502	/nfs/dbraw/zinc/00/25/02/547002502.db2.gz	SNHFPAWKWRIAKE-NSHDSACASA-N	-2	3	369.355	0.911	20	5		FCBDHL
O=C([O-])Cc1ccc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])cc1	ZINC000759167101	602308890	/nfs/dbraw/zinc/30/88/90/602308890.db2.gz	DPNXQDVZBGGQLY-UHFFFAOYSA-N	-2	3	352.328	0.922	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]c2n[nH]cc2-c2nnn[n-]2)cc1C	ZINC000826272601	608307230	/nfs/dbraw/zinc/30/72/30/608307230.db2.gz	RSXYGNVKCBLEEZ-UHFFFAOYSA-N	-2	3	364.347	0.916	20	5		FCBDHL
O=C([O-])[C@H]1CC(=O)N(C2CCN(c3cc[n-]c(=O)c3[N+](=O)[O-])CC2)C1	ZINC001594897614	954581772	/nfs/dbraw/zinc/58/17/72/954581772.db2.gz	AJKOHQKMABVXCB-VIFPVBQESA-N	-2	3	350.331	0.597	20	5		FCBDHL
COC(=O)C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000294583971	214254738	/nfs/dbraw/zinc/25/47/38/214254738.db2.gz	WQGDIBDBBDCSPM-MRVPVSSYSA-N	-2	3	350.280	0.029	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](CCC(=O)[O-])C(=O)[O-]	ZINC000264466337	209888577	/nfs/dbraw/zinc/88/85/77/209888577.db2.gz	HZIWOOKUPVZUQJ-QMMMGPOBSA-N	-3	3	362.316	0.200	20	5		FCBDHL
C[C@](CO)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)CC(=O)[O-]	ZINC000275636258	212064484	/nfs/dbraw/zinc/06/44/84/212064484.db2.gz	MQLGRTLQTJMNBL-GFCCVEGCSA-N	-2	3	350.324	0.486	20	5		FCBDHL
CC(C)(CC(=O)[O-])[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000569879230	491200560	/nfs/dbraw/zinc/20/05/60/491200560.db2.gz	FFMCMSHRQVRIDU-UHFFFAOYSA-N	-2	3	360.344	0.898	20	5		FCBDHL
C[C@]1(C(=O)[O-])CCN(C(=O)C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000263435030	488611749	/nfs/dbraw/zinc/61/17/49/488611749.db2.gz	OHYYQTKDCABLQA-AWEZNQCLSA-N	-2	3	371.371	0.196	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](Cc2c[nH]cn2)C(=O)[O-])c1C	ZINC000274883361	488740683	/nfs/dbraw/zinc/74/06/83/488740683.db2.gz	DIMZWIZHUFQGHZ-LLVKDONJSA-N	-2	3	368.371	0.909	20	5		FCBDHL
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H](C(=O)[O-])[C@H](C)O)cc1[N+](=O)[O-]	ZINC000274924929	488744447	/nfs/dbraw/zinc/74/44/47/488744447.db2.gz	NRMBEMGOMOYTMW-WKEGUHRASA-N	-2	3	352.752	0.669	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](CC(=O)[O-])C(=O)[O-])cc1C	ZINC000275063506	488758092	/nfs/dbraw/zinc/75/80/92/488758092.db2.gz	ZHQRKIYDIUYEQG-VIFPVBQESA-N	-3	3	360.344	0.665	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@H](CCO)C(=O)[O-])c1	ZINC000275132612	488764750	/nfs/dbraw/zinc/76/47/50/488764750.db2.gz	VRAMATRSCIXWKC-ZETCQYMHSA-N	-2	3	352.752	0.671	20	5		FCBDHL
CCOC[C@H]([N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000290714859	489159784	/nfs/dbraw/zinc/15/97/84/489159784.db2.gz	UJCMIFAOORFUQZ-VIFPVBQESA-N	-2	3	366.323	0.511	20	5		FCBDHL
COC[C@H]([N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000555374906	491248444	/nfs/dbraw/zinc/24/84/44/491248444.db2.gz	OFLSCTISXQZZHM-QMMMGPOBSA-N	-2	3	352.296	0.120	20	5		FCBDHL
O=C([O-])CC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000298862270	489375321	/nfs/dbraw/zinc/37/53/21/489375321.db2.gz	PSQWVFPCCCIHNH-QMMMGPOBSA-N	-3	3	350.280	0.330	20	5		FCBDHL
COC(=O)C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000298875868	489376453	/nfs/dbraw/zinc/37/64/53/489376453.db2.gz	WQGDIBDBBDCSPM-QMMMGPOBSA-N	-2	3	350.280	0.029	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCCN2CCCC2=O)c1	ZINC000414316547	489495492	/nfs/dbraw/zinc/49/54/92/489495492.db2.gz	IHKRGFOABSTJEY-UHFFFAOYSA-N	-2	3	371.371	0.584	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@@H](C[C@H]2CCOC2)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000547874344	490372197	/nfs/dbraw/zinc/37/21/97/490372197.db2.gz	ZKUVDRNQTVUFFG-KOLCDFICSA-N	-2	3	374.371	0.762	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@H]2CCOC2)c1C	ZINC000547876262	490373631	/nfs/dbraw/zinc/37/36/31/490373631.db2.gz	YOUGNKLTOFSJDX-CMPLNLGQSA-N	-2	3	358.372	0.980	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-]C[C@@](C)(CC(=O)[O-])C(=O)[O-])cc1[N+](=O)[O-]	ZINC000548261282	490452859	/nfs/dbraw/zinc/45/28/59/490452859.db2.gz	MEWPFWKKEXPRGQ-LLVKDONJSA-N	-3	3	366.373	0.809	20	5		FCBDHL
