smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCC(CC)([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(N)=O	ZINC000101923169	282143547	/nfs/dbraw/zinc/14/35/47/282143547.db2.gz	XRLHBTZNJGJXKV-UHFFFAOYSA-N	-1	3	343.405	1.534	20	5		EDBDHM
O=c1[n-]nc(Cn2cc(Br)c(=O)c([N+](=O)[O-])c2)s1	ZINC000558456354	306238255	/nfs/dbraw/zinc/23/82/55/306238255.db2.gz	JZPXPIVHVBFYBX-UHFFFAOYSA-N	-1	3	333.123	1.124	20	5		EDBDHM
Cc1nn(C)c(C)c1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000173978560	231088217	/nfs/dbraw/zinc/08/82/17/231088217.db2.gz	IHBFZHGXRINYRZ-UHFFFAOYSA-N	-1	3	330.391	1.485	20	5		EDBDHM
CN1C[C@@H]([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCC1=O	ZINC000160079702	529821587	/nfs/dbraw/zinc/82/15/87/529821587.db2.gz	OZYNRULZDMQUBU-VIFPVBQESA-N	-1	3	347.780	1.147	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@H](CO)c1ccccc1	ZINC000125425581	138333719	/nfs/dbraw/zinc/33/37/19/138333719.db2.gz	KMRIMZALJMEIJQ-CYBMUJFWSA-N	-1	3	336.369	1.649	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](CO)C1CCCC1	ZINC000289459207	201338155	/nfs/dbraw/zinc/33/81/55/201338155.db2.gz	GTAZBRBBUUFOOY-LBPRGKRZSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)CCCCO	ZINC000295843180	201350596	/nfs/dbraw/zinc/35/05/96/201350596.db2.gz	WMGQTXVORWTHFL-SNVBAGLBSA-N	-1	3	332.378	1.433	20	5		EDBDHM
CCN1CCCC[C@@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000111352686	220143353	/nfs/dbraw/zinc/14/33/53/220143353.db2.gz	XNRYYFBQGLUXHP-SNVBAGLBSA-N	-1	3	333.435	1.809	20	5		EDBDHM
Cc1cc(N2CCO[C@@H](CN(C)CC(=O)[O-])C2)c(F)cc1[N+](=O)[O-]	ZINC000416403375	251067742	/nfs/dbraw/zinc/06/77/42/251067742.db2.gz	NJJPCFPUYJPCCN-NSHDSACASA-N	-1	3	341.339	1.264	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCOC[C@H]2C)cc1C	ZINC000277947956	273237142	/nfs/dbraw/zinc/23/71/42/273237142.db2.gz	RINCLOGAPSADDU-VXGBXAGGSA-N	-1	3	328.390	1.915	20	5		EDBDHM
CCCn1c(=O)[n-]nc1S(=O)(=O)Cc1cccc([N+](=O)[O-])c1C	ZINC000424201770	252159774	/nfs/dbraw/zinc/15/97/74/252159774.db2.gz	HJSSQQCNSDCBIE-UHFFFAOYSA-N	-1	3	340.361	1.584	20	5		EDBDHM
CSC[C@@H](CCO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000443257126	254573686	/nfs/dbraw/zinc/57/36/86/254573686.db2.gz	ZQNRNYIXKXPLRZ-MRVPVSSYSA-N	-1	3	338.382	1.126	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1occc1C	ZINC000490335762	255084748	/nfs/dbraw/zinc/08/47/48/255084748.db2.gz	HOAZSFRVADWQTH-UHFFFAOYSA-N	-1	3	326.330	1.983	20	5		EDBDHM
CCNC(=O)[C@@H](C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl	ZINC000267674327	139652158	/nfs/dbraw/zinc/65/21/58/139652158.db2.gz	OWIQNSQRFKNYIN-MRVPVSSYSA-N	-1	3	349.796	1.360	20	5		EDBDHM
CCOC(=O)C[C@@H](C)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000270553584	140122722	/nfs/dbraw/zinc/12/27/22/140122722.db2.gz	NBCRFIALKACWQT-SNVBAGLBSA-N	-1	3	330.362	1.462	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@H](O)C(F)(F)F)cc([N+](=O)[O-])c1F	ZINC000271368506	140286112	/nfs/dbraw/zinc/28/61/12/140286112.db2.gz	DDPZBACWJCCUNL-MRVPVSSYSA-N	-1	3	346.258	1.244	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C[C@H]2CCCN2C)cc1[N+](=O)[O-]	ZINC000271687070	140333825	/nfs/dbraw/zinc/33/38/25/140333825.db2.gz	DNXVLKPAHVQUSY-SNVBAGLBSA-N	-1	3	347.824	1.929	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCc2cn(C)cn2)cc1[N+](=O)[O-]	ZINC000416535999	304330177	/nfs/dbraw/zinc/33/01/77/304330177.db2.gz	OGNGDIZSJQTNJK-UHFFFAOYSA-N	-1	3	330.391	1.219	20	5		EDBDHM
CC[C@@](C)([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000352868825	149196504	/nfs/dbraw/zinc/19/65/04/149196504.db2.gz	DZOZWKHXPULBEH-CYBMUJFWSA-N	-1	3	330.362	1.356	20	5		EDBDHM
CCO[C@H]1COCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000352979665	149237892	/nfs/dbraw/zinc/23/78/92/149237892.db2.gz	FKXQUZAELURZCW-NEPJUHHUSA-N	-1	3	348.352	1.206	20	5		EDBDHM
CCN1CC[C@@H]2OCCN(C(=O)c3cc([O-])ccc3[N+](=O)[O-])[C@H]2C1	ZINC000355387163	150246973	/nfs/dbraw/zinc/24/69/73/150246973.db2.gz	SMBMJVROGNPGCH-GJZGRUSLSA-N	-1	3	335.360	1.236	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H](CO)CC2CCC2)cc1[N+](=O)[O-]	ZINC000360362119	152007566	/nfs/dbraw/zinc/00/75/66/152007566.db2.gz	OEXMCSHYWWQKSY-JTQLQIEISA-N	-1	3	334.419	1.794	20	5		EDBDHM
Cn1ccnc1[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1)C1CC1	ZINC000352303288	162106410	/nfs/dbraw/zinc/10/64/10/162106410.db2.gz	QZXMWSNEDBFRFD-LLVKDONJSA-N	-1	3	342.402	1.819	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](CO)C2CC2)cc1C	ZINC000352559075	162253500	/nfs/dbraw/zinc/25/35/00/162253500.db2.gz	GIHBYOXGISFSNA-LBPRGKRZSA-N	-1	3	328.390	1.508	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H]1CCc2nccn2C1	ZINC000275351128	268327962	/nfs/dbraw/zinc/32/79/62/268327962.db2.gz	UCHOAXUKYNFRSI-NSHDSACASA-N	-1	3	336.373	1.332	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H](C)CCCO)cc1[N+](=O)[O-]	ZINC000275091813	273100232	/nfs/dbraw/zinc/10/02/32/273100232.db2.gz	QVMZOCVTIXDWQB-QMMMGPOBSA-N	-1	3	336.341	1.182	20	5		EDBDHM
COCC[C@@H](C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC	ZINC000276207011	273152591	/nfs/dbraw/zinc/15/25/91/273152591.db2.gz	KRALULZPSRHTCD-SECBINFHSA-N	-1	3	346.361	1.085	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H]2CCOC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000285565491	274581308	/nfs/dbraw/zinc/58/13/08/274581308.db2.gz	JWUHNOOTHPVLFR-WDEREUQCSA-N	-1	3	344.389	1.554	20	5		EDBDHM
O=C([N-]c1nncs1)c1cccc([N+](=O)[O-])c1N1CCOCC1	ZINC000182968389	280069393	/nfs/dbraw/zinc/06/93/93/280069393.db2.gz	HIQKSYBNEBFQSP-UHFFFAOYSA-N	-1	3	335.345	1.535	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1C[C@H]2OCCC[C@@H]12	ZINC000249764648	302049471	/nfs/dbraw/zinc/04/94/71/302049471.db2.gz	ICWPCTRIAONJEE-DMDPSCGWSA-N	-1	3	326.374	1.749	20	5		EDBDHM
O=C(Nc1cccc(N2CCC2=O)c1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000448534195	447328725	/nfs/dbraw/zinc/32/87/25/447328725.db2.gz	DRXJGUOYRLMZTH-UHFFFAOYSA-N	-1	3	328.284	1.684	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H]1[C@@H]2CCO[C@@H]2C12CCC2	ZINC000155770027	304810444	/nfs/dbraw/zinc/81/04/44/304810444.db2.gz	HRUSONYNQNQSGK-BPNCWPANSA-N	-1	3	338.385	1.831	20	5		EDBDHM
COC(=O)[C@@H]([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)C(C)C	ZINC000443682571	305240976	/nfs/dbraw/zinc/24/09/76/305240976.db2.gz	HEIMTPGUPDRQGR-LBPRGKRZSA-N	-1	3	330.362	1.212	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])n[nH]1	ZINC000451598842	305355602	/nfs/dbraw/zinc/35/56/02/305355602.db2.gz	PIHSSMBKDVVCBM-UHFFFAOYSA-N	-1	3	345.768	1.407	20	5		EDBDHM
CC[C@@](C)(C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])OC	ZINC000451803577	305369980	/nfs/dbraw/zinc/36/99/80/305369980.db2.gz	RDILEOJPCJTDAG-ZDUSSCGKSA-N	-1	3	332.378	1.697	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC1(CF)CCOCC1	ZINC000451817936	305370931	/nfs/dbraw/zinc/37/09/31/305370931.db2.gz	URWGFJDLYAAKLN-UHFFFAOYSA-N	-1	3	346.380	1.948	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2COCC2(C)C)cc1C	ZINC000451964869	305374803	/nfs/dbraw/zinc/37/48/03/305374803.db2.gz	JYJAXNWMSWERHN-CYBMUJFWSA-N	-1	3	328.390	1.915	20	5		EDBDHM
O=C(Cc1cncc([O-])c1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000553327493	306184317	/nfs/dbraw/zinc/18/43/17/306184317.db2.gz	BPNUDNXFCURZBL-UHFFFAOYSA-N	-1	3	342.355	1.587	20	5		EDBDHM
COC(=O)c1sc2[n-]c(Cn3cnc([N+](=O)[O-])c3)nc(=O)c2c1C	ZINC000026122782	441367533	/nfs/dbraw/zinc/36/75/33/441367533.db2.gz	MGJUWDFEHBWOGH-UHFFFAOYSA-N	-1	3	349.328	1.233	20	5		EDBDHM
C[C@H]1Oc2ccc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)cc2NC1=O	ZINC000029770786	441472825	/nfs/dbraw/zinc/47/28/25/441472825.db2.gz	UDDFRTYHSRAEEH-SSDOTTSWSA-N	-1	3	344.283	1.255	20	5		EDBDHM
CN1CCC[C@@H](C[N-]S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1	ZINC000108406159	441450807	/nfs/dbraw/zinc/45/08/07/441450807.db2.gz	VQHGQEIPADGPDA-JTQLQIEISA-N	-1	3	347.824	1.868	20	5		EDBDHM
Cn1cc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cn1	ZINC000053699654	441537236	/nfs/dbraw/zinc/53/72/36/441537236.db2.gz	BCHCHYGCLQHZQC-UHFFFAOYSA-N	-1	3	330.753	1.460	20	5		EDBDHM
COCCOCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000067879664	441692444	/nfs/dbraw/zinc/69/24/44/441692444.db2.gz	QSUFEWWMAVVCKX-UHFFFAOYSA-N	-1	3	338.769	1.190	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCCn2ccnc2)cc1C	ZINC000126234112	442090471	/nfs/dbraw/zinc/09/04/71/442090471.db2.gz	QLYFFZCVRAFMSU-UHFFFAOYSA-N	-1	3	338.389	1.777	20	5		EDBDHM
CC(C)C[C@@H](CN(C)C)[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000180880171	442666886	/nfs/dbraw/zinc/66/68/86/442666886.db2.gz	RXRAOQLBLLFKBM-NSHDSACASA-N	-1	3	347.412	1.989	20	5		EDBDHM
C[C@@H](CN1CCCCC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000188213165	442725171	/nfs/dbraw/zinc/72/51/71/442725171.db2.gz	OBLNTTPNYVHZOI-JTQLQIEISA-N	-1	3	333.435	1.809	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H]2C[C@@H](O)C2(C)C)cc1[N+](=O)[O-]	ZINC000188115776	442713335	/nfs/dbraw/zinc/71/33/35/442713335.db2.gz	BJXRHYRDWXTGJL-NWDGAFQWSA-N	-1	3	348.808	1.994	20	5		EDBDHM
C[C@H](CO[C@@H]1CCOC1)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000267888274	442778698	/nfs/dbraw/zinc/77/86/98/442778698.db2.gz	QVVDQXUERNQDHW-GHMZBOCLSA-N	-1	3	330.362	1.067	20	5		EDBDHM
Cc1cnc(C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])s1	ZINC000184587462	318536271	/nfs/dbraw/zinc/53/62/71/318536271.db2.gz	UHKFBFYKKBZJFW-UHFFFAOYSA-N	-1	3	327.387	1.979	20	5		EDBDHM
CCN1CCN([C@H](C)CNC(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC1	ZINC000183612898	442946217	/nfs/dbraw/zinc/94/62/17/442946217.db2.gz	SOUZRHCVZLPLHS-GFCCVEGCSA-N	-1	3	336.392	1.056	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2C(=O)NCC[C@@H]2C)c1C	ZINC000195477114	443022995	/nfs/dbraw/zinc/02/29/95/443022995.db2.gz	QNYIHRBJSGQENO-CABZTGNLSA-N	-1	3	341.389	1.015	20	5		EDBDHM
CCN1CCN([C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3[O-])C2)CC1	ZINC000185532162	443215523	/nfs/dbraw/zinc/21/55/23/443215523.db2.gz	IBOJPBUUIVJAGB-CQSZACIVSA-N	-1	3	348.403	1.152	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCOCC1CC1	ZINC000264431444	443289261	/nfs/dbraw/zinc/28/92/61/443289261.db2.gz	AHCFTMYDNZNZAA-UHFFFAOYSA-N	-1	3	330.362	1.308	20	5		EDBDHM
CC(C)OC(=O)[C@@H](C)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000266839421	443263450	/nfs/dbraw/zinc/26/34/50/443263450.db2.gz	LPASCINNUUMYBK-JTQLQIEISA-N	-1	3	330.362	1.461	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCCSC2)c([N+](=O)[O-])c1	ZINC000267163362	443363233	/nfs/dbraw/zinc/36/32/33/443363233.db2.gz	GLIDSNQSRPUWTJ-SECBINFHSA-N	-1	3	332.403	1.777	20	5		EDBDHM
CC[C@@H](NC(=O)CC[C@@H]1NC(=O)[N-]C1=O)c1cccc([N+](=O)[O-])c1	ZINC000267254344	443394682	/nfs/dbraw/zinc/39/46/82/443394682.db2.gz	DULKDCCHMXQNGC-NEPJUHHUSA-N	-1	3	334.332	1.150	20	5		EDBDHM
Cc1c(C(=O)[N-]N2CCCNC2=O)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-]	ZINC000273019943	443520494	/nfs/dbraw/zinc/52/04/94/443520494.db2.gz	CCVMNIJCVDSOJR-UHFFFAOYSA-N	-1	3	337.292	1.180	20	5		EDBDHM
O=C(C[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)OCC1CC1	ZINC000272404277	443614796	/nfs/dbraw/zinc/61/47/96/443614796.db2.gz	AZVVYZXOOSFVAP-UHFFFAOYSA-N	-1	3	328.271	1.756	20	5		EDBDHM
CC1(C)CCC[C@@]1(O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000292935795	443882582	/nfs/dbraw/zinc/88/25/82/443882582.db2.gz	ZMIJXWUADCPZJY-CQSZACIVSA-N	-1	3	328.390	1.814	20	5		EDBDHM
CN1CCN(CCNC(=O)c2ccc([N+](=O)[O-])cc2[O-])CC1(C)C	ZINC000281641992	443967142	/nfs/dbraw/zinc/96/71/42/443967142.db2.gz	ASPPFZNHGLMDKC-UHFFFAOYSA-N	-1	3	336.392	1.056	20	5		EDBDHM
CCn1cc(C[N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])cn1	ZINC000285482021	444001570	/nfs/dbraw/zinc/00/15/70/444001570.db2.gz	CVEABIHMSFDREP-UHFFFAOYSA-N	-1	3	338.389	1.907	20	5		EDBDHM
CCN1CCN([C@H](C)CNc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1	ZINC000565039037	321165372	/nfs/dbraw/zinc/16/53/72/321165372.db2.gz	ZUZMTJWFYXCTOD-GFCCVEGCSA-N	-1	3	336.392	1.731	20	5		EDBDHM
CC(=O)c1cccc(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)c1[O-]	ZINC000570072686	321336593	/nfs/dbraw/zinc/33/65/93/321336593.db2.gz	DCFMCSDNCSAMKM-UHFFFAOYSA-N	-1	3	331.284	1.303	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C(C)(C)C(C)(C)O	ZINC000318713264	444320505	/nfs/dbraw/zinc/32/05/05/444320505.db2.gz	QSEZPEKORJMTBM-UHFFFAOYSA-N	-1	3	332.378	1.431	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCCC[C@H]2CO)c(F)c1	ZINC000318925770	444321767	/nfs/dbraw/zinc/32/17/67/444321767.db2.gz	ORHDQTPGDKOHPG-JOYOIKCWSA-N	-1	3	332.353	1.563	20	5		EDBDHM
COC(=O)C[C@H](C)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000580777797	322094689	/nfs/dbraw/zinc/09/46/89/322094689.db2.gz	JCKTXFSHJHVDPH-VIFPVBQESA-N	-1	3	330.362	1.442	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCO[C@@H]2C2CC2)cc1[N+](=O)[O-]	ZINC000342546968	444739863	/nfs/dbraw/zinc/73/98/63/444739863.db2.gz	GCUDRTTXVVNOCJ-BXKDBHETSA-N	-1	3	332.403	1.811	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1CCO[C@H]1c1cccnc1	ZINC000343211002	445139773	/nfs/dbraw/zinc/13/97/73/445139773.db2.gz	VZZXPLATWSVWLV-DOMZBBRYSA-N	-1	3	349.368	1.798	20	5		EDBDHM
CNc1c(C(=O)Nc2cc(-c3nccn3C)[n-]n2)cccc1[N+](=O)[O-]	ZINC000361324487	445759878	/nfs/dbraw/zinc/75/98/78/445759878.db2.gz	OEFCJTOTBLYJCD-UHFFFAOYSA-N	-1	3	341.331	2.012	20	5		EDBDHM
CNc1c(C(=O)Nc2cc(-c3nccn3C)n[n-]2)cccc1[N+](=O)[O-]	ZINC000361324487	445759884	/nfs/dbraw/zinc/75/98/84/445759884.db2.gz	OEFCJTOTBLYJCD-UHFFFAOYSA-N	-1	3	341.331	2.012	20	5		EDBDHM
CC1CCN(C[C@@H](O)CNC(=O)c2cc([O-])cc([N+](=O)[O-])c2)CC1	ZINC000356554313	445856827	/nfs/dbraw/zinc/85/68/27/445856827.db2.gz	UZCUZONUKZIUIA-HNNXBMFYSA-N	-1	3	337.376	1.123	20	5		EDBDHM
COc1c(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)c(C)nn1C	ZINC000359209839	446039248	/nfs/dbraw/zinc/03/92/48/446039248.db2.gz	MBTOPNPFKNTFGV-UHFFFAOYSA-N	-1	3	340.361	1.124	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2cnc3n2CCCC3)s1	ZINC000375102705	446581307	/nfs/dbraw/zinc/58/13/07/446581307.db2.gz	BSYUHSRIWKXUBZ-UHFFFAOYSA-N	-1	3	342.402	1.668	20	5		EDBDHM
O=C(NC1CCN([C@H]2CCOC2)CC1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000376827574	446741626	/nfs/dbraw/zinc/74/16/26/446741626.db2.gz	JGGVJNYIBHYOPB-ZDUSSCGKSA-N	-1	3	335.360	1.284	20	5		EDBDHM