C[C@]1(C[C@@H]2CCCN2C(=O)c2cc([O-])ccc2[N+](=O)[O-])NC(=O)[N-]C1=O	ZINC000557608913	491386615	/nfs/dbraw/zinc/38/66/15/491386615.db2.gz	KFUVSGVHQOLDFB-XXFAHNHDSA-N	-2	3	362.342	0.893	20	5		FCBDHL
C[C@]1(C[C@H]2CCCN2C(=O)c2cc([O-])cc([N+](=O)[O-])c2)NC(=O)[N-]C1=O	ZINC000557608885	491387005	/nfs/dbraw/zinc/38/70/05/491387005.db2.gz	JEZZCRZWPQHHNG-QLJPJBMISA-N	-2	3	362.342	0.893	20	5		FCBDHL
C[C@@H](CS(C)(=O)=O)[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000566013634	491412698	/nfs/dbraw/zinc/41/26/98/491412698.db2.gz	VYCAUQNFUIOSEH-ZETCQYMHSA-N	-2	3	366.373	0.004	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@]2(CC(=O)[O-])CCOC2)c([N+](=O)[O-])c1	ZINC000574312060	491488550	/nfs/dbraw/zinc/48/85/50/491488550.db2.gz	GOGKIBQHDPDXTF-ZDUSSCGKSA-N	-2	3	360.344	0.516	20	5		FCBDHL
CC(C)(C)[C@H]([N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-])C(N)=O	ZINC000575050354	491536027	/nfs/dbraw/zinc/53/60/27/491536027.db2.gz	HUHBHIZGUBMYRC-SNVBAGLBSA-N	-2	3	359.360	0.471	20	5		FCBDHL
O=C([O-])[C@@H](CCO)[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000569088810	491632391	/nfs/dbraw/zinc/63/23/91/491632391.db2.gz	SJVHCITXVFNCEW-SSDOTTSWSA-N	-2	3	372.277	0.728	20	5		FCBDHL
CCN(C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])[C@@H](C)C(=O)[O-]	ZINC000595999458	491971178	/nfs/dbraw/zinc/97/11/78/491971178.db2.gz	ATTPYCMHMKGRIK-VIFPVBQESA-N	-2	3	359.360	0.195	20	5		FCBDHL
COc1c(F)cc(S(=O)(=O)[N-]C[C@H](OC)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000616330066	492126180	/nfs/dbraw/zinc/12/61/80/492126180.db2.gz	HBCMUOGWTGBQCW-VIFPVBQESA-N	-2	3	352.296	0.120	20	5		FCBDHL
CCC[C@H](O)[C@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC)C(=O)[O-]	ZINC000619470675	492264210	/nfs/dbraw/zinc/26/42/10/492264210.db2.gz	BEYKZIBWVCACKB-ONGXEEELSA-N	-2	3	362.360	0.496	20	5		FCBDHL
COCc1nc(C[N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])n[n-]1	ZINC000594829001	547015021	/nfs/dbraw/zinc/01/50/21/547015021.db2.gz	ZZRKQPAZYWKVMU-UHFFFAOYSA-N	-2	3	357.348	0.346	20	5		FCBDHL
CC(=O)C[C@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000787934362	668815877	/nfs/dbraw/zinc/81/58/77/668815877.db2.gz	NJTIOLAYNJQARB-QMMMGPOBSA-N	-2	3	350.736	0.959	20	5		FCBDHL
Cc1[nH]nc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2C)c1-c1nnn[n-]1	ZINC000826322323	669489951	/nfs/dbraw/zinc/48/99/51/669489951.db2.gz	HXVAHCDKQFCULA-UHFFFAOYSA-N	-2	3	364.347	0.916	20	5		FCBDHL
CC(C)(CCC(=O)[N-]S(=O)(=O)c1ccccc1-c1nnn[n-]1)[N+](=O)[O-]	ZINC001589272418	1282825034	/nfs/dbraw/zinc/82/50/34/1282825034.db2.gz	LOMXDIARNIXCOA-UHFFFAOYSA-N	-2	3	368.375	0.507	20	5		FCBDHL
CC(C)(CCC(=O)[N-]S(=O)(=O)c1ccccc1-c1nn[n-]n1)[N+](=O)[O-]	ZINC001589272418	1282825040	/nfs/dbraw/zinc/82/50/40/1282825040.db2.gz	LOMXDIARNIXCOA-UHFFFAOYSA-N	-2	3	368.375	0.507	20	5		FCBDHL
CCCCC(=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC001590573479	1283614213	/nfs/dbraw/zinc/61/42/13/1283614213.db2.gz	SFFBFWSPXOCYHI-UHFFFAOYSA-N	-2	3	354.348	0.770	20	5		FCBDHL
Cc1cc(S(=O)(=O)[N-][C@]2(CC(=O)[O-])CCOC2)c([N+](=O)[O-])s1	ZINC001600297637	1286471487	/nfs/dbraw/zinc/47/14/87/1286471487.db2.gz	UQARUFMKRJWXMA-NSHDSACASA-N	-2	3	350.374	0.877	20	5		FCBDHL
O=C([O-])[C@H](CC1OCCO1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC001601646763	1286799470	/nfs/dbraw/zinc/79/94/70/1286799470.db2.gz	XOZXGJPZQNAHMW-VIFPVBQESA-N	-2	3	364.307	0.228	20	5		FCBDHL
O=[N+]([O-])c1cnc([N-]c2cnn(-c3ncccc3-c3nnn[n-]3)c2)nc1	ZINC001607085692	1288653733	/nfs/dbraw/zinc/65/37/33/1288653733.db2.gz	KDDVFKZOCBPQAZ-UHFFFAOYSA-N	-2	3	351.290	0.889	20	5		FCBDHL