COCC(COC)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000451892775	447775184	/nfs/dbraw/zinc/77/51/84/447775184.db2.gz	WLIIQZBHRLALEZ-UHFFFAOYSA-N	-1	3	332.378	1.151	20	5		EDBDHM
O=C([O-])Cc1ccc(NC[C@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000578445592	448547380	/nfs/dbraw/zinc/54/73/80/448547380.db2.gz	JERXJDRWQIZRTA-CYBMUJFWSA-N	-1	3	337.376	1.481	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)COCC1CC1	ZINC000593654366	449132405	/nfs/dbraw/zinc/13/24/05/449132405.db2.gz	WPEAKTFZDFERNT-SNVBAGLBSA-N	-1	3	344.389	1.697	20	5		EDBDHM
O=C([O-])c1ccc([N+](=O)[O-])c(N2CCC(CN3CCOCC3)CC2)c1	ZINC000592969405	449090272	/nfs/dbraw/zinc/09/02/72/449090272.db2.gz	JMEQVCWYCFKISM-UHFFFAOYSA-N	-1	3	349.387	1.842	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)N1CCC[C@H](C)C1	ZINC000593532127	449329171	/nfs/dbraw/zinc/32/91/71/449329171.db2.gz	WSTZWGOCWHXTGP-RYUDHWBXSA-N	-1	3	342.421	1.389	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2nc(CC(=O)OC)cs2)n1	ZINC000617371147	449580586	/nfs/dbraw/zinc/58/05/86/449580586.db2.gz	RVYNCBHBLOCJTF-UHFFFAOYSA-N	-1	3	339.333	1.236	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-])[C@H](C)O	ZINC000594779001	449690183	/nfs/dbraw/zinc/69/01/83/449690183.db2.gz	HAPDUJIVFCODKJ-ONGXEEELSA-N	-1	3	339.373	1.581	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2C[C@@H](O)C23CCC3)cc1C	ZINC000594866973	449782604	/nfs/dbraw/zinc/78/26/04/449782604.db2.gz	ZYXTUDQDMZJTMY-UONOGXRCSA-N	-1	3	340.401	1.793	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2CO[C@@H](C3CC3)C2)c([N+](=O)[O-])s1	ZINC000601473121	449996967	/nfs/dbraw/zinc/99/69/67/449996967.db2.gz	AEWJEKZCOUDIER-VHSXEESVSA-N	-1	3	332.403	1.811	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-]C[C@H]1C[C@@H](O)C1	ZINC000599479807	450007080	/nfs/dbraw/zinc/00/70/80/450007080.db2.gz	JOGGIRWZKUWDRF-AOOOYVTPSA-N	-1	3	337.357	1.192	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H](C)c2nccn2C)cc1[N+](=O)[O-]	ZINC000595382402	450096945	/nfs/dbraw/zinc/09/69/45/450096945.db2.gz	HHMAXALELULCKF-ZETCQYMHSA-N	-1	3	330.391	1.738	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-]CCOCCF	ZINC000595407271	450119285	/nfs/dbraw/zinc/11/92/85/450119285.db2.gz	FTTYHAKDIMJOHL-UHFFFAOYSA-N	-1	3	343.336	1.407	20	5		EDBDHM
Cc1ccc([C@@H](C)NC(=O)CC[C@@H]2NC(=O)[N-]C2=O)cc1[N+](=O)[O-]	ZINC000610599270	450270683	/nfs/dbraw/zinc/27/06/83/450270683.db2.gz	GIHAYXSCCOPOFY-KOLCDFICSA-N	-1	3	334.332	1.069	20	5		EDBDHM
CCc1nc([C@H](C)[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])n[nH]1	ZINC000270546627	536153744	/nfs/dbraw/zinc/15/37/44/536153744.db2.gz	DYPRFHSNRWIYDE-QMMMGPOBSA-N	-1	3	325.350	1.315	20	5		EDBDHM
CCc1nnc([C@H](C)[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])[nH]1	ZINC000270546627	536153747	/nfs/dbraw/zinc/15/37/47/536153747.db2.gz	DYPRFHSNRWIYDE-QMMMGPOBSA-N	-1	3	325.350	1.315	20	5		EDBDHM
O=C([O-])N1CCCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000740356497	579335389	/nfs/dbraw/zinc/33/53/89/579335389.db2.gz	CTRISGKLTBOMJO-UHFFFAOYSA-N	-1	3	336.348	1.609	20	5		EDBDHM
O=C(Nc1cccc(-n2cc[nH]c2=O)c1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000729525446	578580220	/nfs/dbraw/zinc/58/02/20/578580220.db2.gz	PDAUSBAJSZZKJM-UHFFFAOYSA-N	-1	3	341.283	1.839	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)c2ccc[nH]2)c([N+](=O)[O-])c1	ZINC000760402940	580029995	/nfs/dbraw/zinc/02/99/95/580029995.db2.gz	GSSLLFBFZMZFLX-VIFPVBQESA-N	-1	3	325.346	1.971	20	5		EDBDHM
O=C(OCc1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)C(=O)[N-]C2=O	ZINC000732339265	578706326	/nfs/dbraw/zinc/70/63/26/578706326.db2.gz	LMDOAARVZUPZDC-UHFFFAOYSA-N	-1	3	344.254	1.975	20	5		EDBDHM
CCN(CC)C(=O)CCCNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000736524912	578995228	/nfs/dbraw/zinc/99/52/28/578995228.db2.gz	XGPBXHULWJWALC-UHFFFAOYSA-N	-1	3	348.367	1.230	20	5		EDBDHM
CCN(CC)C(=O)CCCNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000736524912	578995229	/nfs/dbraw/zinc/99/52/29/578995229.db2.gz	XGPBXHULWJWALC-UHFFFAOYSA-N	-1	3	348.367	1.230	20	5		EDBDHM
COc1ccc(CC(=O)OCc2cc(=O)c([O-])co2)cc1[N+](=O)[O-]	ZINC000736816026	579023591	/nfs/dbraw/zinc/02/35/91/579023591.db2.gz	DKUHICHPGPFBFC-UHFFFAOYSA-N	-1	3	335.268	1.548	20	5		EDBDHM
Cn1cc([C@H]2CCCN2c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)cn1	ZINC000737606992	579119182	/nfs/dbraw/zinc/11/91/82/579119182.db2.gz	VJPXKBPBBKKLQH-CYBMUJFWSA-N	-1	3	340.347	1.850	20	5		EDBDHM
Cn1cc([C@H]2CCCN2c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)cn1	ZINC000737606992	579119183	/nfs/dbraw/zinc/11/91/83/579119183.db2.gz	VJPXKBPBBKKLQH-CYBMUJFWSA-N	-1	3	340.347	1.850	20	5		EDBDHM
O=C(OCc1c(F)cccc1[N+](=O)[O-])c1ccc(-c2nnn[n-]2)cn1	ZINC000738236681	579175975	/nfs/dbraw/zinc/17/59/75/579175975.db2.gz	PDZGAUHVPLTECW-UHFFFAOYSA-N	-1	3	344.262	1.666	20	5		EDBDHM
O=C(OCc1c(F)cccc1[N+](=O)[O-])c1ccc(-c2nn[n-]n2)cn1	ZINC000738236681	579175977	/nfs/dbraw/zinc/17/59/77/579175977.db2.gz	PDZGAUHVPLTECW-UHFFFAOYSA-N	-1	3	344.262	1.666	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@@H](C)OC(=O)c2cccc([N+](=O)[O-])c2N)on1	ZINC000758955725	579995256	/nfs/dbraw/zinc/99/52/56/579995256.db2.gz	FXMORYSLINAWTG-MRVPVSSYSA-N	-1	3	334.288	1.657	20	5		EDBDHM
COc1ccc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])cc1C	ZINC000759168636	580000058	/nfs/dbraw/zinc/00/00/58/580000058.db2.gz	QNZOVSPWFIVFSC-UHFFFAOYSA-N	-1	3	338.345	1.612	20	5		EDBDHM
CN(CC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)CC(F)(F)F	ZINC000768830089	580221555	/nfs/dbraw/zinc/22/15/55/580221555.db2.gz	ATQCPUIDRJGDQA-UHFFFAOYSA-N	-1	3	347.340	1.429	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]c2ccc(=O)[nH]n2)cc1[N+](=O)[O-]	ZINC000800044859	581041312	/nfs/dbraw/zinc/04/13/12/581041312.db2.gz	UJRIAKRFOUIXFA-UHFFFAOYSA-N	-1	3	344.736	1.853	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]N=c2[nH]cccc2[N+](=O)[O-])c(Cl)n1	ZINC000800838151	581059320	/nfs/dbraw/zinc/05/93/20/581059320.db2.gz	USRXWPWLOWPUAD-UHFFFAOYSA-N	-1	3	343.752	1.652	20	5		EDBDHM
Cc1ccc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])c(Cl)n1	ZINC000800838151	581059321	/nfs/dbraw/zinc/05/93/21/581059321.db2.gz	USRXWPWLOWPUAD-UHFFFAOYSA-N	-1	3	343.752	1.652	20	5		EDBDHM
CC(C)(C)OC(=O)N[C@@H]1CCCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1	ZINC000204210507	591203532	/nfs/dbraw/zinc/20/35/32/591203532.db2.gz	XQLIYWZJIMUPBH-SNVBAGLBSA-N	-1	3	338.364	1.777	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]C[C@H]1CC[C@@H](C2CC2)O1	ZINC000907470682	592652233	/nfs/dbraw/zinc/65/22/33/592652233.db2.gz	SIGAATQOQLNUEA-HIFRSBDPSA-N	-1	3	340.401	1.972	20	5		EDBDHM
Cc1nc2n(c1C)CCN(c1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)C2	ZINC000737490775	593074364	/nfs/dbraw/zinc/07/43/64/593074364.db2.gz	WVHDBTDBEQASGP-UHFFFAOYSA-N	-1	3	341.335	1.003	20	5		EDBDHM
Cc1nc2n(c1C)CCN(c1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)C2	ZINC000737490775	593074365	/nfs/dbraw/zinc/07/43/65/593074365.db2.gz	WVHDBTDBEQASGP-UHFFFAOYSA-N	-1	3	341.335	1.003	20	5		EDBDHM
Cc1n[n-]nc1C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000805547232	593465682	/nfs/dbraw/zinc/46/56/82/593465682.db2.gz	WKCNRKKNCZNWLU-UHFFFAOYSA-N	-1	3	330.260	1.428	20	5		EDBDHM
C[C@H](CCCO)Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820243060	593802203	/nfs/dbraw/zinc/80/22/03/593802203.db2.gz	UUFDVDJPCCVLHF-SECBINFHSA-N	-1	3	343.347	1.896	20	5		EDBDHM
C[C@H](CCCO)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820243060	593802204	/nfs/dbraw/zinc/80/22/04/593802204.db2.gz	UUFDVDJPCCVLHF-SECBINFHSA-N	-1	3	343.347	1.896	20	5		EDBDHM
C[C@H](NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000820384343	593815022	/nfs/dbraw/zinc/81/50/22/593815022.db2.gz	BTMOQUQIMZVRRU-QMMMGPOBSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@H](NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000820384343	593815023	/nfs/dbraw/zinc/81/50/23/593815023.db2.gz	BTMOQUQIMZVRRU-QMMMGPOBSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)c1cccc(-c2nnn[n-]2)c1	ZINC000820397019	593816301	/nfs/dbraw/zinc/81/63/01/593816301.db2.gz	KKGJEVMUPYUCEH-QMMMGPOBSA-N	-1	3	328.288	1.859	20	5		EDBDHM
C[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)c1cccc(-c2nn[n-]n2)c1	ZINC000820397019	593816302	/nfs/dbraw/zinc/81/63/02/593816302.db2.gz	KKGJEVMUPYUCEH-QMMMGPOBSA-N	-1	3	328.288	1.859	20	5		EDBDHM
COC(=O)N1CCC(Nc2ccc(-c3nnn[n-]3)c([N+](=O)[O-])c2)CC1	ZINC000821665155	593903435	/nfs/dbraw/zinc/90/34/35/593903435.db2.gz	XWELZOGUQKLQIZ-UHFFFAOYSA-N	-1	3	347.335	1.418	20	5		EDBDHM
C[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)c1nnc2n1CCC2	ZINC000824657233	594051647	/nfs/dbraw/zinc/05/16/47/594051647.db2.gz	PZMKVSFRLXQUCM-QMMMGPOBSA-N	-1	3	341.335	1.486	20	5		EDBDHM
C[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)c1nnc2n1CCC2	ZINC000824657233	594051649	/nfs/dbraw/zinc/05/16/49/594051649.db2.gz	PZMKVSFRLXQUCM-QMMMGPOBSA-N	-1	3	341.335	1.486	20	5		EDBDHM
Cc1nn(Cc2ccc(Cl)cc2[N+](=O)[O-])c(N)c1-c1nnn[n-]1	ZINC000822500774	594058452	/nfs/dbraw/zinc/05/84/52/594058452.db2.gz	GHHCJTYYKVFFGD-UHFFFAOYSA-N	-1	3	334.727	1.564	20	5		EDBDHM
Cc1nn(Cc2ccc(Cl)cc2[N+](=O)[O-])c(N)c1-c1nn[n-]n1	ZINC000822500774	594058454	/nfs/dbraw/zinc/05/84/54/594058454.db2.gz	GHHCJTYYKVFFGD-UHFFFAOYSA-N	-1	3	334.727	1.564	20	5		EDBDHM
C[C@]1(CCCO)CCCN1c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000824816340	594078909	/nfs/dbraw/zinc/07/89/09/594078909.db2.gz	CLJWGMKFCNCYAQ-OAHLLOKOSA-N	-1	3	332.364	1.906	20	5		EDBDHM
C[C@]1(CCCO)CCCN1c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000824816340	594078911	/nfs/dbraw/zinc/07/89/11/594078911.db2.gz	CLJWGMKFCNCYAQ-OAHLLOKOSA-N	-1	3	332.364	1.906	20	5		EDBDHM
Cn1cnc2cc(Nc3nccc(-c4nnn[n-]4)c3[N+](=O)[O-])ccc21	ZINC000822699356	594087574	/nfs/dbraw/zinc/08/75/74/594087574.db2.gz	XSRPOYZYMCJPRU-UHFFFAOYSA-N	-1	3	337.303	1.800	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N[C@H]3CCCOC3)cc(-c3nnn[n-]3)c2c1	ZINC000823644627	594224397	/nfs/dbraw/zinc/22/43/97/594224397.db2.gz	JQGJNWNTPRYYOH-VIFPVBQESA-N	-1	3	341.331	1.914	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N[C@H]3CCCOC3)cc(-c3nn[n-]n3)c2c1	ZINC000823644627	594224398	/nfs/dbraw/zinc/22/43/98/594224398.db2.gz	JQGJNWNTPRYYOH-VIFPVBQESA-N	-1	3	341.331	1.914	20	5		EDBDHM
CC[C@@](C)(CC(=O)[O-])NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000828653257	594473135	/nfs/dbraw/zinc/47/31/35/594473135.db2.gz	XJQYGDXREKRXGJ-INIZCTEOSA-N	-1	3	335.360	1.717	20	5		EDBDHM
CC[C@@](C)(CC(=O)[O-])NCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000828658550	594474178	/nfs/dbraw/zinc/47/41/78/594474178.db2.gz	WJCCWNCOBMETRN-HNNXBMFYSA-N	-1	3	339.348	1.775	20	5		EDBDHM
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000829160252	594575834	/nfs/dbraw/zinc/57/58/34/594575834.db2.gz	GGZLWYKKMRFLHZ-ZIAGYGMSSA-N	-1	3	347.371	1.992	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl)[C@@H](C)O	ZINC000832308730	594741896	/nfs/dbraw/zinc/74/18/96/594741896.db2.gz	CTLCCEQBNOBASD-BDAKNGLRSA-N	-1	3	336.797	1.994	20	5		EDBDHM
CN1CCC[C@H]([N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000848581354	595408469	/nfs/dbraw/zinc/40/84/69/595408469.db2.gz	QHHWIWWPLZIXEL-JTQLQIEISA-N	-1	3	329.303	1.777	20	5		EDBDHM
CN1C[C@H]([N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)CCC1=O	ZINC000848584487	595409981	/nfs/dbraw/zinc/40/99/81/595409981.db2.gz	ZLLXZMSCCJLXGQ-SECBINFHSA-N	-1	3	343.286	1.303	20	5		EDBDHM
COC[C@@H](C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)OC	ZINC000848586052	595410180	/nfs/dbraw/zinc/41/01/80/595410180.db2.gz	GWZTZSMCPBRGEX-LLVKDONJSA-N	-1	3	334.275	1.344	20	5		EDBDHM
O=C([N-]CCN1CCCC1=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848593530	595412857	/nfs/dbraw/zinc/41/28/57/595412857.db2.gz	LQSDDJWUBNNRHH-UHFFFAOYSA-N	-1	3	343.286	1.305	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1COC2(CCC2)C1	ZINC000849449859	595532092	/nfs/dbraw/zinc/53/20/92/595532092.db2.gz	QUUVILYEESAGJZ-JTQLQIEISA-N	-1	3	342.373	1.593	20	5		EDBDHM
COC(=O)C1=CC[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000859285551	596032386	/nfs/dbraw/zinc/03/23/86/596032386.db2.gz	BUPPIVDEQLBSGT-JTQLQIEISA-N	-1	3	326.330	1.135	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@H](O)C2CCCCC2)cs1	ZINC000119812031	596743319	/nfs/dbraw/zinc/74/33/19/596743319.db2.gz	QLMYOFWGKDAQGJ-NSHDSACASA-N	-1	3	334.419	1.876	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@@H]2Cn2cncn2)c(-c2nnn[n-]2)c1	ZINC000738370936	598337981	/nfs/dbraw/zinc/33/79/81/598337981.db2.gz	SUSBVGHGVCODKO-LLVKDONJSA-N	-1	3	341.335	1.035	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@@H]2Cn2cncn2)c(-c2nn[n-]n2)c1	ZINC000738370936	598337986	/nfs/dbraw/zinc/33/79/86/598337986.db2.gz	SUSBVGHGVCODKO-LLVKDONJSA-N	-1	3	341.335	1.035	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOC[C@@H]2CCOC2)c(-c2nn[n-]n2)c1	ZINC000738371620	598594764	/nfs/dbraw/zinc/59/47/64/598594764.db2.gz	UQSJAEGVQKQZTJ-SNVBAGLBSA-N	-1	3	334.336	1.240	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOC[C@@H]2CCOC2)c(-c2nnn[n-]2)c1	ZINC000738371620	598594763	/nfs/dbraw/zinc/59/47/63/598594763.db2.gz	UQSJAEGVQKQZTJ-SNVBAGLBSA-N	-1	3	334.336	1.240	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@H](O)Cc1ccccc1	ZINC000070958369	138205238	/nfs/dbraw/zinc/20/52/38/138205238.db2.gz	NXVRGVQAPFGYSD-CYBMUJFWSA-N	-1	3	336.369	1.477	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CCC[C@]2(C)CO)cc1[N+](=O)[O-]	ZINC000124662321	138328814	/nfs/dbraw/zinc/32/88/14/138328814.db2.gz	JHJZFTKBFJZJGZ-CMPLNLGQSA-N	-1	3	334.419	1.794	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)c1nc[nH]n1	ZINC000185885382	138809936	/nfs/dbraw/zinc/80/99/36/138809936.db2.gz	LPWADPYXVBNZOU-QMMMGPOBSA-N	-1	3	348.344	1.301	20	5		EDBDHM
C[C@@H]1CCCN(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000055240974	201133440	/nfs/dbraw/zinc/13/34/40/201133440.db2.gz	PSYFEVWAKXPNEG-LLVKDONJSA-N	-1	3	345.396	1.744	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@H]1COC2(CCCC2)O1	ZINC000110477575	204312920	/nfs/dbraw/zinc/31/29/20/204312920.db2.gz	UDZKBNLTROAZAX-NSHDSACASA-N	-1	3	342.373	1.559	20	5		EDBDHM
CN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)[C@H]1c1ccccc1	ZINC000246000281	139092125	/nfs/dbraw/zinc/09/21/25/139092125.db2.gz	YCQKUUWEULTMGZ-LSDHHAIUSA-N	-1	3	342.355	1.871	20	5		EDBDHM
Cc1cc(=O)n(C)cc1[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000175966561	207178776	/nfs/dbraw/zinc/17/87/76/207178776.db2.gz	AZXRKDYANMFIRZ-UHFFFAOYSA-N	-1	3	337.357	1.711	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H]2CCCC(=O)N2)c1[N+](=O)[O-]	ZINC000433450967	254528776	/nfs/dbraw/zinc/52/87/76/254528776.db2.gz	ANUJKBBXKQCMMX-NSHDSACASA-N	-1	3	341.389	1.159	20	5		EDBDHM
CCOC(=O)CC[C@H](C)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000270475098	140107043	/nfs/dbraw/zinc/10/70/43/140107043.db2.gz	IJHSETJILLYCSL-NSHDSACASA-N	-1	3	344.389	1.913	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C2(C)CCOCC2)c([N+](=O)[O-])c1	ZINC000331276675	141002420	/nfs/dbraw/zinc/00/24/20/141002420.db2.gz	FTCRGSWWOAINLI-UHFFFAOYSA-N	-1	3	330.362	1.451	20	5		EDBDHM
COC(=O)CCc1nnc([N-]C(=O)c2cccc([N+](=O)[O-])c2)s1	ZINC000346109772	143168701	/nfs/dbraw/zinc/16/87/01/143168701.db2.gz	MGUOISPWQQIHND-UHFFFAOYSA-N	-1	3	336.329	1.804	20	5		EDBDHM
CO[C@@H]1C[C@@H](CN2CCCC2)N(C(=O)c2cc([O-])cc([N+](=O)[O-])c2)C1	ZINC000348004079	143390223	/nfs/dbraw/zinc/39/02/23/143390223.db2.gz	LGQJTWRYRTZLQA-GOEBONIOSA-N	-1	3	349.387	1.626	20	5		EDBDHM
CCO[C@H]1C[C@@H]([N-]S(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)C1	ZINC000416526261	304328884	/nfs/dbraw/zinc/32/88/84/304328884.db2.gz	JMTQSPVXVOWYQZ-DTORHVGOSA-N	-1	3	348.352	1.588	20	5		EDBDHM
CCO[C@H]1COCC[C@H]1[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000352983972	149240168	/nfs/dbraw/zinc/24/01/68/149240168.db2.gz	PGMNHTFCOZYOOE-YPMHNXCESA-N	-1	3	344.389	1.376	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCOC(F)(F)F)ccc1[N+](=O)[O-]	ZINC000353851000	149552049	/nfs/dbraw/zinc/55/20/49/149552049.db2.gz	QXDJMIACCRWVEF-UHFFFAOYSA-N	-1	3	328.268	1.718	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)[C@@H]2CCCOC2)c([N+](=O)[O-])c1	ZINC000355722348	150374847	/nfs/dbraw/zinc/37/48/47/150374847.db2.gz	DVCBQBBFNHFGFO-GHMZBOCLSA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCC1CCOCC1	ZINC000358416828	151367761	/nfs/dbraw/zinc/36/77/61/151367761.db2.gz	XTPORLPVFAPHCG-UHFFFAOYSA-N	-1	3	328.390	1.998	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CN(C(C)C)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000360746770	152183760	/nfs/dbraw/zinc/18/37/60/152183760.db2.gz	QCZKHWANJMMDLM-OLZOCXBDSA-N	-1	3	341.433	1.910	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c([N+](=O)[O-])c1	ZINC000408221200	158300455	/nfs/dbraw/zinc/30/04/55/158300455.db2.gz	DVTMAZOFFZZUSE-ZLKJLUDKSA-N	-1	3	340.401	1.995	20	5		EDBDHM
Cc1ccc(NCCCNC(=O)c2cc(C)nc(=O)[n-]2)c([N+](=O)[O-])c1	ZINC000352390847	162157143	/nfs/dbraw/zinc/15/71/43/162157143.db2.gz	HBUKEGNFVYHHNY-UHFFFAOYSA-N	-1	3	345.359	1.939	20	5		EDBDHM
NC(=O)c1ccc(NC(=O)c2n[n-]c3ccc([N+](=O)[O-])cc32)cn1	ZINC000122672518	222135605	/nfs/dbraw/zinc/13/56/05/222135605.db2.gz	NFIBYIVBDWDLNB-UHFFFAOYSA-N	-1	3	326.272	1.217	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C2(C)CCOCC2)cc1[N+](=O)[O-]	ZINC000275419233	268339648	/nfs/dbraw/zinc/33/96/48/268339648.db2.gz	QBJPUCCNWNOAGT-UHFFFAOYSA-N	-1	3	348.352	1.590	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCN(C)C2CC2)c1C	ZINC000268836204	281015855	/nfs/dbraw/zinc/01/58/55/281015855.db2.gz	GQGOBKAGXGEKOJ-UHFFFAOYSA-N	-1	3	327.406	1.584	20	5		EDBDHM
CCn1cc(S(=O)(=O)[N-][C@@H](CC(C)C)CN(C)C)c([N+](=O)[O-])n1	ZINC000353094812	288703776	/nfs/dbraw/zinc/70/37/76/288703776.db2.gz	DWAKHEZOWLVXJV-NSHDSACASA-N	-1	3	347.441	1.066	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@]2(C)CCOC2=O)c1[N+](=O)[O-]	ZINC000289627093	288746590	/nfs/dbraw/zinc/74/65/90/288746590.db2.gz	RRSZYOSPOBJBBG-CYBMUJFWSA-N	-1	3	328.346	1.196	20	5		EDBDHM
CN(C)CCN(C[C@H]1CCCO1)C(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000359219136	289143594	/nfs/dbraw/zinc/14/35/94/289143594.db2.gz	NENBFTBSWKBXRH-CYBMUJFWSA-N	-1	3	337.376	1.483	20	5		EDBDHM
CN(C)CCN1CCCN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC1	ZINC000363807289	289154667	/nfs/dbraw/zinc/15/46/67/289154667.db2.gz	UQDJGWCAZDRAFW-UHFFFAOYSA-N	-1	3	336.392	1.010	20	5		EDBDHM
C[C@H]1CCC[C@H]1[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000264321268	299907330	/nfs/dbraw/zinc/90/73/30/299907330.db2.gz	PIDRBXYVCMDCNP-VHSXEESVSA-N	-1	3	342.373	1.833	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CCCC[C@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC000487433220	301691177	/nfs/dbraw/zinc/69/11/77/301691177.db2.gz	QGPBCIBKCCTNKF-GHMZBOCLSA-N	-1	3	341.389	1.226	20	5		EDBDHM
Cc1nc([N-]C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)nn1C	ZINC000293706261	303006896	/nfs/dbraw/zinc/00/68/96/303006896.db2.gz	NUMJUEFWEUQGDL-UHFFFAOYSA-N	-1	3	327.247	1.885	20	5		EDBDHM
CC(C)(CCC(=O)Nc1cccc([C@@]2(C)NC(=O)[N-]C2=O)c1)[N+](=O)[O-]	ZINC000294335274	303093570	/nfs/dbraw/zinc/09/35/70/303093570.db2.gz	FCJFEJPJUHGACJ-MRXNPFEDSA-N	-1	3	348.359	1.515	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1CCOC2(CCC2)C1	ZINC000268985599	304810134	/nfs/dbraw/zinc/81/01/34/304810134.db2.gz	QORITLUDAFAVBF-LLVKDONJSA-N	-1	3	326.374	1.975	20	5		EDBDHM
CCN(CC)S(=O)(=O)[N-]c1cc(C(=O)OC)cc([N+](=O)[O-])c1	ZINC000438721712	305188653	/nfs/dbraw/zinc/18/86/53/305188653.db2.gz	HISGRWKILAGICX-UHFFFAOYSA-N	-1	3	331.350	1.380	20	5		EDBDHM
COC[C@@](C)(O)CC[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000451654841	305359759	/nfs/dbraw/zinc/35/97/59/305359759.db2.gz	PHGXRGDOCQAPRK-AWEZNQCLSA-N	-1	3	346.405	1.277	20	5		EDBDHM
CO[C@H]([C@H](C)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C1CC1	ZINC000451979658	305375994	/nfs/dbraw/zinc/37/59/94/305375994.db2.gz	CIKYLLUWENJMGC-IINYFYTJSA-N	-1	3	328.390	1.995	20	5		EDBDHM
Cc1nnc([N-]C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)n1C1CC1	ZINC000556751652	306215553	/nfs/dbraw/zinc/21/55/53/306215553.db2.gz	OELJJZJHRWRYPC-UHFFFAOYSA-N	-1	3	331.288	1.811	20	5		EDBDHM
C[C@H]1CCCN(CC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000046035113	441071324	/nfs/dbraw/zinc/07/13/24/441071324.db2.gz	PMUVFCCHGVPIGQ-LBPRGKRZSA-N	-1	3	327.406	1.605	20	5		EDBDHM
CC(=O)N1CCC([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000055218281	441630558	/nfs/dbraw/zinc/63/05/58/441630558.db2.gz	ZDCZCOUVYVANRD-UHFFFAOYSA-N	-1	3	345.352	1.023	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1CCCCO1	ZINC000145395655	441889190	/nfs/dbraw/zinc/88/91/90/441889190.db2.gz	IUWUZQFMYJJGIZ-NSHDSACASA-N	-1	3	330.362	1.451	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](C)N(C)C2CC2)cc1C	ZINC000069128973	441896292	/nfs/dbraw/zinc/89/62/92/441896292.db2.gz	CRTYWZIJGVTBNA-LBPRGKRZSA-N	-1	3	341.433	1.973	20	5		EDBDHM
Cc1nn(C)c(N2CCN(C(=O)c3cccc([O-])c3)CC2)c1[N+](=O)[O-]	ZINC000078727510	441965795	/nfs/dbraw/zinc/96/57/95/441965795.db2.gz	ZKHPNFONCLVHQY-UHFFFAOYSA-N	-1	3	345.359	1.305	20	5		EDBDHM
CCC(CC)([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(N)=O	ZINC000120102681	442008789	/nfs/dbraw/zinc/00/87/89/442008789.db2.gz	WEZZOPXIVVFBME-UHFFFAOYSA-N	-1	3	343.405	1.534	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCC[N-]S(=O)(=O)c2cccs2)s1	ZINC000192503646	442654290	/nfs/dbraw/zinc/65/42/90/442654290.db2.gz	UUKKPBPUTVOQPF-UHFFFAOYSA-N	-1	3	334.404	1.503	20	5		EDBDHM
O=C(Nc1ccc(-n2cncn2)c(F)c1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000187557896	442681283	/nfs/dbraw/zinc/68/12/83/442681283.db2.gz	ZKWWEJCOKXUVRS-UHFFFAOYSA-N	-1	3	344.262	1.668	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H]2CC[C@@H](O)C2)cc1C	ZINC000188356715	442743018	/nfs/dbraw/zinc/74/30/18/442743018.db2.gz	RUPBDMQXJFEEQN-NWDGAFQWSA-N	-1	3	328.390	1.651	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-][C@H]1Cc2ccccc2[C@H]1O	ZINC000184548816	443038326	/nfs/dbraw/zinc/03/83/26/443038326.db2.gz	YQJHNAJQVAMMMG-GOEBONIOSA-N	-1	3	348.380	1.673	20	5		EDBDHM
C[C@@H]1CN(C2CC2)C[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000268763409	443101246	/nfs/dbraw/zinc/10/12/46/443101246.db2.gz	ARLYGUCAWHLBSF-NOZJJQNGSA-N	-1	3	343.380	1.495	20	5		EDBDHM
C[S@@](=O)Cc1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000185666613	443235460	/nfs/dbraw/zinc/23/54/60/443235460.db2.gz	JMEPDIRGGZVUMD-HSZRJFAPSA-N	-1	3	335.341	1.826	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]CCC[C@H](C)O)cc1[N+](=O)[O-]	ZINC000278582041	443368685	/nfs/dbraw/zinc/36/86/85/443368685.db2.gz	APWXLXJRERSJCM-VIFPVBQESA-N	-1	3	336.797	1.996	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1CCCC[C@H]1O	ZINC000269726336	443412815	/nfs/dbraw/zinc/41/28/15/443412815.db2.gz	BXXQFTGUKRXDFQ-CMPLNLGQSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CS[C@H](C)C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000269767932	443432416	/nfs/dbraw/zinc/43/24/16/443432416.db2.gz	NYEAKLVFBZCKIY-MRVPVSSYSA-N	-1	3	348.402	1.396	20	5		EDBDHM
COC(=O)C1([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CCC1	ZINC000272208181	443556847	/nfs/dbraw/zinc/55/68/47/443556847.db2.gz	ZVTVEAUIBKBFEH-UHFFFAOYSA-N	-1	3	328.271	1.899	20	5		EDBDHM
Cn1nc([C@H]2CCCO2)cc1NC(=O)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000279652217	443617202	/nfs/dbraw/zinc/61/72/02/443617202.db2.gz	HQAJGXBZNJZZKT-LLVKDONJSA-N	-1	3	333.304	1.533	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](CCO)C(C)C)c1[N+](=O)[O-]	ZINC000276654689	443780312	/nfs/dbraw/zinc/78/03/12/443780312.db2.gz	DKTVEZXBKGMECN-GFCCVEGCSA-N	-1	3	330.406	1.897	20	5		EDBDHM
COC(=O)CCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000298852684	443886244	/nfs/dbraw/zinc/88/62/44/443886244.db2.gz	MNQKNSKNRUIIFO-UHFFFAOYSA-N	-1	3	336.753	1.480	20	5		EDBDHM
CN1CCN(CCNC(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC1(C)C	ZINC000281737804	443993083	/nfs/dbraw/zinc/99/30/83/443993083.db2.gz	JRNPQRWBLJCSEK-UHFFFAOYSA-N	-1	3	336.392	1.056	20	5		EDBDHM
C[C@@H]1COCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000277663570	444022636	/nfs/dbraw/zinc/02/26/36/444022636.db2.gz	FRMNBPXXSXOUBH-LDYMZIIASA-N	-1	3	334.781	1.952	20	5		EDBDHM
O=[N+]([O-])c1cccnc1[N-]c1cnn(Cc2nnc3n2CCCC3)c1	ZINC000278001276	444080892	/nfs/dbraw/zinc/08/08/92/444080892.db2.gz	XRWTVRDPRBNKPR-UHFFFAOYSA-N	-1	3	340.347	1.906	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC2CCOCC2)c([N+](=O)[O-])c1	ZINC000299597691	444090689	/nfs/dbraw/zinc/09/06/89/444090689.db2.gz	FKUIMDONDOWKSA-UHFFFAOYSA-N	-1	3	330.362	1.308	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@@H](C)CCO)c1C	ZINC000296294340	444218274	/nfs/dbraw/zinc/21/82/74/444218274.db2.gz	RVCRHMHDWAEBTM-SNVBAGLBSA-N	-1	3	330.406	1.899	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CC[C@H](O)CC2)cc1C	ZINC000318332681	444319036	/nfs/dbraw/zinc/31/90/36/444319036.db2.gz	SLCQZDWRVVKGRY-HAQNSBGRSA-N	-1	3	328.390	1.793	20	5		EDBDHM
CC(=O)N1CC[C@@H]([N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C1	ZINC000331116334	444400298	/nfs/dbraw/zinc/40/02/98/444400298.db2.gz	VLZSOWGPPUIOJY-GFCCVEGCSA-N	-1	3	341.389	1.111	20	5		EDBDHM
C[C@]1(c2ccc(CNc3ncccc3[N+](=O)[O-])cc2)NC(=O)[N-]C1=O	ZINC000338396156	444672209	/nfs/dbraw/zinc/67/22/09/444672209.db2.gz	CBAQGGOSPJLFLS-MRXNPFEDSA-N	-1	3	341.327	1.657	20	5		EDBDHM
O=C(Nc1nnc(SCCO)[n-]1)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000343877449	444641849	/nfs/dbraw/zinc/64/18/49/444641849.db2.gz	VYEFAQFBDZLEQM-UHFFFAOYSA-N	-1	3	348.344	1.531	20	5		EDBDHM
O=C(Nc1nc(SCCO)n[n-]1)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000343877449	444641853	/nfs/dbraw/zinc/64/18/53/444641853.db2.gz	VYEFAQFBDZLEQM-UHFFFAOYSA-N	-1	3	348.344	1.531	20	5		EDBDHM
O=C(Nc1n[n-]c(SCCO)n1)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000343877449	444641857	/nfs/dbraw/zinc/64/18/57/444641857.db2.gz	VYEFAQFBDZLEQM-UHFFFAOYSA-N	-1	3	348.344	1.531	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCCN(C)[C@H]2C)c([N+](=O)[O-])c1	ZINC000343982691	444708638	/nfs/dbraw/zinc/70/86/38/444708638.db2.gz	ORJPWIDAPGNQAH-CMPLNLGQSA-N	-1	3	343.405	1.364	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CCO[C@H](C)C1	ZINC000330614156	445061454	/nfs/dbraw/zinc/06/14/54/445061454.db2.gz	ZULCJKGUNMHUAB-ZJUUUORDSA-N	-1	3	330.362	1.449	20	5		EDBDHM
CC(=O)c1sc2[n-]c(Cn3cnc([N+](=O)[O-])c3)nc(=O)c2c1C	ZINC000348187790	445310385	/nfs/dbraw/zinc/31/03/85/445310385.db2.gz	UDKICDBRKLKULF-UHFFFAOYSA-N	-1	3	333.329	1.649	20	5		EDBDHM
CNS(=O)(=O)c1ccc(NCc2ncccc2[O-])c([N+](=O)[O-])c1	ZINC000359898624	445479457	/nfs/dbraw/zinc/47/94/57/445479457.db2.gz	KWWKPDVSWZZPMR-UHFFFAOYSA-N	-1	3	338.345	1.216	20	5		EDBDHM
CCO[C@@H]1C[C@@H]([N-]c2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]1OC	ZINC000362675488	445493729	/nfs/dbraw/zinc/49/37/29/445493729.db2.gz	SHNMJXXRZBGTEY-JHJVBQTASA-N	-1	3	334.332	2.249	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC(=O)OC(C)(C)C)cc1C	ZINC000360058716	445549027	/nfs/dbraw/zinc/54/90/27/445549027.db2.gz	DTKIGXYESRXAJJ-UHFFFAOYSA-N	-1	3	344.389	1.832	20	5		EDBDHM
CC(C)CN1CCO[C@H](CNC(=O)c2cc([O-])cc([N+](=O)[O-])c2)C1	ZINC000356218140	445680559	/nfs/dbraw/zinc/68/05/59/445680559.db2.gz	LGDHTIHXWIMDKM-OAHLLOKOSA-N	-1	3	337.376	1.387	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CCCc3c[nH]nc32)c([N+](=O)[O-])c1	ZINC000360268626	445668118	/nfs/dbraw/zinc/66/81/18/445668118.db2.gz	UUKYCXXIIUONLI-NSHDSACASA-N	-1	3	336.373	1.982	20	5		EDBDHM
Nc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(-c2nnn[n-]2)c1	ZINC000354349394	446132810	/nfs/dbraw/zinc/13/28/10/446132810.db2.gz	VHTVYSUUGDXZEY-UHFFFAOYSA-N	-1	3	325.288	1.609	20	5		EDBDHM
Nc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(-c2nn[n-]n2)c1	ZINC000354349394	446132813	/nfs/dbraw/zinc/13/28/13/446132813.db2.gz	VHTVYSUUGDXZEY-UHFFFAOYSA-N	-1	3	325.288	1.609	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2C[C@@H](O)C2(C)C)c1[N+](=O)[O-]	ZINC000190169072	533707867	/nfs/dbraw/zinc/70/78/67/533707867.db2.gz	HKFAHRNANUIVRF-GHMZBOCLSA-N	-1	3	328.390	1.649	20	5		EDBDHM
COC(=O)CC[C@H](N)C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000423744270	446674651	/nfs/dbraw/zinc/67/46/51/446674651.db2.gz	NMNFWVUXWOXYJN-ZETCQYMHSA-N	-1	3	331.712	1.173	20	5		EDBDHM
O=C(NCCc1cccc([N+](=O)[O-])c1)c1cc(=O)[n-]c(C2CC2)n1	ZINC000553210792	447979228	/nfs/dbraw/zinc/97/92/28/447979228.db2.gz	QSFVFYDVPTVIQO-UHFFFAOYSA-N	-1	3	328.328	1.940	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](C)C1(OC)CCC1	ZINC000591332488	448327115	/nfs/dbraw/zinc/32/71/15/448327115.db2.gz	TUTHUFBGKZJVFI-JTQLQIEISA-N	-1	3	344.389	1.839	20	5		EDBDHM