O=[N+]([O-])c1cnc([N-]c2cnn(-c3ncccc3-c3nn[n-]n3)c2)nc1	ZINC001607085692	1288653739	/nfs/dbraw/zinc/65/37/39/1288653739.db2.gz	KDDVFKZOCBPQAZ-UHFFFAOYSA-N	-2	3	351.290	0.889	20	5		FCBDHL
COC(=O)C[C@@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000294332120	214239511	/nfs/dbraw/zinc/23/95/11/214239511.db2.gz	JHPALUFSQIFXOM-SECBINFHSA-N	-2	3	360.344	0.506	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H](CC(=O)[O-])C(=O)[O-])c1[N+](=O)[O-]	ZINC000277352488	212352816	/nfs/dbraw/zinc/35/28/16/212352816.db2.gz	XONXNYGCAFBWEO-SECBINFHSA-N	-3	3	360.344	0.665	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@](C)(CO)CC(=O)[O-])cc1C	ZINC000275749768	212083479	/nfs/dbraw/zinc/08/34/79/212083479.db2.gz	QRGCIDDUHFAGGH-AWEZNQCLSA-N	-2	3	360.388	0.963	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@](C)(CO)CC(=O)[O-])c1C	ZINC000275669099	212070449	/nfs/dbraw/zinc/07/04/49/212070449.db2.gz	PPKKFZUQWALKAQ-CQSZACIVSA-N	-2	3	360.388	0.963	20	5		FCBDHL
O=C([O-])C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000317193637	488897964	/nfs/dbraw/zinc/89/79/64/488897964.db2.gz	KNLZHNYKGVVMTH-ZETCQYMHSA-N	-3	3	352.708	0.454	20	5		FCBDHL
NC(=O)COc1ccc([N-]S(=O)(=O)c2ccc([O-])c([N+](=O)[O-])c2)cc1	ZINC000028256534	487708468	/nfs/dbraw/zinc/70/84/68/487708468.db2.gz	FUVJHZBWLZRSBZ-UHFFFAOYSA-N	-2	3	367.339	0.965	20	5		FCBDHL
CC(C)[C@@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)[O-]	ZINC000261628484	488527798	/nfs/dbraw/zinc/52/77/98/488527798.db2.gz	DJGJFLKGZRWKMU-GFCCVEGCSA-N	-2	3	360.344	0.754	20	5		FCBDHL
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H](CC(N)=O)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000274878370	488739966	/nfs/dbraw/zinc/73/99/66/488739966.db2.gz	CCGHSBWIARFZRJ-SSDOTTSWSA-N	-2	3	365.751	0.164	20	5		FCBDHL
C[C@@H](C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)CC(=O)[O-]	ZINC000274946840	488746835	/nfs/dbraw/zinc/74/68/35/488746835.db2.gz	FWJOSKFKXUHAQJ-MRVPVSSYSA-N	-2	3	360.344	0.755	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1C=C[C@H](C(=O)[O-])C1	ZINC000274952606	488747395	/nfs/dbraw/zinc/74/73/95/488747395.db2.gz	GOCFDZJNKCBWIV-IUCAKERBSA-N	-2	3	370.339	0.689	20	5		FCBDHL
O=C([O-])C1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCOCC1	ZINC000275059810	488757674	/nfs/dbraw/zinc/75/76/74/488757674.db2.gz	YPMVBXGTQVDPLZ-UHFFFAOYSA-N	-2	3	362.335	0.894	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C(C)(C)CC(=O)[O-]	ZINC000555575943	491257095	/nfs/dbraw/zinc/25/70/95/491257095.db2.gz	PTESZHLEBVGWMZ-UHFFFAOYSA-N	-2	3	360.344	0.913	20	5		FCBDHL
C[C@@H](Cn1cncn1)[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000414319970	489496220	/nfs/dbraw/zinc/49/62/20/489496220.db2.gz	OQCPJPZELGCJAF-QMMMGPOBSA-N	-2	3	355.332	0.252	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C(=O)[O-])[C@@H]1CCOC1	ZINC000547877977	490373694	/nfs/dbraw/zinc/37/36/94/490373694.db2.gz	TVHYQWQSLZQYSU-PELKAZGASA-N	-2	3	360.344	0.371	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@@H]1CCOC1	ZINC000547877978	490374084	/nfs/dbraw/zinc/37/40/84/490374084.db2.gz	TVHYQWQSLZQYSU-PRHODGIISA-N	-2	3	360.344	0.371	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](Cc2cnn(C)c2)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000547895296	490379661	/nfs/dbraw/zinc/37/96/61/490379661.db2.gz	RTIPJBGZMQAETA-VIFPVBQESA-N	-2	3	374.400	0.672	20	5		FCBDHL
O=C([O-])[C@@H](O)C[N-]S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1	ZINC000547897095	490380898	/nfs/dbraw/zinc/38/08/98/490380898.db2.gz	RZLUAMKMDKCXHN-QMMMGPOBSA-N	-2	3	369.149	0.081	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-]C[C@@](C)(CO)CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000548355780	490470986	/nfs/dbraw/zinc/47/09/86/490470986.db2.gz	IRWBCOXQWHUEEE-NSHDSACASA-N	-2	3	352.390	0.716	20	5		FCBDHL
C[C@H](CO[C@@H]1CCOC1)[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000566316579	491435512	/nfs/dbraw/zinc/43/55/12/491435512.db2.gz	FOZOZMYFFMJZEX-MWLCHTKSSA-N	-2	3	374.371	0.765	20	5		FCBDHL