COCCCN(C)CCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000566914960	448584307	/nfs/dbraw/zinc/58/43/07/448584307.db2.gz	CXYBZNRHXHJZMN-UHFFFAOYSA-N	-1	3	345.783	1.652	20	5		EDBDHM
CC(C)c1nnc(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)n1C	ZINC000574750692	448947624	/nfs/dbraw/zinc/94/76/24/448947624.db2.gz	OGRYHQIXEBWLRE-UHFFFAOYSA-N	-1	3	339.377	1.325	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCC2(CO)CCC2)c([N+](=O)[O-])c1	ZINC000593664165	449137622	/nfs/dbraw/zinc/13/76/22/449137622.db2.gz	HBVOZNRXWZRTBC-UHFFFAOYSA-N	-1	3	344.389	1.434	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1C[C@H]2CC[C@@H]1O2	ZINC000593632855	449118892	/nfs/dbraw/zinc/11/88/92/449118892.db2.gz	GGJXPHGKPCGDIX-KKZNHRDASA-N	-1	3	328.346	1.202	20	5		EDBDHM
CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000590398959	449147716	/nfs/dbraw/zinc/14/77/16/449147716.db2.gz	AXQGFDWOLLKIKD-OCCSQVGLSA-N	-1	3	335.360	1.236	20	5		EDBDHM
CC[C@@H](CCO)C[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F	ZINC000590591283	449206464	/nfs/dbraw/zinc/20/64/64/449206464.db2.gz	SOCVPYZAOKMRHY-JTQLQIEISA-N	-1	3	334.369	1.729	20	5		EDBDHM
CC[C@@](C)([N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F)C(=O)OC	ZINC000590591979	449208835	/nfs/dbraw/zinc/20/88/35/449208835.db2.gz	WWNPACHTOXQLKW-CYBMUJFWSA-N	-1	3	348.352	1.662	20	5		EDBDHM
O=C1C[C@]2(CCSC2)C(=O)[N-]N1c1ccc([N+](=O)[O-])cc1F	ZINC000601938421	449235357	/nfs/dbraw/zinc/23/53/57/449235357.db2.gz	HKYAWZUVABKOKF-ZDUSSCGKSA-N	-1	3	325.321	1.625	20	5		EDBDHM
CC(=O)N(C)c1ccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)cc1	ZINC000604484953	449238163	/nfs/dbraw/zinc/23/81/63/449238163.db2.gz	QXSPIDMYYUOESV-UHFFFAOYSA-N	-1	3	330.300	1.930	20	5		EDBDHM
COC(=O)[C@@H](NCCCNc1cc[n-]c(=O)c1[N+](=O)[O-])C(C)C	ZINC000596246886	449437617	/nfs/dbraw/zinc/43/76/17/449437617.db2.gz	JOZLCTXQKCVQLZ-NSHDSACASA-N	-1	3	326.353	1.285	20	5		EDBDHM
COc1ccc(N2C[C@@H](Nc3cc[n-]c(=O)c3[N+](=O)[O-])CC2=O)cc1	ZINC000596434901	449501751	/nfs/dbraw/zinc/50/17/51/449501751.db2.gz	ZSFPINRGHBEMHQ-JTQLQIEISA-N	-1	3	344.327	1.921	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])N1CCCC[C@@H]1C	ZINC000594748177	449664674	/nfs/dbraw/zinc/66/46/74/449664674.db2.gz	KVBZFWBIFFWWPH-NWDGAFQWSA-N	-1	3	342.421	1.531	20	5		EDBDHM
CCN1CCCC[C@@H]1C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594756193	449670324	/nfs/dbraw/zinc/67/03/24/449670324.db2.gz	ZQJPGQZTYWSOGF-LLVKDONJSA-N	-1	3	328.394	1.143	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](CO)C2CCC2)c([N+](=O)[O-])c1	ZINC000594802682	449715037	/nfs/dbraw/zinc/71/50/37/449715037.db2.gz	YUTRGHREOADMRT-LLVKDONJSA-N	-1	3	330.362	1.043	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H](C)[C@H]2CCOC2)c(F)cc1[N+](=O)[O-]	ZINC000601356917	449869655	/nfs/dbraw/zinc/86/96/55/449869655.db2.gz	IDUNAGXOTULNCW-UWVGGRQHSA-N	-1	3	332.353	1.746	20	5		EDBDHM
CN(C)c1nc(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)cs1	ZINC000612792386	449880594	/nfs/dbraw/zinc/88/05/94/449880594.db2.gz	PHQFBQMAXOBAIU-UHFFFAOYSA-N	-1	3	342.402	1.596	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CC2=CCCOC2)c(F)cc1[N+](=O)[O-]	ZINC000601417056	449933647	/nfs/dbraw/zinc/93/36/47/449933647.db2.gz	JLWNXIQENYDPEY-UHFFFAOYSA-N	-1	3	330.337	1.667	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](O)[C@H]2CCCO2)c1C	ZINC000599392283	449939016	/nfs/dbraw/zinc/93/90/16/449939016.db2.gz	PWJXWZBNQLCHAH-QWHCGFSZSA-N	-1	3	344.389	1.030	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC(=O)C1CCCC1	ZINC000599472206	450000882	/nfs/dbraw/zinc/00/08/82/450000882.db2.gz	CUUHOHQEHKYWCI-UHFFFAOYSA-N	-1	3	326.374	1.941	20	5		EDBDHM
Cc1c(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)n[nH]c1C(F)(F)F	ZINC000618359546	450173907	/nfs/dbraw/zinc/17/39/07/450173907.db2.gz	IHUBFQDSNQGYDV-UHFFFAOYSA-N	-1	3	331.210	1.998	20	5		EDBDHM
CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1cccc([O-])c1[N+](=O)[O-]	ZINC000597696172	450204870	/nfs/dbraw/zinc/20/48/70/450204870.db2.gz	WGTYPSVROBNPLM-OLZOCXBDSA-N	-1	3	335.360	1.236	20	5		EDBDHM
C[C@@H](C[C@H]1CCOC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000610739615	450316988	/nfs/dbraw/zinc/31/69/88/450316988.db2.gz	GGKFMHXDQPQVEM-VHSXEESVSA-N	-1	3	332.353	1.827	20	5		EDBDHM
CC(=O)N1CCC(CNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000735467224	578886555	/nfs/dbraw/zinc/88/65/55/578886555.db2.gz	ZOPVQZGZOGWDQO-UHFFFAOYSA-N	-1	3	345.363	1.445	20	5		EDBDHM
CC(=O)N1CCC(CNc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000735467224	578886556	/nfs/dbraw/zinc/88/65/56/578886556.db2.gz	ZOPVQZGZOGWDQO-UHFFFAOYSA-N	-1	3	345.363	1.445	20	5		EDBDHM
COC(=O)N1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C1	ZINC000736935281	579032282	/nfs/dbraw/zinc/03/22/82/579032282.db2.gz	HERIBRHIARAINZ-VIFPVBQESA-N	-1	3	347.335	1.418	20	5		EDBDHM
COC(=O)N1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C1	ZINC000736935281	579032283	/nfs/dbraw/zinc/03/22/83/579032283.db2.gz	HERIBRHIARAINZ-VIFPVBQESA-N	-1	3	347.335	1.418	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)NCc1ccc(-c2nnn[n-]2)cc1F	ZINC000737610388	579119826	/nfs/dbraw/zinc/11/98/26/579119826.db2.gz	OPQLBMCMBNOSTJ-UHFFFAOYSA-N	-1	3	345.294	1.183	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)NCc1ccc(-c2nn[n-]n2)cc1F	ZINC000737610388	579119827	/nfs/dbraw/zinc/11/98/27/579119827.db2.gz	OPQLBMCMBNOSTJ-UHFFFAOYSA-N	-1	3	345.294	1.183	20	5		EDBDHM
COCCO[N-]C(=O)c1cc(F)cc([N+](=O)[O-])c1Br	ZINC000755017656	579918250	/nfs/dbraw/zinc/91/82/50/579918250.db2.gz	PQAWDTRBQRVLDS-UHFFFAOYSA-N	-1	3	337.101	1.804	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCC2(C)OCCO2)c1C	ZINC000759115789	579998950	/nfs/dbraw/zinc/99/89/50/579998950.db2.gz	IYSKASNPZKLSKI-UHFFFAOYSA-N	-1	3	344.389	1.643	20	5		EDBDHM
Cc1cc(=O)[n-]c(CSCc2ccc(C(N)=O)cc2[N+](=O)[O-])n1	ZINC000763210109	580095198	/nfs/dbraw/zinc/09/51/98/580095198.db2.gz	VKCZTIHWMDGKPS-UHFFFAOYSA-N	-1	3	334.357	1.931	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]Cc2ccn(C)n2)cc1[N+](=O)[O-]	ZINC000765735119	580150283	/nfs/dbraw/zinc/15/02/83/580150283.db2.gz	MJHZYGPBUWYDBO-UHFFFAOYSA-N	-1	3	344.780	1.769	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1[N-]CC(F)(F)CO	ZINC000767214515	580183891	/nfs/dbraw/zinc/18/38/91/580183891.db2.gz	ZISHYAJIYZFTRP-UHFFFAOYSA-N	-1	3	335.219	1.329	20	5		EDBDHM
CC[C@H](CN1CCCC1)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768851106	580222464	/nfs/dbraw/zinc/22/24/64/580222464.db2.gz	CXJWMNJRAMMRAX-SNVBAGLBSA-N	-1	3	333.435	1.809	20	5		EDBDHM
CC[C@H](CO)N1CCN(Cc2ccc([O-])c(OC)c2[N+](=O)[O-])CC1	ZINC000892131510	590813955	/nfs/dbraw/zinc/81/39/55/590813955.db2.gz	KOQSHPRUADMUMH-CYBMUJFWSA-N	-1	3	339.392	1.198	20	5		EDBDHM
COc1c([O-])ccc(CN(C)C2CCN(OC)CC2)c1[N+](=O)[O-]	ZINC000894813239	591426486	/nfs/dbraw/zinc/42/64/86/591426486.db2.gz	PMGRHVSHEHGEML-UHFFFAOYSA-N	-1	3	325.365	1.767	20	5		EDBDHM
CC(=O)Nc1ccc(Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cc1	ZINC000735487791	592985353	/nfs/dbraw/zinc/98/53/53/592985353.db2.gz	AVLAHDOJHHFLAC-UHFFFAOYSA-N	-1	3	340.303	1.872	20	5		EDBDHM
CC(=O)Nc1ccc(Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)cc1	ZINC000735487791	592985356	/nfs/dbraw/zinc/98/53/56/592985356.db2.gz	AVLAHDOJHHFLAC-UHFFFAOYSA-N	-1	3	340.303	1.872	20	5		EDBDHM
Nc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c([O-])c1	ZINC000817913072	593648053	/nfs/dbraw/zinc/64/80/53/593648053.db2.gz	NOBCDJKJNMVTOE-UHFFFAOYSA-N	-1	3	343.343	1.240	20	5		EDBDHM
C[C@H]1CN=C([N-]C(=O)c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])S1	ZINC000819783193	593769031	/nfs/dbraw/zinc/76/90/31/593769031.db2.gz	YWJNNAXIXSGYNK-ZETCQYMHSA-N	-1	3	343.386	1.219	20	5		EDBDHM
C[C@@](O)(CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)c1ccco1	ZINC000820467577	593820697	/nfs/dbraw/zinc/82/06/97/593820697.db2.gz	JXNZMQHIFDGHGT-CQSZACIVSA-N	-1	3	330.304	1.688	20	5		EDBDHM
C[C@@](O)(CNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)c1ccco1	ZINC000820467577	593820698	/nfs/dbraw/zinc/82/06/98/593820698.db2.gz	JXNZMQHIFDGHGT-CQSZACIVSA-N	-1	3	330.304	1.688	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1	ZINC000821845991	593953042	/nfs/dbraw/zinc/95/30/42/593953042.db2.gz	NGZRWCPFZFKHDN-UHFFFAOYSA-N	-1	3	343.303	1.042	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1	ZINC000821845991	593953043	/nfs/dbraw/zinc/95/30/43/593953043.db2.gz	NGZRWCPFZFKHDN-UHFFFAOYSA-N	-1	3	343.303	1.042	20	5		EDBDHM
C[C@@H](NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1ccccc1[N+](=O)[O-]	ZINC000824513828	594028223	/nfs/dbraw/zinc/02/82/23/594028223.db2.gz	JGYXMJMMDCUCFS-MRVPVSSYSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@@H](NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1ccccc1[N+](=O)[O-]	ZINC000824513828	594028225	/nfs/dbraw/zinc/02/82/25/594028225.db2.gz	JGYXMJMMDCUCFS-MRVPVSSYSA-N	-1	3	327.304	1.594	20	5		EDBDHM
Cc1noc(C)c1CCCNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000822522759	594062029	/nfs/dbraw/zinc/06/20/29/594062029.db2.gz	MLHIVUAMNKOVOL-UHFFFAOYSA-N	-1	3	344.335	1.819	20	5		EDBDHM
Cc1noc(C)c1CCCNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000822522759	594062030	/nfs/dbraw/zinc/06/20/30/594062030.db2.gz	MLHIVUAMNKOVOL-UHFFFAOYSA-N	-1	3	344.335	1.819	20	5		EDBDHM
NC(=O)[C@@H]1CCCCC[C@H]1Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000822860408	594112620	/nfs/dbraw/zinc/11/26/20/594112620.db2.gz	UGXRQDFXTJBQOJ-GHMZBOCLSA-N	-1	3	345.363	1.621	20	5		EDBDHM
NC(=O)[C@@H]1CCCCC[C@H]1Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000822860408	594112621	/nfs/dbraw/zinc/11/26/21/594112621.db2.gz	UGXRQDFXTJBQOJ-GHMZBOCLSA-N	-1	3	345.363	1.621	20	5		EDBDHM
C[C@H](NCCCN1CCN(C(=O)[O-])CC1)c1cccc([N+](=O)[O-])c1	ZINC000825496134	594193146	/nfs/dbraw/zinc/19/31/46/594193146.db2.gz	MKBNRULICUQBRC-ZDUSSCGKSA-N	-1	3	336.392	1.931	20	5		EDBDHM
COc1ccc(CNc2c([N+](=O)[O-])c(C)nn2C)cc1-c1nnn[n-]1	ZINC000826203305	594376743	/nfs/dbraw/zinc/37/67/43/594376743.db2.gz	IRYSXDRTQJHVNW-UHFFFAOYSA-N	-1	3	344.335	1.438	20	5		EDBDHM
COc1ccc(CNc2c([N+](=O)[O-])c(C)nn2C)cc1-c1nn[n-]n1	ZINC000826203305	594376746	/nfs/dbraw/zinc/37/67/46/594376746.db2.gz	IRYSXDRTQJHVNW-UHFFFAOYSA-N	-1	3	344.335	1.438	20	5		EDBDHM
Cc1c(CC(=O)Nc2ccncc2-c2nnn[n-]2)cccc1[N+](=O)[O-]	ZINC000826236667	594391053	/nfs/dbraw/zinc/39/10/53/594391053.db2.gz	XASQCIIWDPTPDR-UHFFFAOYSA-N	-1	3	339.315	1.081	20	5		EDBDHM
Cc1c(CC(=O)Nc2ccncc2-c2nn[n-]n2)cccc1[N+](=O)[O-]	ZINC000826236667	594391056	/nfs/dbraw/zinc/39/10/56/594391056.db2.gz	XASQCIIWDPTPDR-UHFFFAOYSA-N	-1	3	339.315	1.081	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C[C@H](O)C2CCC2)c1	ZINC000832654667	594767130	/nfs/dbraw/zinc/76/71/30/594767130.db2.gz	QCAIHWZJVQHBHZ-NSHDSACASA-N	-1	3	348.808	1.996	20	5		EDBDHM
CNc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)C[C@H]1CCCOC1	ZINC000842586926	595133533	/nfs/dbraw/zinc/13/35/33/595133533.db2.gz	RRDZNDZXKCCYOG-JTQLQIEISA-N	-1	3	329.378	1.805	20	5		EDBDHM
O=C1CC2(CN(c3cc[n-]c(=O)c3[N+](=O)[O-])C2)N1Cc1ccccc1	ZINC000866160151	596811049	/nfs/dbraw/zinc/81/10/49/596811049.db2.gz	UWEGFCBKGHLLQH-UHFFFAOYSA-N	-1	3	340.339	1.687	20	5		EDBDHM
C[C@H](CC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)[S@](C)=O	ZINC000120027117	596877478	/nfs/dbraw/zinc/87/74/78/596877478.db2.gz	IZCLKVPCKMVXHB-LWESTGQBSA-N	-1	3	326.421	1.092	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@@H](C3OCCO3)C2)c(-c2nnn[n-]2)c1	ZINC000738368195	598313433	/nfs/dbraw/zinc/31/34/33/598313433.db2.gz	ANVPAVVTNMWKEU-SNVBAGLBSA-N	-1	3	346.347	1.364	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@@H](C3OCCO3)C2)c(-c2nn[n-]n2)c1	ZINC000738368195	598313435	/nfs/dbraw/zinc/31/34/35/598313435.db2.gz	ANVPAVVTNMWKEU-SNVBAGLBSA-N	-1	3	346.347	1.364	20	5		EDBDHM
CC1(C(=O)N[C@@H]2[C@H]3CN(c4cc[n-]c(=O)c4[N+](=O)[O-])C[C@H]32)CCCC1	ZINC001060460503	695215643	/nfs/dbraw/zinc/21/56/43/695215643.db2.gz	RDAHKDAVNAAJOE-PJXYFTJBSA-N	-1	3	346.387	1.827	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](CCO)c1ccco1	ZINC000184269781	235351678	/nfs/dbraw/zinc/35/16/78/235351678.db2.gz	YFXCUBQNTFUMMR-NSHDSACASA-N	-1	3	340.357	1.898	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCC[C@]2(C)CO)cc1[N+](=O)[O-]	ZINC000124662089	138328757	/nfs/dbraw/zinc/32/87/57/138328757.db2.gz	JHJZFTKBFJZJGZ-ZYHUDNBSSA-N	-1	3	334.419	1.794	20	5		EDBDHM
O=C1[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CN1c1ccccc1	ZINC000359909357	201118593	/nfs/dbraw/zinc/11/85/93/201118593.db2.gz	YWVRIJNFMAQYSL-GFCCVEGCSA-N	-1	3	347.352	1.289	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)CC(C)(C)O	ZINC000295526094	201349655	/nfs/dbraw/zinc/34/96/55/201349655.db2.gz	PSYSCMWEWFXWMH-SECBINFHSA-N	-1	3	332.378	1.431	20	5		EDBDHM
CCN(CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000077389429	203384689	/nfs/dbraw/zinc/38/46/89/203384689.db2.gz	XMNQHXFQVOXIMM-UHFFFAOYSA-N	-1	3	331.369	1.497	20	5		EDBDHM
C[C@H](CN(C)c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1nnn[n-]1	ZINC000129859839	205215232	/nfs/dbraw/zinc/21/52/32/205215232.db2.gz	AOZSHPHATLQZCJ-MRVPVSSYSA-N	-1	3	331.336	1.233	20	5		EDBDHM
C[C@H](CN(C)c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1nn[n-]n1	ZINC000129859839	205215236	/nfs/dbraw/zinc/21/52/36/205215236.db2.gz	AOZSHPHATLQZCJ-MRVPVSSYSA-N	-1	3	331.336	1.233	20	5		EDBDHM
Cc1noc(CC[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])n1	ZINC000101575584	205561577	/nfs/dbraw/zinc/56/15/77/205561577.db2.gz	RQHMPUMEJJWMIS-UHFFFAOYSA-N	-1	3	346.752	1.461	20	5		EDBDHM
Cc1ocnc1C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000161945650	206378296	/nfs/dbraw/zinc/37/82/96/206378296.db2.gz	WCUHEDVVNOYBSM-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
CCCCN(C)CC[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000112364005	220315126	/nfs/dbraw/zinc/31/51/26/220315126.db2.gz	AHQQQKBUVZLPFW-UHFFFAOYSA-N	-1	3	333.385	1.744	20	5		EDBDHM
COC(=O)c1cc2c(cc1[N-]C(=O)c1ccc([N+](=O)[O-])o1)OCO2	ZINC000489696444	255071028	/nfs/dbraw/zinc/07/10/28/255071028.db2.gz	NUXMUWDTRYOPPV-UHFFFAOYSA-N	-1	3	334.240	1.955	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CCO[C@@H](C)C1	ZINC000271303821	140274392	/nfs/dbraw/zinc/27/43/92/140274392.db2.gz	WXRJAYLGTUBSFZ-WDEREUQCSA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H](CO)C(C)C)c1[N+](=O)[O-]	ZINC000344805822	143013849	/nfs/dbraw/zinc/01/38/49/143013849.db2.gz	GRCMSRHORDOWHL-GFCCVEGCSA-N	-1	3	330.406	1.754	20	5		EDBDHM
CCCN(CC)C[C@H](C)[N-]S(=O)(=O)c1cn(CC)nc1[N+](=O)[O-]	ZINC000352585222	149074613	/nfs/dbraw/zinc/07/46/13/149074613.db2.gz	BMEYYYCYDLNZKB-NSHDSACASA-N	-1	3	347.441	1.210	20	5		EDBDHM
CC(=O)NCc1ccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)cc1	ZINC000354954955	150052904	/nfs/dbraw/zinc/05/29/04/150052904.db2.gz	VUAICIFAJDNJEN-UHFFFAOYSA-N	-1	3	330.300	1.584	20	5		EDBDHM
CCN1CC[C@@H]2OCCN(C(=O)c3cccc([O-])c3[N+](=O)[O-])[C@H]2C1	ZINC000355328885	150219890	/nfs/dbraw/zinc/21/98/90/150219890.db2.gz	YUNBBVJJVPSVGD-JSGCOSHPSA-N	-1	3	335.360	1.236	20	5		EDBDHM
O=C([N-]c1n[nH]c(SCCO)n1)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000355422376	150261786	/nfs/dbraw/zinc/26/17/86/150261786.db2.gz	NRBTYLYZKPIJHG-UHFFFAOYSA-N	-1	3	343.752	1.703	20	5		EDBDHM
CNc1c(C(=O)N2CCc3c(nc[n-]c3=O)C2)cccc1[N+](=O)[O-]	ZINC000360924494	152253609	/nfs/dbraw/zinc/25/36/09/152253609.db2.gz	JLTURWXSRDEMMG-UHFFFAOYSA-N	-1	3	329.316	1.331	20	5		EDBDHM
O=C(COc1cccc([N+](=O)[O-])c1)NCc1nnc(C(F)(F)F)[n-]1	ZINC000360998758	152274991	/nfs/dbraw/zinc/27/49/91/152274991.db2.gz	YNKHTKFXZSEJAC-UHFFFAOYSA-N	-1	3	345.237	1.427	20	5		EDBDHM
O=C(COc1cccc([N+](=O)[O-])c1)NCc1n[n-]c(C(F)(F)F)n1	ZINC000360998758	152274994	/nfs/dbraw/zinc/27/49/94/152274994.db2.gz	YNKHTKFXZSEJAC-UHFFFAOYSA-N	-1	3	345.237	1.427	20	5		EDBDHM
O=C(COc1cccc([N+](=O)[O-])c1)NCc1nc(C(F)(F)F)n[n-]1	ZINC000360998758	152274995	/nfs/dbraw/zinc/27/49/95/152274995.db2.gz	YNKHTKFXZSEJAC-UHFFFAOYSA-N	-1	3	345.237	1.427	20	5		EDBDHM
COc1cc(C(=O)NCc2ncccc2[O-])c([N+](=O)[O-])cc1OC	ZINC000352514376	162223159	/nfs/dbraw/zinc/22/31/59/162223159.db2.gz	AIDQAHABFWZKMS-UHFFFAOYSA-N	-1	3	333.300	1.643	20	5		EDBDHM
CC1(C)CC[C@@H](C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])O1	ZINC000188748981	272959166	/nfs/dbraw/zinc/95/91/66/272959166.db2.gz	BGLMIVWUVHSOHT-LBPRGKRZSA-N	-1	3	328.390	1.972	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@H]2CCC[C@H]2O)cc1[N+](=O)[O-]	ZINC000275104553	268282101	/nfs/dbraw/zinc/28/21/01/268282101.db2.gz	UTKSPMKNEOODTB-PRHODGIISA-N	-1	3	348.352	1.182	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCC(C)C	ZINC000276050809	268394122	/nfs/dbraw/zinc/39/41/22/268394122.db2.gz	AEZSFIQWSMQQHL-UHFFFAOYSA-N	-1	3	330.362	1.706	20	5		EDBDHM
COc1cc(CNCC2([S@](C)=O)CCC2)c([N+](=O)[O-])cc1[O-]	ZINC000280608003	273377109	/nfs/dbraw/zinc/37/71/09/273377109.db2.gz	JXEIZUDCGPVFTM-QFIPXVFZSA-N	-1	3	328.390	1.700	20	5		EDBDHM
Cc1noc(C(C)(C)[N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)n1	ZINC000284130759	274090483	/nfs/dbraw/zinc/09/04/83/274090483.db2.gz	CTUKUNDIJYLGMM-UHFFFAOYSA-N	-1	3	340.361	1.641	20	5		EDBDHM
CCC[C@]1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)CCOC1	ZINC000285411735	274533616	/nfs/dbraw/zinc/53/36/16/274533616.db2.gz	UXBAKFGXSZOFMH-AWEZNQCLSA-N	-1	3	344.389	1.841	20	5		EDBDHM
CCOc1cc([N+](=O)[O-])c(C(=O)[N-]OCCCOC)cc1OC	ZINC000287756207	288315544	/nfs/dbraw/zinc/31/55/44/288315544.db2.gz	IWBDDTSFRYDHRB-UHFFFAOYSA-N	-1	3	328.321	1.700	20	5		EDBDHM
CCOC(=O)C(C)(C)O[N-]C(=O)c1cc(OCC)ccc1[N+](=O)[O-]	ZINC000295743456	303261063	/nfs/dbraw/zinc/26/10/63/303261063.db2.gz	TUOZWZGFFKKXLS-UHFFFAOYSA-N	-1	3	340.332	1.997	20	5		EDBDHM
CCOC(=O)c1cc(S(=O)(=O)[N-]CCF)cc([N+](=O)[O-])c1C	ZINC000435632519	305144139	/nfs/dbraw/zinc/14/41/39/305144139.db2.gz	PHAIMUKZKJJFLN-UHFFFAOYSA-N	-1	3	334.325	1.328	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1C(=O)NCc1nnc(C(F)(F)F)[n-]1	ZINC000446334150	305263316	/nfs/dbraw/zinc/26/33/16/305263316.db2.gz	UNVBMOFQJTWUQX-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1C(=O)NCc1n[n-]c(C(F)(F)F)n1	ZINC000446334150	305263317	/nfs/dbraw/zinc/26/33/17/305263317.db2.gz	UNVBMOFQJTWUQX-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1C(=O)NCc1nc(C(F)(F)F)n[n-]1	ZINC000446334150	305263318	/nfs/dbraw/zinc/26/33/18/305263318.db2.gz	UNVBMOFQJTWUQX-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1	ZINC000523693869	305812075	/nfs/dbraw/zinc/81/20/75/305812075.db2.gz	CPOBHCPRBKJUIK-LLVKDONJSA-N	-1	3	330.300	1.583	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](CO)c1ccccc1	ZINC000102888380	441172689	/nfs/dbraw/zinc/17/26/89/441172689.db2.gz	NKNIXSQQBCIFJB-CYBMUJFWSA-N	-1	3	336.369	1.915	20	5		EDBDHM
CN(C)c1nc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cs1	ZINC000080800072	441198683	/nfs/dbraw/zinc/19/86/83/441198683.db2.gz	QVZXOYWDPSVQOW-UHFFFAOYSA-N	-1	3	342.402	1.596	20	5		EDBDHM
CN(C)C(=O)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000056087828	441688025	/nfs/dbraw/zinc/68/80/25/441688025.db2.gz	BNLXBPGLJZAOOF-UHFFFAOYSA-N	-1	3	335.769	1.005	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](O)C(C)(C)C)c1C	ZINC000119071676	441915447	/nfs/dbraw/zinc/91/54/47/441915447.db2.gz	HASIRXMUBHQQGJ-LBPRGKRZSA-N	-1	3	330.406	1.897	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCC[S@](C)=O)c1C	ZINC000120682894	442116718	/nfs/dbraw/zinc/11/67/18/442116718.db2.gz	CBWOWTVHFGHXJJ-HXUWFJFHSA-N	-1	3	334.419	1.259	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCNC(=O)C(C)C)c1C	ZINC000178282033	442421071	/nfs/dbraw/zinc/42/10/71/442421071.db2.gz	UJUSQTUQVBINMX-UHFFFAOYSA-N	-1	3	343.405	1.262	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@](C)(O)C(C)C)cc1C	ZINC000178744094	442472680	/nfs/dbraw/zinc/47/26/80/442472680.db2.gz	MWLHTOCLWJFVHC-AWEZNQCLSA-N	-1	3	330.406	1.897	20	5		EDBDHM
C[C@H](CO[C@H]1CCOC1)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000267888276	442778527	/nfs/dbraw/zinc/77/85/27/442778527.db2.gz	QVVDQXUERNQDHW-MNOVXSKESA-N	-1	3	330.362	1.067	20	5		EDBDHM
CN(C)C(=O)CCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000193926989	442813795	/nfs/dbraw/zinc/81/37/95/442813795.db2.gz	MCJLZNGTTGTISJ-UHFFFAOYSA-N	-1	3	349.796	1.395	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCOC1	ZINC000266132756	443028707	/nfs/dbraw/zinc/02/87/07/443028707.db2.gz	BGNZBAMHMLXZKY-IUCAKERBSA-N	-1	3	334.781	1.952	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2CCC(=O)N(C)C2)c1[N+](=O)[O-]	ZINC000189982501	443042420	/nfs/dbraw/zinc/04/24/20/443042420.db2.gz	UWDKQDZRFMLICC-LLVKDONJSA-N	-1	3	341.389	1.111	20	5		EDBDHM
Cc1cc([N-]c2ccn(CC(=O)N3CCOCC3)n2)ncc1[N+](=O)[O-]	ZINC000266794917	443245090	/nfs/dbraw/zinc/24/50/90/443245090.db2.gz	AEFLUNXBPGVBAY-UHFFFAOYSA-N	-1	3	346.347	1.097	20	5		EDBDHM
COc1cc(-c2nc(-c3c([N+](=O)[O-])ncn3C)no2)cc(OC)c1[O-]	ZINC000350898045	319078057	/nfs/dbraw/zinc/07/80/57/319078057.db2.gz	HQXMMIMBFNELBI-UHFFFAOYSA-N	-1	3	347.287	1.768	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1CCC[C@H]1O	ZINC000269307692	443275565	/nfs/dbraw/zinc/27/55/65/443275565.db2.gz	UPUZHCKIKUNIAA-GXSJLCMTSA-N	-1	3	330.362	1.043	20	5		EDBDHM
CC(C)OC(=O)[C@H](C)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000266839423	443262999	/nfs/dbraw/zinc/26/29/99/443262999.db2.gz	LPASCINNUUMYBK-SNVBAGLBSA-N	-1	3	330.362	1.461	20	5		EDBDHM
O=C([N-]N1CCCNC1=O)c1cc([N+](=O)[O-])ccc1N1CCCC1	ZINC000272459220	443326304	/nfs/dbraw/zinc/32/63/04/443326304.db2.gz	XUBJZIMZIORXPM-UHFFFAOYSA-N	-1	3	333.348	1.255	20	5		EDBDHM
O=C(CNc1ccccc1[N+](=O)[O-])N1CCc2nc[n-]c(=O)c2C1	ZINC000269676925	443391275	/nfs/dbraw/zinc/39/12/75/443391275.db2.gz	JVUHEXVBRXDVJY-UHFFFAOYSA-N	-1	3	329.316	1.087	20	5		EDBDHM
CN(C)[C@@]1(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCSC1	ZINC000267182286	443369655	/nfs/dbraw/zinc/36/96/55/443369655.db2.gz	XPDTWOQMRKBCAT-CYBMUJFWSA-N	-1	3	345.446	1.310	20	5		EDBDHM
CC[C@H](C)[C@@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000269763288	443430423	/nfs/dbraw/zinc/43/04/23/443430423.db2.gz	KIPDGULSJKHBKK-ONGXEEELSA-N	-1	3	332.378	1.289	20	5		EDBDHM
CCC[C@H](O)C[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	ZINC000275044335	443620151	/nfs/dbraw/zinc/62/01/51/443620151.db2.gz	FWRYXNXJNMRMBW-QMMMGPOBSA-N	-1	3	336.341	1.182	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCN1CC=CCC1	ZINC000280387008	443709974	/nfs/dbraw/zinc/70/99/74/443709974.db2.gz	ZXNNYZFOVRWDRC-UHFFFAOYSA-N	-1	3	325.390	1.443	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1C(=O)N1CCc2nc[n-]c(=O)c2C1	ZINC000277214075	443939439	/nfs/dbraw/zinc/93/94/39/443939439.db2.gz	HNNNIKWVAURSGF-UHFFFAOYSA-N	-1	3	330.300	1.298	20	5		EDBDHM
CC[C@H](C)c1nc([C@@H](C)NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)n[nH]1	ZINC000277076136	443903513	/nfs/dbraw/zinc/90/35/13/443903513.db2.gz	OALUDGFEFLWORP-JGVFFNPUSA-N	-1	3	334.336	1.818	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCOC[C@H]2C)c1C	ZINC000277728410	444033583	/nfs/dbraw/zinc/03/35/83/444033583.db2.gz	JMRADOSJAFAWGE-ZYHUDNBSSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@]2(C)CCOC2=O)c1C	ZINC000289685017	444190458	/nfs/dbraw/zinc/19/04/58/444190458.db2.gz	VMDCFCQYXBGBJI-CYBMUJFWSA-N	-1	3	328.346	1.196	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000316794369	444312715	/nfs/dbraw/zinc/31/27/15/444312715.db2.gz	HAQGLJCPAKAEFX-SECBINFHSA-N	-1	3	330.362	1.603	20	5		EDBDHM
CCC[C@@H](C)[C@H](CO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000581256215	322156171	/nfs/dbraw/zinc/15/61/71/322156171.db2.gz	WCGPUICXQHODPI-PWSUYJOCSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CN(C)c1nc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc(=O)[n-]1	ZINC000338316620	444627595	/nfs/dbraw/zinc/62/75/95/444627595.db2.gz	QNLXUCFEDHZBHF-UHFFFAOYSA-N	-1	3	345.359	1.471	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)c1ccon1	ZINC000342351042	444649061	/nfs/dbraw/zinc/64/90/61/444649061.db2.gz	QNOQMPUCEIBMQI-QMMMGPOBSA-N	-1	3	327.318	1.631	20	5		EDBDHM
COCCOCCC[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000343470175	445228727	/nfs/dbraw/zinc/22/87/27/445228727.db2.gz	QSTVCMQVGUAUTB-UHFFFAOYSA-N	-1	3	338.407	1.296	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCc2ccn(C)n2)cc1C	ZINC000354711401	445347858	/nfs/dbraw/zinc/34/78/58/445347858.db2.gz	OZNOFWQAIHMHPY-UHFFFAOYSA-N	-1	3	338.389	1.466	20	5		EDBDHM
COC(=O)c1cccc2nc(NC(=O)c3c([N+](=O)[O-])cnn3C)[n-]c21	ZINC000348561138	445326599	/nfs/dbraw/zinc/32/65/99/445326599.db2.gz	JCEYWGBUBYSGSX-UHFFFAOYSA-N	-1	3	344.287	1.244	20	5		EDBDHM
COC(=O)c1cccc2[n-]c(NC(=O)c3c([N+](=O)[O-])cnn3C)nc21	ZINC000348561138	445326603	/nfs/dbraw/zinc/32/66/03/445326603.db2.gz	JCEYWGBUBYSGSX-UHFFFAOYSA-N	-1	3	344.287	1.244	20	5		EDBDHM
O=C(Nc1ccc2c(=O)cc[nH]c2c1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000357101548	445429510	/nfs/dbraw/zinc/42/95/10/445429510.db2.gz	OVIDGZJWFBSRIX-UHFFFAOYSA-N	-1	3	326.268	1.789	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H]2CCCOC2)c1[N+](=O)[O-]	ZINC000189876312	533707166	/nfs/dbraw/zinc/70/71/66/533707166.db2.gz	NVWQGFHPAHESGC-GFCCVEGCSA-N	-1	3	328.390	1.917	20	5		EDBDHM
Cc1noc(C)c1S(=O)(=O)[N-]Cc1cccc([N+](=O)[O-])c1C	ZINC000360114733	445575021	/nfs/dbraw/zinc/57/50/21/445575021.db2.gz	IQQSQEFFIAUBPV-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
CS[C@H]1CN(c2nc(C(=O)[O-])ccc2[N+](=O)[O-])C[C@H]1N(C)C	ZINC000583696187	326122062	/nfs/dbraw/zinc/12/20/62/326122062.db2.gz	INCHCAGJIFSFTG-MNOVXSKESA-N	-1	3	326.378	1.170	20	5		EDBDHM
Cc1cc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)ccc1-n1cnnn1	ZINC000583732116	326126958	/nfs/dbraw/zinc/12/69/58/326126958.db2.gz	MLOPBMLOJLBPNC-UHFFFAOYSA-N	-1	3	341.287	1.232	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CC2(CO)CCCC2)cc1[N+](=O)[O-]	ZINC000351575058	446171941	/nfs/dbraw/zinc/17/19/41/446171941.db2.gz	FKVVMQTVUCGHNS-UHFFFAOYSA-N	-1	3	334.419	1.796	20	5		EDBDHM
Cn1cc(-c2cc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)n(C)n2)cn1	ZINC000365758705	446331729	/nfs/dbraw/zinc/33/17/29/446331729.db2.gz	PBCVXVWAVQSDBR-UHFFFAOYSA-N	-1	3	343.303	1.082	20	5		EDBDHM
COC(=O)[C@H](CNc1ccc([N+](=O)[O-])cn1)Cc1ccc([O-])c(F)c1	ZINC000420637537	446714693	/nfs/dbraw/zinc/71/46/93/446714693.db2.gz	OVKNNZGWHCYFIO-NSHDSACASA-N	-1	3	349.318	2.278	20	5		EDBDHM
O=C(c1ccc([O-])c([N+](=O)[O-])c1)N1CCCN(C2CCOCC2)CC1	ZINC000368316924	446782949	/nfs/dbraw/zinc/78/29/49/446782949.db2.gz	UMNNJODNSVAUHT-UHFFFAOYSA-N	-1	3	349.387	1.627	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@@H](O)CC(C)(C)C)c([N+](=O)[O-])c1	ZINC000443260039	447018130	/nfs/dbraw/zinc/01/81/30/447018130.db2.gz	BUXATURABQHCDO-NSHDSACASA-N	-1	3	330.406	1.979	20	5		EDBDHM
CCOC(=O)Cn1cnc([N-]C(=O)c2c(C)cccc2[N+](=O)[O-])n1	ZINC000425098905	447019486	/nfs/dbraw/zinc/01/94/86/447019486.db2.gz	MZLUXOITZWDUGK-UHFFFAOYSA-N	-1	3	333.304	1.310	20	5		EDBDHM
O=C(Cn1cnc([N+](=O)[O-])n1)Nc1ccc(OC(F)(F)F)cc1[O-]	ZINC000442806326	446973778	/nfs/dbraw/zinc/97/37/78/446973778.db2.gz	BEUHPLKVRNOJOF-UHFFFAOYSA-N	-1	3	347.209	1.429	20	5		EDBDHM
CC(=O)N(C)c1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000445001279	447155431	/nfs/dbraw/zinc/15/54/31/447155431.db2.gz	SURMFMIESURXMB-UHFFFAOYSA-N	-1	3	330.300	1.930	20	5		EDBDHM
Cc1cc(C(=O)N2CCO[C@]3(CCCOC3)C2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375983150	447191903	/nfs/dbraw/zinc/19/19/03/447191903.db2.gz	FZYGWUFRTOVBIM-OAHLLOKOSA-N	-1	3	337.332	1.025	20	5		EDBDHM
C[C@@H](CCO)[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000416463172	447609616	/nfs/dbraw/zinc/60/96/16/447609616.db2.gz	UJUXGNXMFOBDPC-ZETCQYMHSA-N	-1	3	342.295	1.663	20	5		EDBDHM
CC[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)OC	ZINC000592078580	448665540	/nfs/dbraw/zinc/66/55/40/448665540.db2.gz	VFUNEFZOJAMAEI-QMMMGPOBSA-N	-1	3	334.325	1.211	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2ccc3c(n2)CCCC3)nc1	ZINC000593588798	449092877	/nfs/dbraw/zinc/09/28/77/449092877.db2.gz	NRUFEIJRTHSRLI-UHFFFAOYSA-N	-1	3	348.384	1.742	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](CO)CC2CC2)c([N+](=O)[O-])c1	ZINC000611108101	449170742	/nfs/dbraw/zinc/17/07/42/449170742.db2.gz	YARBJKUTQGUGFJ-JTQLQIEISA-N	-1	3	330.362	1.043	20	5		EDBDHM
O=C(c1ccc([N+](=O)[O-])cc1[O-])N1CCC(N2CCCOCC2)CC1	ZINC000600009315	449147279	/nfs/dbraw/zinc/14/72/79/449147279.db2.gz	ZILWBLFOQFFZOG-UHFFFAOYSA-N	-1	3	349.387	1.627	20	5		EDBDHM
CN1CCC[C@H](N2CCN(Cc3cc([O-])ccc3[N+](=O)[O-])CC2)C1	ZINC000611270770	449242896	/nfs/dbraw/zinc/24/28/96/449242896.db2.gz	NOIOEYCQGKXFBF-HNNXBMFYSA-N	-1	3	334.420	1.512	20	5		EDBDHM
Cc1csc(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)n1	ZINC000593529712	449327807	/nfs/dbraw/zinc/32/78/07/449327807.db2.gz	SKFCDBARZRRVRL-UHFFFAOYSA-N	-1	3	328.375	1.276	20	5		EDBDHM