O=C([O-])c1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCCO[C@H]2CCOC2)c1	ZINC000566316900	491435612	/nfs/dbraw/zinc/43/56/12/491435612.db2.gz	SJGPHVRTAMSNHD-NSHDSACASA-N	-2	3	374.371	0.767	20	5		FCBDHL
CCOC(=O)[C@H](C)C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000573689309	491448643	/nfs/dbraw/zinc/44/86/43/491448643.db2.gz	PULXSCRNEHHVRM-MRVPVSSYSA-N	-2	3	360.344	0.771	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)[C@H](C)C(=O)[O-]	ZINC000576240492	491596654	/nfs/dbraw/zinc/59/66/54/491596654.db2.gz	QRSWNAAAUDKWFN-YUMQZZPRSA-N	-2	3	360.344	0.769	20	5		FCBDHL
CCOC(=O)[C@H](C)C[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000577284752	491609783	/nfs/dbraw/zinc/60/97/83/491609783.db2.gz	GSRKOQYHORNJSN-MRVPVSSYSA-N	-2	3	360.344	0.771	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]CCOCC(F)F)c1[N+](=O)[O-]	ZINC000578240653	491673101	/nfs/dbraw/zinc/67/31/01/491673101.db2.gz	BQQFEWUMPWDTNJ-UHFFFAOYSA-N	-2	3	354.287	0.853	20	5		FCBDHL
NC(=O)[C@@H]([N-]S(=O)(=O)c1ccc([O-])c([N+](=O)[O-])c1)c1ccccc1	ZINC000590763044	491785883	/nfs/dbraw/zinc/78/58/83/491785883.db2.gz	LLOFNMGZFLPTRD-ZDUSSCGKSA-N	-2	3	351.340	0.805	20	5		FCBDHL
CO[C@H]1COCC[C@H]1C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000582305039	491806707	/nfs/dbraw/zinc/80/67/07/491806707.db2.gz	LHNIORHPVNHIIB-JQWIXIFHSA-N	-2	3	374.371	0.623	20	5		FCBDHL
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]C1(C(=O)[O-])CCOCC1	ZINC000619709001	492276527	/nfs/dbraw/zinc/27/65/27/492276527.db2.gz	NAYNDJPWJFWAMD-UHFFFAOYSA-N	-2	3	360.344	0.516	20	5		FCBDHL
CC1(C(=O)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC001590069451	1283199637	/nfs/dbraw/zinc/19/96/37/1283199637.db2.gz	ZYRVAHGVJVSTEQ-UHFFFAOYSA-N	-2	3	352.332	0.380	20	5		FCBDHL
O=C([N-]CC1CN(c2cccc(-c3nnn[n-]3)c2[N+](=O)[O-])C1)C(F)(F)F	ZINC001593046395	1285938159	/nfs/dbraw/zinc/93/81/59/1285938159.db2.gz	WYSQZQGMTSRMLB-UHFFFAOYSA-N	-2	3	371.279	0.890	20	5		FCBDHL
O=C([O-])[C@@H]1CN(c2cc(-c3nnn[n-]3)c3cc([N+](=O)[O-])ccc3n2)CCO1	ZINC001606961521	1288576399	/nfs/dbraw/zinc/57/63/99/1288576399.db2.gz	UCXZWWNGKLMETI-LBPRGKRZSA-N	-2	3	371.313	0.613	20	5		FCBDHL
O=C([O-])[C@@H]1CN(c2cc(-c3nn[n-]n3)c3cc([N+](=O)[O-])ccc3n2)CCO1	ZINC001606961521	1288576400	/nfs/dbraw/zinc/57/64/00/1288576400.db2.gz	UCXZWWNGKLMETI-LBPRGKRZSA-N	-2	3	371.313	0.613	20	5		FCBDHL
CN(CC[N-]S(=O)(=O)c1cc(Cl)c(F)cc1[N+](=O)[O-])CC(=O)[O-]	ZINC001610118232	1289381545	/nfs/dbraw/zinc/38/15/45/1289381545.db2.gz	CKDUOVKXWLGTPT-UHFFFAOYSA-N	-2	3	369.758	0.682	20	5		FCBDHL
COC[C@](C)([N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC001599154914	998356558	/nfs/dbraw/zinc/35/65/58/998356558.db2.gz	AABHMOQISQNTBB-LBPRGKRZSA-N	-2	3	350.324	0.810	20	5		FCBDHL
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1ncccc1[O-]	ZINC000480730296	250279674	/nfs/dbraw/zinc/27/96/74/250279674.db2.gz	PEGSXVFNSMPSEX-UHFFFAOYSA-N	-2	3	367.339	0.961	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@]1(C(=O)[O-])CCSC1	ZINC000321558220	488901552	/nfs/dbraw/zinc/90/15/52/488901552.db2.gz	MITMTWOIOHJODV-GFCCVEGCSA-N	-2	3	362.385	0.842	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@@H](Cc2c[nH]cn2)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000327319163	488919037	/nfs/dbraw/zinc/91/90/37/488919037.db2.gz	ZDPUIYOIFTYOCY-JTQLQIEISA-N	-2	3	370.343	0.301	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@H](Cc2c[nH]cn2)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000327319164	488919272	/nfs/dbraw/zinc/91/92/72/488919272.db2.gz	ZDPUIYOIFTYOCY-SNVBAGLBSA-N	-2	3	370.343	0.301	20	5		FCBDHL
O=C([O-])CCCC[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000274872042	488739131	/nfs/dbraw/zinc/73/91/31/488739131.db2.gz	AVSQBUMBULSICB-UHFFFAOYSA-N	-2	3	360.344	0.899	20	5		FCBDHL