O=C(c1cccc(F)c1)N1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596076532	449351305	/nfs/dbraw/zinc/35/13/05/449351305.db2.gz	UBWNFSRUIPNREG-UHFFFAOYSA-N	-1	3	346.318	1.797	20	5		EDBDHM
CCCNC(=O)CN1CCC(Nc2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596076620	449351397	/nfs/dbraw/zinc/35/13/97/449351397.db2.gz	NHIUIDHCXYYJCK-UHFFFAOYSA-N	-1	3	337.380	1.098	20	5		EDBDHM
CCOc1cc(N2CCC[C@@H]2c2nc(=N)n(C)[n-]2)ccc1[N+](=O)[O-]	ZINC000596253086	449441404	/nfs/dbraw/zinc/44/14/04/449441404.db2.gz	WDYAZXUMKVVVGG-GFCCVEGCSA-N	-1	3	332.364	1.876	20	5		EDBDHM
Cn1[n-]c([C@H]2CCCN2c2nc3sccn3c2[N+](=O)[O-])nc1=N	ZINC000596253130	449441429	/nfs/dbraw/zinc/44/14/29/449441429.db2.gz	XCDCBVGHNILVPE-SSDOTTSWSA-N	-1	3	334.365	1.187	20	5		EDBDHM
CO[C@@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)c2cc([O-])cc([N+](=O)[O-])c2)C1	ZINC000600629033	449465954	/nfs/dbraw/zinc/46/59/54/449465954.db2.gz	OEFHOMFHMZBHAQ-OWCLPIDISA-N	-1	3	349.387	1.672	20	5		EDBDHM
CCOc1ccc([N+](=O)[O-])cc1CNCc1nc(CN)cc(=O)[n-]1	ZINC000600778219	449544530	/nfs/dbraw/zinc/54/45/30/449544530.db2.gz	WURQSCGSLGZSHA-UHFFFAOYSA-N	-1	3	333.348	1.238	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCC1CC(OC)C1	ZINC000594788555	449697832	/nfs/dbraw/zinc/69/78/32/449697832.db2.gz	FFBDVLNHHZXBSL-UHFFFAOYSA-N	-1	3	344.389	1.697	20	5		EDBDHM
CCN1CCC[C@H](C[N-]S(=O)(=O)c2cc(C)sc2[N+](=O)[O-])C1	ZINC000601328775	449836527	/nfs/dbraw/zinc/83/65/27/449836527.db2.gz	YVMXRGFXXOUZNQ-LLVKDONJSA-N	-1	3	347.462	1.975	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1C[C@H]1C(F)(F)F	ZINC000601522566	450044571	/nfs/dbraw/zinc/04/45/71/450044571.db2.gz	POBYLXPOEWLHEJ-RNFRBKRXSA-N	-1	3	340.279	1.833	20	5		EDBDHM
CO[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C1CCCC1	ZINC000595363716	450076890	/nfs/dbraw/zinc/07/68/90/450076890.db2.gz	AHEDZYKYHXSZMD-GFCCVEGCSA-N	-1	3	329.378	1.473	20	5		EDBDHM
CSc1cccc(C(=O)NCCCc2cc(=O)[nH][n-]2)c1[N+](=O)[O-]	ZINC000597666282	450181216	/nfs/dbraw/zinc/18/12/16/450181216.db2.gz	WZYCSTSKYCNTIF-UHFFFAOYSA-N	-1	3	336.373	1.703	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](C(C)C)C(C)(C)O	ZINC000619499413	450493161	/nfs/dbraw/zinc/49/31/61/450493161.db2.gz	OECYBTDDAWBKCL-ZDUSSCGKSA-N	-1	3	346.405	1.677	20	5		EDBDHM
C[C@H]1CCN(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000524790148	486871803	/nfs/dbraw/zinc/87/18/03/486871803.db2.gz	HYYOXUKOTLINBI-JTQLQIEISA-N	-1	3	347.824	1.868	20	5		EDBDHM
C[C@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2[O-])C(=O)N1c1cnn(C)c1	ZINC000742392218	579450663	/nfs/dbraw/zinc/45/06/63/579450663.db2.gz	NRISBITWMZAOML-IINYFYTJSA-N	-1	3	345.359	1.318	20	5		EDBDHM
CC(C)(C)[S@@](=O)CCNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000735644089	578907574	/nfs/dbraw/zinc/90/75/74/578907574.db2.gz	UHTOEFSVAFTGTG-QHCPKHFHSA-N	-1	3	338.393	1.734	20	5		EDBDHM
CC(C)(C)[S@@](=O)CCNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000735644089	578907575	/nfs/dbraw/zinc/90/75/75/578907575.db2.gz	UHTOEFSVAFTGTG-QHCPKHFHSA-N	-1	3	338.393	1.734	20	5		EDBDHM
C[C@](O)(CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)c1ccccc1	ZINC000736141425	578956626	/nfs/dbraw/zinc/95/66/26/578956626.db2.gz	JCAIQTKSUVXFNJ-HNNXBMFYSA-N	-1	3	341.331	1.490	20	5		EDBDHM
C[C@](O)(CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)c1ccccc1	ZINC000736141425	578956627	/nfs/dbraw/zinc/95/66/27/578956627.db2.gz	JCAIQTKSUVXFNJ-HNNXBMFYSA-N	-1	3	341.331	1.490	20	5		EDBDHM
CC(C)N(CCC(=O)N(C)CC(=O)[O-])Cc1ccc([N+](=O)[O-])cc1	ZINC000736463528	578991186	/nfs/dbraw/zinc/99/11/86/578991186.db2.gz	PHIMTZIUTGZIJB-UHFFFAOYSA-N	-1	3	337.376	1.738	20	5		EDBDHM
O=C([O-])/C=C\c1ccc(NCCCN2CCC(O)CC2)c([N+](=O)[O-])c1	ZINC000739625411	579227948	/nfs/dbraw/zinc/22/79/48/579227948.db2.gz	PNIVYUSILUQLOT-HYXAFXHYSA-N	-1	3	349.387	1.951	20	5		EDBDHM
CCCCC[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000751988505	579832247	/nfs/dbraw/zinc/83/22/47/579832247.db2.gz	LIUCZFPTTUVFCZ-NSHDSACASA-N	-1	3	344.389	1.995	20	5		EDBDHM
O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCc2c(=O)[n-]cnc2C1	ZINC000753476984	579881104	/nfs/dbraw/zinc/88/11/04/579881104.db2.gz	RLIZXUUEDZUFNT-UHFFFAOYSA-N	-1	3	334.719	1.942	20	5		EDBDHM
CCNC(=O)c1ccccc1NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000776621514	580424452	/nfs/dbraw/zinc/42/44/52/580424452.db2.gz	DAOJCGYPEZVDQL-UHFFFAOYSA-N	-1	3	330.300	1.697	20	5		EDBDHM
CCn1cccc(C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)c1=O	ZINC000788686784	580727998	/nfs/dbraw/zinc/72/79/98/580727998.db2.gz	FTWUMADDWDROJU-UHFFFAOYSA-N	-1	3	343.386	1.316	20	5		EDBDHM
CCCCOC(=O)C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000790852202	580780036	/nfs/dbraw/zinc/78/00/36/580780036.db2.gz	RLQMNBLRSOCXJF-UHFFFAOYSA-N	-1	3	344.389	1.833	20	5		EDBDHM
COc1c([O-])ccc(CN2C[C@@H](C)N(CCO)C[C@H]2C)c1[N+](=O)[O-]	ZINC000894953667	591498513	/nfs/dbraw/zinc/49/85/13/591498513.db2.gz	HDOGLCLPPQDBSE-VXGBXAGGSA-N	-1	3	339.392	1.196	20	5		EDBDHM
O=C([N-]CCO[C@@H]1CCOC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000902980015	592092404	/nfs/dbraw/zinc/09/24/04/592092404.db2.gz	IEAQSURZEUQIKK-GFCCVEGCSA-N	-1	3	346.286	1.488	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@H]23)c([N+](=O)[O-])s1	ZINC000907759184	592780364	/nfs/dbraw/zinc/78/03/64/592780364.db2.gz	CNTHVDBZUDWDBW-BIIVNPBRSA-N	-1	3	330.387	1.419	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCOC(=O)C2CC2)cc1C	ZINC000841537297	593253880	/nfs/dbraw/zinc/25/38/80/593253880.db2.gz	OGWHLKSTMKPDPI-UHFFFAOYSA-N	-1	3	342.373	1.443	20	5		EDBDHM
CN(C)c1ccc(S(=O)(=O)[N-]c2cc([N+](=O)[O-])ccc2F)cn1	ZINC000811824598	593483531	/nfs/dbraw/zinc/48/35/31/593483531.db2.gz	IHPWDYNJWOGCQI-UHFFFAOYSA-N	-1	3	340.336	1.996	20	5		EDBDHM
CC1(C)CCC[C@]1(O)C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000815062301	593612640	/nfs/dbraw/zinc/61/26/40/593612640.db2.gz	HZZHJSWFFODKKE-LBPRGKRZSA-N	-1	3	334.419	1.876	20	5		EDBDHM
CC(C)OC(=O)[C@@H](C)CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820136850	593794320	/nfs/dbraw/zinc/79/43/20/593794320.db2.gz	CLCITYCKWGDLSO-QMMMGPOBSA-N	-1	3	335.324	1.170	20	5		EDBDHM
CC(C)OC(=O)[C@@H](C)CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820136850	593794321	/nfs/dbraw/zinc/79/43/21/593794321.db2.gz	CLCITYCKWGDLSO-QMMMGPOBSA-N	-1	3	335.324	1.170	20	5		EDBDHM
COC(=O)CCN(CC(C)C)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000821661434	593901283	/nfs/dbraw/zinc/90/12/83/593901283.db2.gz	JFPSWXSFZJNBDB-UHFFFAOYSA-N	-1	3	348.363	1.800	20	5		EDBDHM
COC(=O)CCN(CC(C)C)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000821661434	593901286	/nfs/dbraw/zinc/90/12/86/593901286.db2.gz	JFPSWXSFZJNBDB-UHFFFAOYSA-N	-1	3	348.363	1.800	20	5		EDBDHM
CC(C)[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CCO1	ZINC000824215254	593958666	/nfs/dbraw/zinc/95/86/66/593958666.db2.gz	JSYMGJPJQVJBCN-JOYOIKCWSA-N	-1	3	333.352	1.785	20	5		EDBDHM
CC(C)[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CCO1	ZINC000824215254	593958668	/nfs/dbraw/zinc/95/86/68/593958668.db2.gz	JSYMGJPJQVJBCN-JOYOIKCWSA-N	-1	3	333.352	1.785	20	5		EDBDHM
CCO[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)C12CCC2	ZINC000821361431	594027678	/nfs/dbraw/zinc/02/76/78/594027678.db2.gz	USWIONWONJYILS-VXGBXAGGSA-N	-1	3	345.363	1.930	20	5		EDBDHM
CCO[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)C12CCC2	ZINC000821361431	594027680	/nfs/dbraw/zinc/02/76/80/594027680.db2.gz	USWIONWONJYILS-VXGBXAGGSA-N	-1	3	345.363	1.930	20	5		EDBDHM
Cc1nc(NC(=O)Cc2cccc(-c3nnn[n-]3)c2)ccc1[N+](=O)[O-]	ZINC000822450015	594050497	/nfs/dbraw/zinc/05/04/97/594050497.db2.gz	YZXMDJMVPIEYNB-UHFFFAOYSA-N	-1	3	339.315	1.660	20	5		EDBDHM
Cc1nc(NC(=O)Cc2cccc(-c3nn[n-]n3)c2)ccc1[N+](=O)[O-]	ZINC000822450015	594050499	/nfs/dbraw/zinc/05/04/99/594050499.db2.gz	YZXMDJMVPIEYNB-UHFFFAOYSA-N	-1	3	339.315	1.660	20	5		EDBDHM
C[C@@H](Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000824650397	594050717	/nfs/dbraw/zinc/05/07/17/594050717.db2.gz	RENQEDXPJBANQY-MRVPVSSYSA-N	-1	3	334.336	1.917	20	5		EDBDHM
C[C@@H](Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000824650397	594050718	/nfs/dbraw/zinc/05/07/18/594050718.db2.gz	RENQEDXPJBANQY-MRVPVSSYSA-N	-1	3	334.336	1.917	20	5		EDBDHM
CC1(C)C[C@H](Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)C(C)(C)O1	ZINC000824796046	594076261	/nfs/dbraw/zinc/07/62/61/594076261.db2.gz	LXOOWBWGLCDJHA-JTQLQIEISA-N	-1	3	333.352	1.928	20	5		EDBDHM
CC1(C)C[C@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)C(C)(C)O1	ZINC000824796046	594076262	/nfs/dbraw/zinc/07/62/62/594076262.db2.gz	LXOOWBWGLCDJHA-JTQLQIEISA-N	-1	3	333.352	1.928	20	5		EDBDHM
Cn1cc(-c2nnn[n-]2)cc1C(=O)OCc1ccccc1[N+](=O)[O-]	ZINC000822665333	594081611	/nfs/dbraw/zinc/08/16/11/594081611.db2.gz	ODYQJPZJLRVBKP-UHFFFAOYSA-N	-1	3	328.288	1.470	20	5		EDBDHM
Cn1cc(-c2nn[n-]n2)cc1C(=O)OCc1ccccc1[N+](=O)[O-]	ZINC000822665333	594081613	/nfs/dbraw/zinc/08/16/13/594081613.db2.gz	ODYQJPZJLRVBKP-UHFFFAOYSA-N	-1	3	328.288	1.470	20	5		EDBDHM
Nc1nc(Oc2cc(Cl)ccc2-c2nnn[n-]2)ncc1[N+](=O)[O-]	ZINC000822907571	594120272	/nfs/dbraw/zinc/12/02/72/594120272.db2.gz	TVIYLNDWWWYKNI-UHFFFAOYSA-N	-1	3	334.683	1.593	20	5		EDBDHM
Nc1nc(Oc2cc(Cl)ccc2-c2nn[n-]n2)ncc1[N+](=O)[O-]	ZINC000822907571	594120273	/nfs/dbraw/zinc/12/02/73/594120273.db2.gz	TVIYLNDWWWYKNI-UHFFFAOYSA-N	-1	3	334.683	1.593	20	5		EDBDHM
O=C(CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)OC1CCCCC1	ZINC000823014861	594137591	/nfs/dbraw/zinc/13/75/91/594137591.db2.gz	WTKGQCJKOBOXGY-UHFFFAOYSA-N	-1	3	347.335	1.458	20	5		EDBDHM
CCN(CC)C(=O)CSc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000825406114	594180103	/nfs/dbraw/zinc/18/01/03/594180103.db2.gz	KCTIQRDRJGUCSX-UHFFFAOYSA-N	-1	3	336.377	1.735	20	5		EDBDHM
CCN(CC)C(=O)CSc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000825406114	594180104	/nfs/dbraw/zinc/18/01/04/594180104.db2.gz	KCTIQRDRJGUCSX-UHFFFAOYSA-N	-1	3	336.377	1.735	20	5		EDBDHM
O=[N+]([O-])c1ccnn1Cc1ccc(-c2nnn[n-]2)cc1OC(F)F	ZINC000823647539	594224516	/nfs/dbraw/zinc/22/45/16/594224516.db2.gz	LTSCFYVDPZNKJR-UHFFFAOYSA-N	-1	3	337.246	1.621	20	5		EDBDHM
O=[N+]([O-])c1ccnn1Cc1ccc(-c2nn[n-]n2)cc1OC(F)F	ZINC000823647539	594224517	/nfs/dbraw/zinc/22/45/17/594224517.db2.gz	LTSCFYVDPZNKJR-UHFFFAOYSA-N	-1	3	337.246	1.621	20	5		EDBDHM
CN(C[C@@H](O)C(F)(F)F)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825902002	594273394	/nfs/dbraw/zinc/27/33/94/594273394.db2.gz	NJWXTCFOTOAUEN-SECBINFHSA-N	-1	3	332.242	1.134	20	5		EDBDHM
CN(C[C@@H](O)C(F)(F)F)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825902002	594273395	/nfs/dbraw/zinc/27/33/95/594273395.db2.gz	NJWXTCFOTOAUEN-SECBINFHSA-N	-1	3	332.242	1.134	20	5		EDBDHM
CNC(=O)[C@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000826060189	594321448	/nfs/dbraw/zinc/32/14/48/594321448.db2.gz	IKROKTKBDJUFDC-GXSJLCMTSA-N	-1	3	331.336	1.102	20	5		EDBDHM
CNC(=O)[C@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000826060189	594321451	/nfs/dbraw/zinc/32/14/51/594321451.db2.gz	IKROKTKBDJUFDC-GXSJLCMTSA-N	-1	3	331.336	1.102	20	5		EDBDHM
O=C([O-])N1CCC[C@@H]1[C@@H]1CCCCN1CCn1cc([N+](=O)[O-])cn1	ZINC000831998287	594717976	/nfs/dbraw/zinc/71/79/76/594717976.db2.gz	TULZRZPOXIJMES-UONOGXRCSA-N	-1	3	337.380	1.788	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1cc([N+](=O)[O-])cc(Cl)c1F)N(C)C	ZINC000832401042	594747764	/nfs/dbraw/zinc/74/77/64/594747764.db2.gz	QRAZERVSKLSFDS-ZETCQYMHSA-N	-1	3	339.776	1.616	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CCC2(CO)CC2)c1	ZINC000832451228	594751359	/nfs/dbraw/zinc/75/13/59/594751359.db2.gz	WASJRAXMNWIDKH-UHFFFAOYSA-N	-1	3	348.808	1.998	20	5		EDBDHM
CS(=O)(=O)c1ccc(C(=O)[N-]OC2CCCCC2)c([N+](=O)[O-])c1	ZINC000836785207	594997590	/nfs/dbraw/zinc/99/75/90/594997590.db2.gz	YECDTLUNLUELDF-UHFFFAOYSA-N	-1	3	342.373	1.992	20	5		EDBDHM
COCC[C@H](COC)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848589225	595411211	/nfs/dbraw/zinc/41/12/11/595411211.db2.gz	ICJSBNFGERLDMO-SNVBAGLBSA-N	-1	3	348.302	1.734	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(OC)OC	ZINC000849405152	595521380	/nfs/dbraw/zinc/52/13/80/595521380.db2.gz	DXADGBOTWAXKDA-SNVBAGLBSA-N	-1	3	332.378	1.579	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C(OC)OC	ZINC000849406386	595521597	/nfs/dbraw/zinc/52/15/97/595521597.db2.gz	JNFVXOKDJPHKTR-LBPRGKRZSA-N	-1	3	332.378	1.412	20	5		EDBDHM
C[C@H]([N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1)C1(CO)CC1	ZINC000853829542	595894527	/nfs/dbraw/zinc/89/45/27/595894527.db2.gz	FKCYFKIJMAAGIJ-VIFPVBQESA-N	-1	3	330.287	1.844	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@@H](O)c2ccc(F)cc2)cs1	ZINC000119810131	596743664	/nfs/dbraw/zinc/74/36/64/596743664.db2.gz	LIKRKQLSQSFIQR-LLVKDONJSA-N	-1	3	346.361	1.807	20	5		EDBDHM
O=[N+]([O-])c1ccc[n-]c1=NNS(=O)(=O)c1cccc2ncccc21	ZINC000125496903	596918006	/nfs/dbraw/zinc/91/80/06/596918006.db2.gz	QYNKQHSXMFAWJM-UHFFFAOYSA-N	-1	3	345.340	1.843	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H]1C[C@H]2CCC[C@H]2O1	ZINC000872555898	596963219	/nfs/dbraw/zinc/96/32/19/596963219.db2.gz	JHPNRGXJOVTGCZ-NTZNESFSSA-N	-1	3	326.374	1.831	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@@H](c3cc[nH]n3)C2)c(-c2nnn[n-]2)c1	ZINC000738370972	598500167	/nfs/dbraw/zinc/50/01/67/598500167.db2.gz	ZIXSVHCRZYOXPS-SECBINFHSA-N	-1	3	341.335	1.277	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@@H](c3cc[nH]n3)C2)c(-c2nn[n-]n2)c1	ZINC000738370972	598500170	/nfs/dbraw/zinc/50/01/70/598500170.db2.gz	ZIXSVHCRZYOXPS-SECBINFHSA-N	-1	3	341.335	1.277	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@@H]2Cn2cccn2)c(-c2nnn[n-]2)c1	ZINC000738368669	598502655	/nfs/dbraw/zinc/50/26/55/598502655.db2.gz	HWTKOIBVTRUZDH-SNVBAGLBSA-N	-1	3	341.335	1.035	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@@H]2Cn2cccn2)c(-c2nn[n-]n2)c1	ZINC000738368669	598502656	/nfs/dbraw/zinc/50/26/56/598502656.db2.gz	HWTKOIBVTRUZDH-SNVBAGLBSA-N	-1	3	341.335	1.035	20	5		EDBDHM
CN(C(=O)CCn1cc([N+](=O)[O-])cn1)c1ccccc1-c1nnn[n-]1	ZINC000821570558	606969183	/nfs/dbraw/zinc/96/91/83/606969183.db2.gz	AHLLYJYSUHGKNE-UHFFFAOYSA-N	-1	3	342.319	1.025	20	5		EDBDHM
CN(C(=O)CCn1cc([N+](=O)[O-])cn1)c1ccccc1-c1nn[n-]n1	ZINC000821570558	606969184	/nfs/dbraw/zinc/96/91/84/606969184.db2.gz	AHLLYJYSUHGKNE-UHFFFAOYSA-N	-1	3	342.319	1.025	20	5		EDBDHM
O=[N+]([O-])c1ccc(CS(=O)(=O)[N-][C@H](CCO)c2ccco2)cc1	ZINC000184277323	235353511	/nfs/dbraw/zinc/35/35/11/235353511.db2.gz	DYNHJJJVBBFDKK-CYBMUJFWSA-N	-1	3	340.357	1.731	20	5		EDBDHM
Cn1ncc2c1ncc(C(=O)NCCc1ccc([N+](=O)[O-])cc1)c2[O-]	ZINC000132606197	138379621	/nfs/dbraw/zinc/37/96/21/138379621.db2.gz	WVFLDXQWOJSUFI-UHFFFAOYSA-N	-1	3	341.327	1.555	20	5		EDBDHM
C[C@H]1CCCN(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000066333478	201157426	/nfs/dbraw/zinc/15/74/26/201157426.db2.gz	OSAGVNJFMSVYST-JTQLQIEISA-N	-1	3	333.435	1.667	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)CC(C)(C)O)c([N+](=O)[O-])c1	ZINC000295619967	201351294	/nfs/dbraw/zinc/35/12/94/201351294.db2.gz	ZBESFSJDMYZRQP-VIFPVBQESA-N	-1	3	332.378	1.431	20	5		EDBDHM
CN(CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C1CCCC1	ZINC000104755460	204118320	/nfs/dbraw/zinc/11/83/20/204118320.db2.gz	FEFVAGMGNMEHNJ-UHFFFAOYSA-N	-1	3	345.396	1.887	20	5		EDBDHM
COc1cnc(C(=O)[N-]c2cc3c(cc2[N+](=O)[O-])OCCCO3)nc1	ZINC000459893050	255008422	/nfs/dbraw/zinc/00/84/22/255008422.db2.gz	BELAVMLXUKGEKV-UHFFFAOYSA-N	-1	3	346.299	1.807	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCCC[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000269308621	139913276	/nfs/dbraw/zinc/91/32/76/139913276.db2.gz	VCVGIOKARBDPNV-PWSUYJOCSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CCC[C@@H](CCO)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000269880619	140011440	/nfs/dbraw/zinc/01/14/40/140011440.db2.gz	WABALHMZGFBLCJ-NSHDSACASA-N	-1	3	346.405	1.680	20	5		EDBDHM
Nc1c(=O)[n-]c(=O)[nH]c1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000270949202	140205899	/nfs/dbraw/zinc/20/58/99/140205899.db2.gz	OTESOILUSDVIOQ-UHFFFAOYSA-N	-1	3	345.315	1.183	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H](CO)C(C)C	ZINC000344826494	143016768	/nfs/dbraw/zinc/01/67/68/143016768.db2.gz	KEYFMDQWELHVNV-SNVBAGLBSA-N	-1	3	332.378	1.146	20	5		EDBDHM
CNC(=O)[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000345510814	143100186	/nfs/dbraw/zinc/10/01/86/143100186.db2.gz	NUPKZNSSTSLXNF-MNOVXSKESA-N	-1	3	341.389	1.096	20	5		EDBDHM
O=[N+]([O-])c1ccc(CS(=O)(=O)[N-][C@@H](CO)c2ccsc2)cc1	ZINC000351575603	143582496	/nfs/dbraw/zinc/58/24/96/143582496.db2.gz	IFAAWTFALWVXKH-ZDUSSCGKSA-N	-1	3	342.398	1.809	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H](C)C(=O)N2CCCC2)cc1[N+](=O)[O-]	ZINC000353208727	149325519	/nfs/dbraw/zinc/32/55/19/149325519.db2.gz	ZFKODBBQHCCICQ-QMMMGPOBSA-N	-1	3	347.418	1.254	20	5		EDBDHM
COC[C@@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])OC	ZINC000358500457	151397339	/nfs/dbraw/zinc/39/73/39/151397339.db2.gz	MMEFRWZEJZTRDI-SECBINFHSA-N	-1	3	338.769	1.188	20	5		EDBDHM
COc1cc(C(=O)NCc2nnc(C(F)(F)F)[n-]2)ccc1[N+](=O)[O-]	ZINC000361015087	152279909	/nfs/dbraw/zinc/27/99/09/152279909.db2.gz	ZFXHXDXDDRUGHP-UHFFFAOYSA-N	-1	3	345.237	1.670	20	5		EDBDHM
COc1cc(C(=O)NCc2n[n-]c(C(F)(F)F)n2)ccc1[N+](=O)[O-]	ZINC000361015087	152279911	/nfs/dbraw/zinc/27/99/11/152279911.db2.gz	ZFXHXDXDDRUGHP-UHFFFAOYSA-N	-1	3	345.237	1.670	20	5		EDBDHM
COc1cc(C(=O)NCc2nc(C(F)(F)F)n[n-]2)ccc1[N+](=O)[O-]	ZINC000361015087	152279913	/nfs/dbraw/zinc/27/99/13/152279913.db2.gz	ZFXHXDXDDRUGHP-UHFFFAOYSA-N	-1	3	345.237	1.670	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-][C@H]1CCO[C@H]1C1CC1	ZINC000363977347	153112270	/nfs/dbraw/zinc/11/22/70/153112270.db2.gz	OMRVEVVKNLVWTL-JSGCOSHPSA-N	-1	3	326.374	1.582	20	5		EDBDHM
O=C(c1ccc(O)cc1[O-])N1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000364326903	153206174	/nfs/dbraw/zinc/20/61/74/153206174.db2.gz	WUEGRJHSDGIKCD-SNVBAGLBSA-N	-1	3	332.316	1.680	20	5		EDBDHM
COCC[C@H](COC)[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000352521760	162228272	/nfs/dbraw/zinc/22/82/72/162228272.db2.gz	KXRSQRUMHSRDSH-SECBINFHSA-N	-1	3	338.407	1.295	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](CO)C2CC2)cc1C	ZINC000352559074	162254315	/nfs/dbraw/zinc/25/43/15/162254315.db2.gz	GIHBYOXGISFSNA-GFCCVEGCSA-N	-1	3	328.390	1.508	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]C[C@@H]2CCC[C@@H]2O)cc1[N+](=O)[O-]	ZINC000274718954	268190613	/nfs/dbraw/zinc/19/06/13/268190613.db2.gz	BSQBNNKIMPGRGA-ZANVPECISA-N	-1	3	332.353	1.482	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2=CCN(C)CC2)cc1C	ZINC000273990211	273065273	/nfs/dbraw/zinc/06/52/73/273065273.db2.gz	RNHSBQVKAUPNLA-UHFFFAOYSA-N	-1	3	339.417	1.752	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2CCCOC2)cc1[N+](=O)[O-]	ZINC000275078984	273100007	/nfs/dbraw/zinc/10/00/07/273100007.db2.gz	NBOAPZBGPPYCLQ-QMMMGPOBSA-N	-1	3	334.325	1.200	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCC[C@H]1CCO	ZINC000275154966	273103900	/nfs/dbraw/zinc/10/39/00/273103900.db2.gz	HLIQFNNRBWYEPY-CMPLNLGQSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CN(C)C1(C[N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CCC1	ZINC000319047992	282043430	/nfs/dbraw/zinc/04/34/30/282043430.db2.gz	CSPLDHUHMOYBKH-UHFFFAOYSA-N	-1	3	331.369	1.497	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl)C(N)=O	ZINC000292045455	289247841	/nfs/dbraw/zinc/24/78/41/289247841.db2.gz	GBUQHTPXWFHCTG-SSDOTTSWSA-N	-1	3	335.769	1.099	20	5		EDBDHM
Cc1cc(C(=O)N2CCS[C@@H]3COCC[C@@H]32)c([N+](=O)[O-])c(=O)[n-]1	ZINC000368553760	301112633	/nfs/dbraw/zinc/11/26/33/301112633.db2.gz	QKGRJPITDGVMRO-WDEREUQCSA-N	-1	3	339.373	1.350	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCCCC[C@H]1O	ZINC000287475842	302048209	/nfs/dbraw/zinc/04/82/09/302048209.db2.gz	PZZKZLUNAQPJEY-DGCLKSJQSA-N	-1	3	328.390	1.875	20	5		EDBDHM
COC(=O)[C@H]1CC[C@@H]([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C1	ZINC000433459251	305109948	/nfs/dbraw/zinc/10/99/48/305109948.db2.gz	KPUCBCMXDDDJDK-DTWKUNHWSA-N	-1	3	348.402	1.585	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)Nc2cccc(C(=O)OC)c2[O-])n1	ZINC000436815875	305167712	/nfs/dbraw/zinc/16/77/12/305167712.db2.gz	MROJORABHKJBLN-UHFFFAOYSA-N	-1	3	334.288	1.556	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2cccc(C(=O)OC)c2O)n1	ZINC000436815875	305167713	/nfs/dbraw/zinc/16/77/13/305167713.db2.gz	MROJORABHKJBLN-UHFFFAOYSA-N	-1	3	334.288	1.556	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)[C@H](O)C(F)F	ZINC000451706392	305363420	/nfs/dbraw/zinc/36/34/20/305363420.db2.gz	GGPBWASTEJZVBA-MUWHJKNJSA-N	-1	3	344.361	1.648	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)Cn1cccn1	ZINC000045742110	441026934	/nfs/dbraw/zinc/02/69/34/441026934.db2.gz	KSNCDDUBAHNMSZ-JTQLQIEISA-N	-1	3	340.361	1.167	20	5		EDBDHM
C[N-]S(=O)(=O)c1ccc(CNc2ccncc2[N+](=O)[O-])s1	ZINC000060375274	441239290	/nfs/dbraw/zinc/23/92/90/441239290.db2.gz	XEOVPQKAIHCQDM-UHFFFAOYSA-N	-1	3	328.375	1.572	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)[C@@H]1CCCO1	ZINC000028327325	441431396	/nfs/dbraw/zinc/43/13/96/441431396.db2.gz	YESJDHVNHKJSHQ-ONGXEEELSA-N	-1	3	330.362	1.449	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cnc1N1CCN(C(=O)c2ccccc2[O-])CC1	ZINC000089589227	441560807	/nfs/dbraw/zinc/56/08/07/441560807.db2.gz	MIYXATOXDMOTLO-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)[C@@H]1CCCO1	ZINC000032433334	441556379	/nfs/dbraw/zinc/55/63/79/441556379.db2.gz	WWFHWAJNRXHFEO-KOLCDFICSA-N	-1	3	330.362	1.449	20	5		EDBDHM
Cc1cccc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)n1	ZINC000055276975	441636172	/nfs/dbraw/zinc/63/61/72/441636172.db2.gz	DTYKBRGTCDSCFI-UHFFFAOYSA-N	-1	3	325.321	1.916	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCCC(C)(C)CO)c([N+](=O)[O-])c1	ZINC000121706058	441763577	/nfs/dbraw/zinc/76/35/77/441763577.db2.gz	ZCAGCPSRVPZLNK-UHFFFAOYSA-N	-1	3	330.406	1.980	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@H]1CCC[C@H](O)C1	ZINC000121829440	441789526	/nfs/dbraw/zinc/78/95/26/441789526.db2.gz	KXQBGHOXUXZQQX-RYUDHWBXSA-N	-1	3	328.390	1.733	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2ccccc2CO)c(F)c1	ZINC000159750597	441834894	/nfs/dbraw/zinc/83/48/94/441834894.db2.gz	UKMDCHUJDGUTOW-UHFFFAOYSA-N	-1	3	340.332	1.705	20	5		EDBDHM
CC[C@@H](C)[C@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000119399934	441932734	/nfs/dbraw/zinc/93/27/34/441932734.db2.gz	HAOIKCXDAQGJAE-LDYMZIIASA-N	-1	3	336.797	1.934	20	5		EDBDHM
Cc1nnc(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])n1C1CC1	ZINC000133956209	442442795	/nfs/dbraw/zinc/44/27/95/442442795.db2.gz	FQCAUYHSNUFXHI-UHFFFAOYSA-N	-1	3	337.361	1.308	20	5		EDBDHM
CC(C)[C@](C)(O)C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000178744527	442471817	/nfs/dbraw/zinc/47/18/17/442471817.db2.gz	DQUZVDQPPWOJBS-GFCCVEGCSA-N	-1	3	336.797	1.934	20	5		EDBDHM
CC(C)(C)C[C@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000178775467	442481933	/nfs/dbraw/zinc/48/19/33/442481933.db2.gz	PEQWRXFWTFFXPM-JTQLQIEISA-N	-1	3	334.369	1.809	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]Cc2ncn(C)n2)c1	ZINC000180276382	442572270	/nfs/dbraw/zinc/57/22/70/442572270.db2.gz	OPKKWCXXHHORIO-UHFFFAOYSA-N	-1	3	345.768	1.164	20	5		EDBDHM
Cn1c(=O)oc2cc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)ccc21	ZINC000188397340	442746412	/nfs/dbraw/zinc/74/64/12/442746412.db2.gz	HHIIBCBPRUKURF-UHFFFAOYSA-N	-1	3	330.256	1.393	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2C(=O)NCC[C@H]2C)cc1C	ZINC000195476195	443022053	/nfs/dbraw/zinc/02/20/53/443022053.db2.gz	ZUSBLSSTKQWJON-OQPBUACISA-N	-1	3	341.389	1.015	20	5		EDBDHM
C[C@H]1CN(C2CC2)C[C@@H]1[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000268816953	443117305	/nfs/dbraw/zinc/11/73/05/443117305.db2.gz	WCRQFZUCILVWHA-CABZTGNLSA-N	-1	3	343.380	1.495	20	5		EDBDHM
O=C(Cn1cc([N-]c2ncc(Cl)cc2[N+](=O)[O-])cn1)NC1CC1	ZINC000269353035	443290434	/nfs/dbraw/zinc/29/04/34/443290434.db2.gz	GOHBTNJGFJXHDR-UHFFFAOYSA-N	-1	3	336.739	1.862	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H](C)C(=O)OC(C)C	ZINC000266853301	443268176	/nfs/dbraw/zinc/26/81/76/443268176.db2.gz	SELCXJRSHRNXCQ-LLVKDONJSA-N	-1	3	344.389	1.769	20	5		EDBDHM
CC[C@](C)([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)C(=O)OC	ZINC000443709305	320110157	/nfs/dbraw/zinc/11/01/57/320110157.db2.gz	NPBJTLXDGBIQCL-ZDUSSCGKSA-N	-1	3	330.362	1.356	20	5		EDBDHM
C[C@@]1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)NC(=O)[N-]C1=O	ZINC000518248425	320455250	/nfs/dbraw/zinc/45/52/50/320455250.db2.gz	QKABTHNJVVJYHN-HNNXBMFYSA-N	-1	3	344.283	1.495	20	5		EDBDHM
O=C([O-])CN1CCCN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1	ZINC000580315278	322036316	/nfs/dbraw/zinc/03/63/16/322036316.db2.gz	BADMPCZATGSRNI-UHFFFAOYSA-N	-1	3	348.281	1.605	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCCN(C)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000343982694	444708670	/nfs/dbraw/zinc/70/86/70/444708670.db2.gz	ORJPWIDAPGNQAH-PWSUYJOCSA-N	-1	3	343.405	1.364	20	5		EDBDHM
CSC[C@@H](CCO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000342489959	444713017	/nfs/dbraw/zinc/71/30/17/444713017.db2.gz	GBKVGWVQUIEQCH-MRVPVSSYSA-N	-1	3	340.448	1.357	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCc2cnccn2)c(Cl)c1	ZINC000341198358	444724638	/nfs/dbraw/zinc/72/46/38/444724638.db2.gz	WGXZDZRKJZKQJK-UHFFFAOYSA-N	-1	3	342.764	1.559	20	5		EDBDHM
CN(C)c1nccc(C[N-]c2nc(-c3ccc([N+](=O)[O-])cc3)no2)n1	ZINC000342793162	444869416	/nfs/dbraw/zinc/86/94/16/444869416.db2.gz	YPXAIDJXWDIURZ-UHFFFAOYSA-N	-1	3	341.331	2.113	20	5		EDBDHM
C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ncccc1[O-]	ZINC000341906573	445065293	/nfs/dbraw/zinc/06/52/93/445065293.db2.gz	YVWRFXHOXWYIOQ-SECBINFHSA-N	-1	3	330.300	1.452	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@]1(C)CCOC1	ZINC000354500822	445265541	/nfs/dbraw/zinc/26/55/41/445265541.db2.gz	SRAMACPARVOAJY-ZDUSSCGKSA-N	-1	3	330.362	1.308	20	5		EDBDHM
O=C(Nc1ccc2c(=O)cc[nH]c2c1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000357113334	445435423	/nfs/dbraw/zinc/43/54/23/445435423.db2.gz	TWLRQVWDRXVOGO-UHFFFAOYSA-N	-1	3	326.268	1.789	20	5		EDBDHM
CCC[C@@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(=O)OC	ZINC000358592391	445664848	/nfs/dbraw/zinc/66/48/48/445664848.db2.gz	AXODKWBGJXLMOP-LLVKDONJSA-N	-1	3	344.389	1.832	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CC[C@H](OC)C2)cc1[N+](=O)[O-]	ZINC000349971525	445738604	/nfs/dbraw/zinc/73/86/04/445738604.db2.gz	UWGLCFDZIPBYDC-BDAKNGLRSA-N	-1	3	348.352	1.588	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC[C@H](O)C(F)(F)F)cc1	ZINC000349974135	445739713	/nfs/dbraw/zinc/73/97/13/445739713.db2.gz	LYCWZMGMSWOCQR-VIFPVBQESA-N	-1	3	328.268	1.186	20	5		EDBDHM
O=[N+]([O-])c1cccc(S(=O)(=O)[N-]CC[C@@H](O)C(F)(F)F)c1	ZINC000350005179	445747217	/nfs/dbraw/zinc/74/72/17/445747217.db2.gz	DWTPHADUNCSWMM-SECBINFHSA-N	-1	3	328.268	1.186	20	5		EDBDHM
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H]1OC	ZINC000358912215	445844816	/nfs/dbraw/zinc/84/48/16/445844816.db2.gz	YPCYCVSACXWTIH-MCIONIFRSA-N	-1	3	344.389	1.207	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC2(CC(N)=O)CC2)c1[N+](=O)[O-]	ZINC000420698881	446756678	/nfs/dbraw/zinc/75/66/78/446756678.db2.gz	AUWJMJFZHKPVBI-UHFFFAOYSA-N	-1	3	341.389	1.146	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC[C@H](O)C(C)C	ZINC000443248736	447014339	/nfs/dbraw/zinc/01/43/39/447014339.db2.gz	LCWKLWVHCWKVCH-NSHDSACASA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000427150602	447553160	/nfs/dbraw/zinc/55/31/60/447553160.db2.gz	QWIZLSOXHIOQNB-UHFFFAOYSA-N	-1	3	334.244	1.085	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H](CO)CC(F)F)cc1[N+](=O)[O-]	ZINC000428419926	447699748	/nfs/dbraw/zinc/69/97/48/447699748.db2.gz	MYHYOOHVEXIQTD-LURJTMIESA-N	-1	3	330.334	1.259	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCC2(CO)CC2)c1[N+](=O)[O-]	ZINC000451940298	447792908	/nfs/dbraw/zinc/79/29/08/447792908.db2.gz	UDTQGNZAUIFKQA-UHFFFAOYSA-N	-1	3	328.390	1.653	20	5		EDBDHM
CCOC(=O)c1[n-]c(C)nc1NC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000525150612	447969030	/nfs/dbraw/zinc/96/90/30/447969030.db2.gz	FCKSAMBNYZVBEF-UHFFFAOYSA-N	-1	3	332.316	1.984	20	5		EDBDHM
CCOC(=O)c1nc(C)[n-]c1NC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000525150612	447969033	/nfs/dbraw/zinc/96/90/33/447969033.db2.gz	FCKSAMBNYZVBEF-UHFFFAOYSA-N	-1	3	332.316	1.984	20	5		EDBDHM
C[C@H]1CN(CCCNc2nccc(C(=O)[O-])c2[N+](=O)[O-])CCCO1	ZINC000582912223	448379651	/nfs/dbraw/zinc/37/96/51/448379651.db2.gz	WQULIIGBAMBVQX-NSHDSACASA-N	-1	3	338.364	1.601	20	5		EDBDHM