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@H](C)O)cc1[N+](=O)[O-]	ZINC000274924927	488744451	/nfs/dbraw/zinc/74/44/51/488744451.db2.gz	NRMBEMGOMOYTMW-QUBYGPBYSA-N	-2	3	352.752	0.669	20	5		FCBDHL
O=C([O-])[C@H]1C=C[C@@H]([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000274916517	488743203	/nfs/dbraw/zinc/74/32/03/488743203.db2.gz	AAZBFTJAOODYCC-DTWKUNHWSA-N	-2	3	370.339	0.674	20	5		FCBDHL
C[C@@H](CCC(=O)[O-])[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000274945401	488746549	/nfs/dbraw/zinc/74/65/49/488746549.db2.gz	FQVDMPPQANJYAJ-QMMMGPOBSA-N	-2	3	360.344	0.898	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H](CC(=O)[O-])C(=O)[O-])c1	ZINC000274949264	488747034	/nfs/dbraw/zinc/74/70/34/488747034.db2.gz	SJQRYUAJCIPHJU-ZCFIWIBFSA-N	-3	3	366.735	0.763	20	5		FCBDHL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCC(=O)NCC(=O)[O-])cc1C	ZINC000278233023	488806512	/nfs/dbraw/zinc/80/65/12/488806512.db2.gz	KOTJJKBVDAPEGC-UHFFFAOYSA-N	-2	3	359.360	0.081	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@@H](CCC(=O)[O-])C(=O)[O-])c([N+](=O)[O-])c1	ZINC000298062299	489284364	/nfs/dbraw/zinc/28/43/64/489284364.db2.gz	BCAPKBBIGDRBAE-QMMMGPOBSA-N	-3	3	362.316	0.200	20	5		FCBDHL
C[C@]1(C[C@@H]2CCCN2C(=O)c2cccc([O-])c2[N+](=O)[O-])NC(=O)[N-]C1=O	ZINC000286275576	489375650	/nfs/dbraw/zinc/37/56/50/489375650.db2.gz	QTMAKZLDYWKMKA-XXFAHNHDSA-N	-2	3	362.342	0.893	20	5		FCBDHL
CC(C)(C)[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-])C(N)=O	ZINC000414312526	489495651	/nfs/dbraw/zinc/49/56/51/489495651.db2.gz	ANXYLIUZOSGUIO-JTQLQIEISA-N	-2	3	359.360	0.471	20	5		FCBDHL
COC(=O)Cc1nnc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)[n-]1	ZINC000460529396	489871099	/nfs/dbraw/zinc/87/10/99/489871099.db2.gz	FMHXVIFIZUJYGP-UHFFFAOYSA-N	-2	3	371.331	0.238	20	5		FCBDHL
COC(=O)Cc1nc([N-]S(=O)(=O)CCc2ccccc2[N+](=O)[O-])n[n-]1	ZINC000460535305	489871801	/nfs/dbraw/zinc/87/18/01/489871801.db2.gz	UYQBBJFERNRHOG-UHFFFAOYSA-N	-2	3	369.359	0.413	20	5		FCBDHL
Cc1nc(S(=O)(=O)[N-]CC(=O)Nc2ccc([O-])c([N+](=O)[O-])c2)cn1C	ZINC000483434574	490317486	/nfs/dbraw/zinc/31/74/86/490317486.db2.gz	DRYRWVHGIRJWFC-UHFFFAOYSA-N	-2	3	369.359	0.259	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@H](Cc2c[nH]cn2)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000547871293	490371242	/nfs/dbraw/zinc/37/12/42/490371242.db2.gz	QLZQHKVBJIFQNB-MRVPVSSYSA-N	-2	3	360.373	0.662	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-][C@@H](C[C@@H]2CCOC2)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000547874346	490372797	/nfs/dbraw/zinc/37/27/97/490372797.db2.gz	ZKUVDRNQTVUFFG-ONGXEEELSA-N	-2	3	374.371	0.762	20	5		FCBDHL
O=C([O-])[C@@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br	ZINC000548218145	490443124	/nfs/dbraw/zinc/44/31/24/490443124.db2.gz	VIMQYYUNYJGNFX-ZETCQYMHSA-N	-2	3	369.149	0.081	20	5		FCBDHL
O=C([O-])COCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000548261638	490452547	/nfs/dbraw/zinc/45/25/47/490452547.db2.gz	HNQLRZVTLKSOCK-UHFFFAOYSA-N	-2	3	372.277	0.993	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@H](C(=O)[O-])c2cnn(C)c2)cc1[N+](=O)[O-]	ZINC000548530862	490496436	/nfs/dbraw/zinc/49/64/36/490496436.db2.gz	VSWBCEDYWHHRCN-JTQLQIEISA-N	-2	3	360.373	0.802	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C[C@H]1CCOC1)C(=O)[O-]	ZINC000548531907	490497847	/nfs/dbraw/zinc/49/78/47/490497847.db2.gz	WEKUOWHLLVIHMO-MWLCHTKSSA-N	-2	3	374.371	0.762	20	5		FCBDHL
CCC[C@@H](O)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000548560115	490506660	/nfs/dbraw/zinc/50/66/60/490506660.db2.gz	QNRYDPYUFPQUQP-MWLCHTKSSA-N	-2	3	350.324	0.626	20	5		FCBDHL
C[C@]1(C[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2[N+](=O)[O-])CCC(=O)N1	ZINC000516573656	490868894	/nfs/dbraw/zinc/86/88/94/490868894.db2.gz	BSDXEVDKHGDCIJ-CYBMUJFWSA-N	-2	3	357.344	0.240	20	5		FCBDHL
Cc1c([C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C(=O)[O-])cnn1C	ZINC000530435971	490905921	/nfs/dbraw/zinc/90/59/21/490905921.db2.gz	KITWPSSTMFZCGL-LBPRGKRZSA-N	-2	3	372.334	0.880	20	5		FCBDHL
COC(=O)CCCC[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000566317200	491435374	/nfs/dbraw/zinc/43/53/74/491435374.db2.gz	GQEZNGCUCCIDAM-UHFFFAOYSA-N	-2	3	360.344	0.915	20	5		FCBDHL
O=C([O-])c1cn(CCCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])nn1	ZINC000574858522	491524304	/nfs/dbraw/zinc/52/43/04/491524304.db2.gz	UECNGVGNHUULPI-UHFFFAOYSA-N	-2	3	369.359	0.643	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C(=O)[O-])[C@@H]1CCCOC1	ZINC000577722066	491645831	/nfs/dbraw/zinc/64/58/31/491645831.db2.gz	FSNCENLVWYNCDN-RNCFNFMXSA-N	-2	3	374.371	0.762	20	5		FCBDHL
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@]1(CC(=O)[O-])CCOC1	ZINC000591745332	546939879	/nfs/dbraw/zinc/93/98/79/546939879.db2.gz	RWUSAYQRMVLJOE-CYBMUJFWSA-N	-2	3	360.344	0.516	20	5		FCBDHL
CC[C@H](C[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-])C(=O)OC	ZINC000593312612	546965898	/nfs/dbraw/zinc/96/58/98/546965898.db2.gz	YYLJCZNLXULRRL-MRVPVSSYSA-N	-2	3	360.344	0.771	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccc(-c2nnn[n-]2)[nH]1	ZINC000826450408	607776943	/nfs/dbraw/zinc/77/69/43/607776943.db2.gz	KXWPGILEEGJDPZ-UHFFFAOYSA-N	-2	3	363.315	0.222	20	5		FCBDHL
O=C([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccc(-c2nn[n-]n2)[nH]1	ZINC000826450408	607776944	/nfs/dbraw/zinc/77/69/44/607776944.db2.gz	KXWPGILEEGJDPZ-UHFFFAOYSA-N	-2	3	363.315	0.222	20	5		FCBDHL
O=c1[n-]c([C@H]2CCCN(c3cc(-c4nnn[n-]4)ccc3[N+](=O)[O-])C2)n[nH]1	ZINC001593497394	1286180612	/nfs/dbraw/zinc/18/06/12/1286180612.db2.gz	BAIDHGCXKCBTEH-VIFPVBQESA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=c1[n-]c([C@H]2CCCN(c3cc(-c4nn[n-]n4)ccc3[N+](=O)[O-])C2)n[nH]1	ZINC001593497394	1286180618	/nfs/dbraw/zinc/18/06/18/1286180618.db2.gz	BAIDHGCXKCBTEH-VIFPVBQESA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=c1[n-]c([C@@H]2CCCN(c3ccc(-c4nnn[n-]4)c([N+](=O)[O-])c3)C2)n[nH]1	ZINC001593497747	1286181051	/nfs/dbraw/zinc/18/10/51/1286181051.db2.gz	KWMRUXJVSYSHMZ-MRVPVSSYSA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=c1[n-]c([C@@H]2CCCN(c3ccc(-c4nn[n-]n4)c([N+](=O)[O-])c3)C2)n[nH]1	ZINC001593497747	1286181055	/nfs/dbraw/zinc/18/10/55/1286181055.db2.gz	KWMRUXJVSYSHMZ-MRVPVSSYSA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=C([O-])[C@H]1CN(c2cc(-c3nnn[n-]3)c3cc([N+](=O)[O-])ccc3n2)CCO1	ZINC001606961520	1288576478	/nfs/dbraw/zinc/57/64/78/1288576478.db2.gz	UCXZWWNGKLMETI-GFCCVEGCSA-N	-2	3	371.313	0.613	20	5		FCBDHL
O=C([O-])[C@H]1CN(c2cc(-c3nn[n-]n3)c3cc([N+](=O)[O-])ccc3n2)CCO1	ZINC001606961520	1288576479	/nfs/dbraw/zinc/57/64/79/1288576479.db2.gz	UCXZWWNGKLMETI-GFCCVEGCSA-N	-2	3	371.313	0.613	20	5		FCBDHL
O=[N+]([O-])c1c([O-])cc([O-])cc1OC[C@H]1COCCOCCOCCO1	ZINC001228973179	857241847	/nfs/dbraw/zinc/24/18/47/857241847.db2.gz	HMOMWLCBUZDBJX-GFCCVEGCSA-N	-2	3	359.331	0.833	20	5		FCBDHL
O=C([O-])CN1CCC([N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC001343003720	958014442	/nfs/dbraw/zinc/01/44/42/958014442.db2.gz	ANINWLSOHOMBLE-UHFFFAOYSA-N	-2	3	361.351	0.561	20	5		FCBDHL
COC[C@@](C)([N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC001599154913	998356598	/nfs/dbraw/zinc/35/65/98/998356598.db2.gz	AABHMOQISQNTBB-GFCCVEGCSA-N	-2	3	350.324	0.810	20	5		FCBDHL
O=C([O-])CCCNC(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000414627677	245307642	/nfs/dbraw/zinc/30/76/42/245307642.db2.gz	LZECCJCNQMRQRF-UHFFFAOYSA-N	-2	3	374.375	0.037	20	5		FCBDHL
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](Cc1c[nH]cn1)C(=O)[O-]	ZINC000325110931	488908745	/nfs/dbraw/zinc/90/87/45/488908745.db2.gz	FFQMWQNBTGAQAX-JTQLQIEISA-N	-2	3	354.344	0.601	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C(=O)[O-])c1cnn(C)c1	ZINC000327165677	488918520	/nfs/dbraw/zinc/91/85/20/488918520.db2.gz	TWCVQYSUNCCJDE-LBPRGKRZSA-N	-2	3	370.343	0.441	20	5		FCBDHL
C[C@]1(C[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c([O-])c2)NC(=O)[N-]C1=O	ZINC000288017591	488933086	/nfs/dbraw/zinc/93/30/86/488933086.db2.gz	WJJLNEFSHYQJJX-MGPLVRAMSA-N	-2	3	362.342	0.893	20	5		FCBDHL
Cc1ccc(C)c(S(=O)(=O)[N-]Cc2cn(CC(=O)[O-])nn2)c1[N+](=O)[O-]	ZINC000569987450	491208260	/nfs/dbraw/zinc/20/82/60/491208260.db2.gz	DKIWJQIFAIBHIO-UHFFFAOYSA-N	-2	3	369.359	0.366	20	5		FCBDHL
O=C([O-])[C@@H]1CCCN(C(=O)C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000263226829	488606654	/nfs/dbraw/zinc/60/66/54/488606654.db2.gz	AMORFPJBYGFBJI-SNVBAGLBSA-N	-2	3	371.371	0.196	20	5		FCBDHL
C[C@](O)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(=O)[O-]	ZINC000263499087	488613535	/nfs/dbraw/zinc/61/35/35/488613535.db2.gz	SESOVILSJXNNSB-JTQLQIEISA-N	-2	3	372.277	0.728	20	5		FCBDHL
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1C=C[C@@H](C(=O)[O-])C1	ZINC000274952608	488747411	/nfs/dbraw/zinc/74/74/11/488747411.db2.gz	GOCFDZJNKCBWIV-RKDXNWHRSA-N	-2	3	370.339	0.689	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CCC(=O)[O-])C(=O)[O-])c1C	ZINC000275151324	488766823	/nfs/dbraw/zinc/76/68/23/488766823.db2.gz	YQBRLFWZQNAFOV-VIFPVBQESA-N	-3	3	360.344	0.808	20	5		FCBDHL
Cc1cc(Cl)c(S(=O)(=O)[N-]CCc2nc(=O)o[n-]2)cc1[N+](=O)[O-]	ZINC000290109353	489114962	/nfs/dbraw/zinc/11/49/62/489114962.db2.gz	JLXFSVLCCZJXRX-UHFFFAOYSA-N	-2	3	362.751	0.754	20	5		FCBDHL
COc1c(F)cc(S(=O)(=O)[N-][C@]2(C(=O)[O-])CCOC2)cc1[N+](=O)[O-]	ZINC000370141164	489319851	/nfs/dbraw/zinc/31/98/51/489319851.db2.gz	QNMFREYNDVNDAR-GFCCVEGCSA-N	-2	3	364.307	0.265	20	5		FCBDHL
COC(=O)Cc1nnc([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)[n-]1	ZINC000414462861	489500032	/nfs/dbraw/zinc/50/00/32/489500032.db2.gz	ZHWPHJWYYXIQOZ-UHFFFAOYSA-N	-2	3	369.359	0.846	20	5		FCBDHL
CN(CCCC(=O)[O-])C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000455761850	489599653	/nfs/dbraw/zinc/59/96/53/489599653.db2.gz	ZICLQACKFBCSEL-UHFFFAOYSA-N	-2	3	359.360	0.196	20	5		FCBDHL
Cc1cnn(C[C@H]([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C(=O)[O-])c1	ZINC000547875399	490372289	/nfs/dbraw/zinc/37/22/89/490372289.db2.gz	GWGUIWRSQALDOE-NSHDSACASA-N	-2	3	368.371	0.840	20	5		FCBDHL
Cc1cc(=O)n2[n-]c([N-]S(=O)(=O)c3c(C)cccc3[N+](=O)[O-])nc2n1	ZINC000484427967	490425269	/nfs/dbraw/zinc/42/52/69/490425269.db2.gz	UDBRDMOAGDLPBG-UHFFFAOYSA-N	-2	3	364.343	0.743	20	5		FCBDHL
Cc1ccc(S(=O)(=O)[N-][C@@H](Cc2cnn(C)c2)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000548223796	490444747	/nfs/dbraw/zinc/44/47/47/490444747.db2.gz	KPDFVILQRDDKOV-NSHDSACASA-N	-2	3	368.371	0.611	20	5		FCBDHL
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CCC(N)=O)C(=O)[O-])c1C	ZINC000548243801	490448409	/nfs/dbraw/zinc/44/84/09/490448409.db2.gz	VWDPUXVIZCDKFD-VIFPVBQESA-N	-2	3	359.360	0.209	20	5		FCBDHL
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C[C@H]1CCOC1)C(=O)[O-]	ZINC000548531906	490497638	/nfs/dbraw/zinc/49/76/38/490497638.db2.gz	WEKUOWHLLVIHMO-KOLCDFICSA-N	-2	3	374.371	0.762	20	5		FCBDHL
CCC[C@H](O)[C@@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000548593236	490514357	/nfs/dbraw/zinc/51/43/57/490514357.db2.gz	ZBXIAXRRJGBOFQ-CMPLNLGQSA-N	-2	3	362.360	0.496	20	5		FCBDHL
Cc1sc(S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@@H]2CCOC2)cc1[N+](=O)[O-]	ZINC000574974891	491531320	/nfs/dbraw/zinc/53/13/20/491531320.db2.gz	FHJCTPMNIJMUAS-GMSGAONNSA-N	-2	3	350.374	0.733	20	5		FCBDHL
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C(=O)[O-])[C@@H]1CCCOC1	ZINC000569232264	491644282	/nfs/dbraw/zinc/64/42/82/491644282.db2.gz	QXTAENHELGWRSO-RNCFNFMXSA-N	-2	3	374.371	0.762	20	5		FCBDHL
O=C([O-])c1cccc(S(=O)(=O)[N-]C2CCS(=O)CC2)c1[N+](=O)[O-]	ZINC000579844794	491706828	/nfs/dbraw/zinc/70/68/28/491706828.db2.gz	MWZJWNAZCBMIBD-UHFFFAOYSA-N	-2	3	362.385	0.482	20	5		FCBDHL
C[S@](=O)CCC[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000580332829	491726625	/nfs/dbraw/zinc/72/66/25/491726625.db2.gz	FNNXIGSQVCSILF-NRFANRHFSA-N	-2	3	350.374	0.340	20	5		FCBDHL
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2[N+](=O)[O-])[C@@H]1OC	ZINC000580571374	491736784	/nfs/dbraw/zinc/73/67/84/491736784.db2.gz	HREQHAYUBBFFLR-CWSCBRNRSA-N	-2	3	374.371	0.764	20	5		FCBDHL
CO[C@@H]1COCC[C@@H]1C[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000582305041	491806694	/nfs/dbraw/zinc/80/66/94/491806694.db2.gz	LHNIORHPVNHIIB-ZYHUDNBSSA-N	-2	3	374.371	0.623	20	5		FCBDHL
C[S@@](=O)CCC[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000583325573	491842485	/nfs/dbraw/zinc/84/24/85/491842485.db2.gz	RAHBDODNLWOSRL-OAQYLSRUSA-N	-2	3	350.374	0.340	20	5		FCBDHL
O=C([O-])[C@H](O)C[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000583641921	491849203	/nfs/dbraw/zinc/84/92/03/491849203.db2.gz	IMJIBHDRQJLFOQ-SSDOTTSWSA-N	-2	3	358.250	0.337	20	5		FCBDHL
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](CC(F)F)C(=O)[O-]	ZINC000619470322	492264227	/nfs/dbraw/zinc/26/42/27/492264227.db2.gz	IRQSFWWHUYXSDE-LURJTMIESA-N	-2	3	354.287	0.990	20	5		FCBDHL
O=C([O-])CCCCC(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000594461422	546998712	/nfs/dbraw/zinc/99/87/12/546998712.db2.gz	BCZIWKRXYXBHCN-UHFFFAOYSA-N	-2	3	373.387	0.634	20	5		FCBDHL
Cc1cc(S(=O)(=O)[N-]c2nn(C)cc2-c2nnn[n-]2)ccc1[N+](=O)[O-]	ZINC000822211938	606711250	/nfs/dbraw/zinc/71/12/50/606711250.db2.gz	UPQNXJKYROQNFL-UHFFFAOYSA-N	-2	3	364.347	0.618	20	5		FCBDHL
Cc1ccc(S(=O)(=O)[N-]c2nn(C)cc2-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000822266756	606711395	/nfs/dbraw/zinc/71/13/95/606711395.db2.gz	HGQIIHGXWRHTNM-UHFFFAOYSA-N	-2	3	364.347	0.618	20	5		FCBDHL
O=C(NCCNc1ccc(-c2nnn[n-]2)cn1)c1cccc([N+](=O)[O-])c1[O-]	ZINC000823201584	607193860	/nfs/dbraw/zinc/19/38/60/607193860.db2.gz	KGHNYJXJPWSKAH-UHFFFAOYSA-N	-2	3	370.329	0.717	20	5		FCBDHL
O=C(NCCNc1ccc(-c2nn[n-]n2)cn1)c1cccc([N+](=O)[O-])c1[O-]	ZINC000823201584	607193861	/nfs/dbraw/zinc/19/38/61/607193861.db2.gz	KGHNYJXJPWSKAH-UHFFFAOYSA-N	-2	3	370.329	0.717	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-]c2n[nH]cc2-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000826211415	608305686	/nfs/dbraw/zinc/30/56/86/608305686.db2.gz	BUKOBNMBGAJNTL-UHFFFAOYSA-N	-2	3	366.319	0.307	20	5		FCBDHL
COc1ccc(S(=O)(=O)[N-]c2n[nH]cc2-c2nnn[n-]2)c([N+](=O)[O-])c1	ZINC000826211430	608307151	/nfs/dbraw/zinc/30/71/51/608307151.db2.gz	COYNXMGFUBKFOW-UHFFFAOYSA-N	-2	3	366.319	0.307	20	5		FCBDHL
O=C([O-])[C@@H](Cc1c[nH]cn1)[N-]S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000776437825	668261667	/nfs/dbraw/zinc/26/16/67/668261667.db2.gz	MWFSQNHANGEDHC-SECBINFHSA-N	-2	3	374.762	0.946	20	5		FCBDHL
O=C([O-])[C@@H](Cc1cnc[nH]1)[N-]S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000776437825	668261672	/nfs/dbraw/zinc/26/16/72/668261672.db2.gz	MWFSQNHANGEDHC-SECBINFHSA-N	-2	3	374.762	0.946	20	5		FCBDHL
CCn1nc(C)c(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(=O)[O-])n1	ZINC000829706699	669719732	/nfs/dbraw/zinc/71/97/32/669719732.db2.gz	KHGKBPOBOXBADG-UHFFFAOYSA-N	-2	3	369.359	0.691	20	5		FCBDHL
Cc1cc(S(=O)(=O)[N-]C[C@@H](C(=O)[O-])[C@H]2CCOC2)c([N+](=O)[O-])s1	ZINC001600298768	1286473086	/nfs/dbraw/zinc/47/30/86/1286473086.db2.gz	BLXLTFOAYFYLHY-DTWKUNHWSA-N	-2	3	364.401	0.980	20	5		FCBDHL
O=c1[n-]c(C2CCN(c3ccc(-c4nnn[n-]4)c([N+](=O)[O-])c3)CC2)n[nH]1	ZINC001609605363	1289260612	/nfs/dbraw/zinc/26/06/12/1289260612.db2.gz	XHGCNZCIWREFLW-UHFFFAOYSA-N	-2	3	357.334	0.983	20	5		FCBDHL
O=c1[n-]c(C2CCN(c3ccc(-c4nn[n-]n4)c([N+](=O)[O-])c3)CC2)n[nH]1	ZINC001609605363	1289260617	/nfs/dbraw/zinc/26/06/17/1289260617.db2.gz	XHGCNZCIWREFLW-UHFFFAOYSA-N	-2	3	357.334	0.983	20	5		FCBDHL