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)[C@@H]1SC	ZINC000593612934	449108695	/nfs/dbraw/zinc/10/86/95/449108695.db2.gz	KDPWYOUPZGJCEK-FOGDFJRCSA-N	-1	3	347.418	1.177	20	5		EDBDHM
COC(=O)[C@@H](CCF)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000593634804	449121468	/nfs/dbraw/zinc/12/14/68/449121468.db2.gz	ZGFRQVSYXPXLFY-SECBINFHSA-N	-1	3	334.325	1.083	20	5		EDBDHM
CCCn1cc(C(=O)[N-]c2n[nH]c(-c3cccc([N+](=O)[O-])c3)n2)nn1	ZINC000611238614	449231669	/nfs/dbraw/zinc/23/16/69/449231669.db2.gz	QEFHWGMJOQELQO-UHFFFAOYSA-N	-1	3	342.319	1.634	20	5		EDBDHM
Cc1nc(C)c(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)s1	ZINC000593551609	449342182	/nfs/dbraw/zinc/34/21/82/449342182.db2.gz	AZKDNUPDCMBFBN-UHFFFAOYSA-N	-1	3	328.375	1.542	20	5		EDBDHM
CC(C)CC[C@](C)(O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593558273	449348227	/nfs/dbraw/zinc/34/82/27/449348227.db2.gz	UANFCGXYNMKWCE-ZDUSSCGKSA-N	-1	3	331.394	1.455	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)N1CCC(C)CC1	ZINC000593536476	449332088	/nfs/dbraw/zinc/33/20/88/449332088.db2.gz	RFWAKEHHSPFNAL-LBPRGKRZSA-N	-1	3	342.421	1.389	20	5		EDBDHM
CCN1CCCC[C@@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593541279	449334613	/nfs/dbraw/zinc/33/46/13/449334613.db2.gz	JVFBGKVCSGZIQK-LLVKDONJSA-N	-1	3	328.394	1.143	20	5		EDBDHM
CC(C)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)c1nccs1	ZINC000593546759	449339293	/nfs/dbraw/zinc/33/92/93/449339293.db2.gz	OBNJFOFBHZSJAU-UHFFFAOYSA-N	-1	3	328.375	1.660	20	5		EDBDHM
CO[C@@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)c2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000600628694	449465616	/nfs/dbraw/zinc/46/56/16/449465616.db2.gz	JWGDBYTURLSUGZ-VHDGCEQUSA-N	-1	3	349.387	1.672	20	5		EDBDHM
CC1([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC=CC1	ZINC000594473538	449539004	/nfs/dbraw/zinc/53/90/04/449539004.db2.gz	LFPLLWCUIIMCGS-UHFFFAOYSA-N	-1	3	340.357	1.753	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2n[nH]c(C(F)(F)F)c2C)n1	ZINC000617403655	449592438	/nfs/dbraw/zinc/59/24/38/449592438.db2.gz	IEVGQBZXBPNPPK-UHFFFAOYSA-N	-1	3	332.242	2.114	20	5		EDBDHM
CN1CC[C@H]([N-]S(=O)(=O)c2ccc3ncccc3c2[N+](=O)[O-])C1	ZINC000594749881	449665859	/nfs/dbraw/zinc/66/58/59/449665859.db2.gz	CTYYHSCSOTZWKE-JTQLQIEISA-N	-1	3	336.373	1.125	20	5		EDBDHM
COC1CC(CC[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000594788980	449698217	/nfs/dbraw/zinc/69/82/17/449698217.db2.gz	HKXUMNYCDMONMN-UHFFFAOYSA-N	-1	3	328.390	1.997	20	5		EDBDHM
CC(C)(C)N1CC[C@@H](C[N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])C1	ZINC000594790547	449699474	/nfs/dbraw/zinc/69/94/74/449699474.db2.gz	MPKBCRZLWHBACM-NSHDSACASA-N	-1	3	342.421	1.389	20	5		EDBDHM
C[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc3ncccc3c2[N+](=O)[O-])CO1	ZINC000594794101	449704553	/nfs/dbraw/zinc/70/45/53/449704553.db2.gz	JRQNFTDNIGVMLZ-UWVGGRQHSA-N	-1	3	337.357	1.599	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CC(O)(C2CC2)C2CC2)cc1[N+](=O)[O-]	ZINC000594867154	449782750	/nfs/dbraw/zinc/78/27/50/449782750.db2.gz	XYMIYDFUOCRMRW-UHFFFAOYSA-N	-1	3	346.430	1.794	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN(C)C2CC2)c(F)cc1[N+](=O)[O-]	ZINC000601319298	449827301	/nfs/dbraw/zinc/82/73/01/449827301.db2.gz	ZBRSIKXUCNBSKU-UHFFFAOYSA-N	-1	3	331.369	1.415	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCOCC2CC2)c(F)cc1[N+](=O)[O-]	ZINC000601339733	449848690	/nfs/dbraw/zinc/84/86/90/449848690.db2.gz	GKVPDCSYVFORGF-UHFFFAOYSA-N	-1	3	332.353	1.747	20	5		EDBDHM
C[C@H]1O[C@@H](C)[C@H](C)[C@H]1[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000599459383	449991925	/nfs/dbraw/zinc/99/19/25/449991925.db2.gz	IJZJURCFUHFBRH-KZWBYHQPSA-N	-1	3	328.390	1.826	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CO[C@@H](C2CC2)C1	ZINC000599481223	450008281	/nfs/dbraw/zinc/00/82/81/450008281.db2.gz	BLBLTZRYFFVRFN-WCQYABFASA-N	-1	3	326.374	1.749	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2C(=O)NCC2(C)C)c1C	ZINC000595355677	450070493	/nfs/dbraw/zinc/07/04/93/450070493.db2.gz	WJWAKNZLOLXCMI-GFCCVEGCSA-N	-1	3	341.389	1.015	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)c2nccn2C)c1C	ZINC000595382945	450097399	/nfs/dbraw/zinc/09/73/99/450097399.db2.gz	MBXFRHDGTRYDNX-LLVKDONJSA-N	-1	3	338.389	1.985	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1C[N-]c1nnc(C(F)F)o1)OCCO2	ZINC000615781421	450237238	/nfs/dbraw/zinc/23/72/38/450237238.db2.gz	NXWJEXLQZHVMQT-UHFFFAOYSA-N	-1	3	328.231	2.299	20	5		EDBDHM
COC(=O)c1ccc(S(=O)(=O)[N-][C@H]2CC[C@@H](F)C2)cc1[N+](=O)[O-]	ZINC000416491531	491008964	/nfs/dbraw/zinc/00/89/64/491008964.db2.gz	ZOFMXWFFXMKJDT-BDAKNGLRSA-N	-1	3	346.336	1.550	20	5		EDBDHM
COc1ccc(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1O	ZINC000352864261	536895418	/nfs/dbraw/zinc/89/54/18/536895418.db2.gz	ZRCUTJNQZQOGNM-UHFFFAOYSA-N	-1	3	338.341	1.788	20	5		EDBDHM
CC[S@](=O)CC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000733898811	578787710	/nfs/dbraw/zinc/78/77/10/578787710.db2.gz	SQNSZYLVFCLYTQ-IBGZPJMESA-N	-1	3	340.810	1.295	20	5		EDBDHM
COc1cccc(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)c1O	ZINC000737132811	579050619	/nfs/dbraw/zinc/05/06/19/579050619.db2.gz	QZDYXAMKUQKFQI-UHFFFAOYSA-N	-1	3	343.303	1.496	20	5		EDBDHM
COc1cccc(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)c1O	ZINC000737132811	579050620	/nfs/dbraw/zinc/05/06/20/579050620.db2.gz	QZDYXAMKUQKFQI-UHFFFAOYSA-N	-1	3	343.303	1.496	20	5		EDBDHM
Cc1ccnc(NCCNc2ncccc2-c2nnn[n-]2)c1[N+](=O)[O-]	ZINC000737436140	579091020	/nfs/dbraw/zinc/09/10/20/579091020.db2.gz	FMQWAUODSPTSTI-UHFFFAOYSA-N	-1	3	341.335	1.397	20	5		EDBDHM
Cc1ccnc(NCCNc2ncccc2-c2nn[n-]n2)c1[N+](=O)[O-]	ZINC000737436140	579091021	/nfs/dbraw/zinc/09/10/21/579091021.db2.gz	FMQWAUODSPTSTI-UHFFFAOYSA-N	-1	3	341.335	1.397	20	5		EDBDHM
O=C(NCc1cccc([N+](=O)[O-])c1)c1ccc(-c2nnn[n-]2)cn1	ZINC000738117077	579161553	/nfs/dbraw/zinc/16/15/53/579161553.db2.gz	PKWXEMRNDKDLNL-UHFFFAOYSA-N	-1	3	325.288	1.100	20	5		EDBDHM
O=C(NCc1cccc([N+](=O)[O-])c1)c1ccc(-c2nn[n-]n2)cn1	ZINC000738117077	579161555	/nfs/dbraw/zinc/16/15/55/579161555.db2.gz	PKWXEMRNDKDLNL-UHFFFAOYSA-N	-1	3	325.288	1.100	20	5		EDBDHM
O=C(OCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(Cl)cc1[O-]	ZINC000761348987	580055670	/nfs/dbraw/zinc/05/56/70/580055670.db2.gz	MOCQEROTJFEZML-UHFFFAOYSA-N	-1	3	338.703	1.973	20	5		EDBDHM
O=C([O-])[C@@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000739505147	579213085	/nfs/dbraw/zinc/21/30/85/579213085.db2.gz	BONSZKFBCVIFCZ-HOCLYGCPSA-N	-1	3	346.339	1.750	20	5		EDBDHM
O=[N+]([O-])c1ccc(CS(=O)(=O)[N-]C[C@H](O)c2ccccn2)cc1	ZINC000758519640	579984809	/nfs/dbraw/zinc/98/48/09/579984809.db2.gz	YIBVLSZKBKIOMS-AWEZNQCLSA-N	-1	3	337.357	1.143	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]C[C@@H](O)c1ccccn1	ZINC000759073122	579997902	/nfs/dbraw/zinc/99/79/02/579997902.db2.gz	XUJOONUDWQPPCU-CQSZACIVSA-N	-1	3	337.357	1.143	20	5		EDBDHM
CCCCOC(=O)C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000765186335	580136945	/nfs/dbraw/zinc/13/69/45/580136945.db2.gz	RSQASMNSRLQEDR-UHFFFAOYSA-N	-1	3	344.389	1.833	20	5		EDBDHM
Cc1ccc([C@H](O)C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)o1	ZINC000767791860	580199750	/nfs/dbraw/zinc/19/97/50/580199750.db2.gz	FOQILCCTWSQQOV-SNVBAGLBSA-N	-1	3	346.386	1.878	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H](CO)c2ccc(F)cc2)cs1	ZINC000768848589	580222251	/nfs/dbraw/zinc/22/22/51/580222251.db2.gz	OOTGBNKCSJUUDL-NSHDSACASA-N	-1	3	346.361	1.807	20	5		EDBDHM
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@H]1OC	ZINC000772956641	580324145	/nfs/dbraw/zinc/32/41/45/580324145.db2.gz	CANBPGVYQSMBNB-IQJOONFLSA-N	-1	3	336.391	1.127	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCN2CCC[C@@H]2C)cc1C	ZINC000780867546	580536011	/nfs/dbraw/zinc/53/60/11/580536011.db2.gz	MYVUTDRFLFFZDR-ZDUSSCGKSA-N	-1	3	341.433	1.974	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H](C)C[C@H](C)O)cc1[N+](=O)[O-]	ZINC000783000814	580591037	/nfs/dbraw/zinc/59/10/37/580591037.db2.gz	ZVBPTSVIVCBOPB-IUCAKERBSA-N	-1	3	336.797	1.994	20	5		EDBDHM
O=C1[N-]C(=O)C(=CNNc2cccc(F)c2[N+](=O)[O-])c2ccccc21	ZINC000790619131	580774056	/nfs/dbraw/zinc/77/40/56/580774056.db2.gz	RJINKYYUUYXWTL-DHZHZOJOSA-N	-1	3	342.286	1.962	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)N1CCCCC1=O	ZINC000800939609	581062687	/nfs/dbraw/zinc/06/26/87/581062687.db2.gz	LIMWYGAGGQRWKD-VIFPVBQESA-N	-1	3	347.418	1.336	20	5		EDBDHM
CC[C@H]1C(=O)N(CC)CCN1Cc1ccc([O-])c(OC)c1[N+](=O)[O-]	ZINC000893719977	591063759	/nfs/dbraw/zinc/06/37/59/591063759.db2.gz	UAROWQVOFIKMDB-LBPRGKRZSA-N	-1	3	337.376	1.752	20	5		EDBDHM
COCCO[C@@H]1CCCN(Cc2ccc([O-])c(OC)c2[N+](=O)[O-])C1	ZINC000894265367	591255697	/nfs/dbraw/zinc/25/56/97/591255697.db2.gz	VQUMTENAROZQOS-CYBMUJFWSA-N	-1	3	340.376	1.936	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@H]23)c(F)cc1[N+](=O)[O-]	ZINC000907764211	592782949	/nfs/dbraw/zinc/78/29/49/592782949.db2.gz	URMWQTVWDJBDRM-DWIZHQHQSA-N	-1	3	342.348	1.496	20	5		EDBDHM
CN(C)c1cccc(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)c1	ZINC000736779589	593036892	/nfs/dbraw/zinc/03/68/92/593036892.db2.gz	KFACWBRGDPKDIW-UHFFFAOYSA-N	-1	3	340.347	1.848	20	5		EDBDHM
CN(C)c1cccc(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)c1	ZINC000736779589	593036894	/nfs/dbraw/zinc/03/68/94/593036894.db2.gz	KFACWBRGDPKDIW-UHFFFAOYSA-N	-1	3	340.347	1.848	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H]2C[C@H](C)OC2=O)c1	ZINC000841521600	593153693	/nfs/dbraw/zinc/15/36/93/593153693.db2.gz	FOZIVFOLLMWLCD-YUMQZZPRSA-N	-1	3	348.764	1.539	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])OCCCCF	ZINC000803515866	593338942	/nfs/dbraw/zinc/33/89/42/593338942.db2.gz	RDHZPUZZUVLGJB-UHFFFAOYSA-N	-1	3	334.325	1.166	20	5		EDBDHM
CC(C)(C)[C@H]([N-]S(C)(=O)=O)C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000819898953	593775587	/nfs/dbraw/zinc/77/55/87/593775587.db2.gz	FWEHUYZNHYYBEJ-LLVKDONJSA-N	-1	3	344.393	1.079	20	5		EDBDHM
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cn1)c1ccc(-c2nnn[n-]2)cc1	ZINC000820397886	593816174	/nfs/dbraw/zinc/81/61/74/593816174.db2.gz	WDXIFUMNLPHRBN-SECBINFHSA-N	-1	3	339.315	1.661	20	5		EDBDHM
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cn1)c1ccc(-c2nn[n-]n2)cc1	ZINC000820397886	593816175	/nfs/dbraw/zinc/81/61/75/593816175.db2.gz	WDXIFUMNLPHRBN-SECBINFHSA-N	-1	3	339.315	1.661	20	5		EDBDHM
CCCCCOC1CN(c2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)C1	ZINC000821056397	593955090	/nfs/dbraw/zinc/95/50/90/593955090.db2.gz	PWGACDQCZNEVNI-UHFFFAOYSA-N	-1	3	333.352	1.565	20	5		EDBDHM
CCCCCOC1CN(c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)C1	ZINC000821056397	593955091	/nfs/dbraw/zinc/95/50/91/593955091.db2.gz	PWGACDQCZNEVNI-UHFFFAOYSA-N	-1	3	333.352	1.565	20	5		EDBDHM
CC(C)OCC(=O)Nc1cc(-c2nnn[n-]2)cc([N+](=O)[O-])c1Cl	ZINC000824309620	593981770	/nfs/dbraw/zinc/98/17/70/593981770.db2.gz	RZCFGGSECWVKNT-UHFFFAOYSA-N	-1	3	340.727	1.792	20	5		EDBDHM
CC(C)OCC(=O)Nc1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl	ZINC000824309620	593981771	/nfs/dbraw/zinc/98/17/71/593981771.db2.gz	RZCFGGSECWVKNT-UHFFFAOYSA-N	-1	3	340.727	1.792	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(=O)n1CCOc1ccccc1-c1nnn[n-]1	ZINC000822271186	594022398	/nfs/dbraw/zinc/02/23/98/594022398.db2.gz	PUDHBUGZROCJFS-UHFFFAOYSA-N	-1	3	342.315	1.324	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(=O)n1CCOc1ccccc1-c1nn[n-]n1	ZINC000822271186	594022399	/nfs/dbraw/zinc/02/23/99/594022399.db2.gz	PUDHBUGZROCJFS-UHFFFAOYSA-N	-1	3	342.315	1.324	20	5		EDBDHM
Cc1cn2cc(Nc3ncc([N+](=O)[O-])cc3-c3nnn[n-]3)ccc2n1	ZINC000822388906	594042128	/nfs/dbraw/zinc/04/21/28/594042128.db2.gz	FVZWOTUCZQTFOC-UHFFFAOYSA-N	-1	3	337.303	1.870	20	5		EDBDHM
Cc1cn2cc(Nc3ncc([N+](=O)[O-])cc3-c3nn[n-]n3)ccc2n1	ZINC000822388906	594042129	/nfs/dbraw/zinc/04/21/29/594042129.db2.gz	FVZWOTUCZQTFOC-UHFFFAOYSA-N	-1	3	337.303	1.870	20	5		EDBDHM
O=C(NCCCNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C1CCC1	ZINC000823191366	594167395	/nfs/dbraw/zinc/16/73/95/594167395.db2.gz	KNSFQYGQMZQMSZ-UHFFFAOYSA-N	-1	3	345.363	1.493	20	5		EDBDHM
O=C(NCCCNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])C1CCC1	ZINC000823191366	594167396	/nfs/dbraw/zinc/16/73/96/594167396.db2.gz	KNSFQYGQMZQMSZ-UHFFFAOYSA-N	-1	3	345.363	1.493	20	5		EDBDHM
CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)c1ccc(-c2nnn[n-]2)cc1	ZINC000825377118	594175704	/nfs/dbraw/zinc/17/57/04/594175704.db2.gz	UCWVBNHZNGIVBB-UHFFFAOYSA-N	-1	3	342.319	1.025	20	5		EDBDHM
CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)c1ccc(-c2nn[n-]n2)cc1	ZINC000825377118	594175706	/nfs/dbraw/zinc/17/57/06/594175706.db2.gz	UCWVBNHZNGIVBB-UHFFFAOYSA-N	-1	3	342.319	1.025	20	5		EDBDHM
O=C(OCc1ccc(-c2nnn[n-]2)cc1F)c1ccc([N+](=O)[O-])cn1	ZINC000823421934	594200327	/nfs/dbraw/zinc/20/03/27/594200327.db2.gz	KGUDJJBWHGKRRZ-UHFFFAOYSA-N	-1	3	344.262	1.666	20	5		EDBDHM
O=C(OCc1ccc(-c2nn[n-]n2)cc1F)c1ccc([N+](=O)[O-])cn1	ZINC000823421934	594200328	/nfs/dbraw/zinc/20/03/28/594200328.db2.gz	KGUDJJBWHGKRRZ-UHFFFAOYSA-N	-1	3	344.262	1.666	20	5		EDBDHM
O=C1CN(c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)[C@H]2CCCC[C@@H]2N1	ZINC000823536297	594215203	/nfs/dbraw/zinc/21/52/03/594215203.db2.gz	ZUMFREHPWRDTNX-AAEUAGOBSA-N	-1	3	343.347	1.022	20	5		EDBDHM
O=C1CN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)[C@H]2CCCC[C@@H]2N1	ZINC000823536297	594215204	/nfs/dbraw/zinc/21/52/04/594215204.db2.gz	ZUMFREHPWRDTNX-AAEUAGOBSA-N	-1	3	343.347	1.022	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NC[C@H](CO)c1ccccc1	ZINC000823629721	594222894	/nfs/dbraw/zinc/22/28/94/594222894.db2.gz	FVZXRRCSIHOOEH-CYBMUJFWSA-N	-1	3	340.343	1.963	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NC[C@H](CO)c1ccccc1	ZINC000823629721	594222895	/nfs/dbraw/zinc/22/28/95/594222895.db2.gz	FVZXRRCSIHOOEH-CYBMUJFWSA-N	-1	3	340.343	1.963	20	5		EDBDHM
CN(C)c1nccc(CNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)n1	ZINC000825887974	594269563	/nfs/dbraw/zinc/26/95/63/594269563.db2.gz	MPNBZWRXOSEYJP-UHFFFAOYSA-N	-1	3	341.335	1.243	20	5		EDBDHM
CN(C)c1nccc(CNc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)n1	ZINC000825887974	594269565	/nfs/dbraw/zinc/26/95/65/594269565.db2.gz	MPNBZWRXOSEYJP-UHFFFAOYSA-N	-1	3	341.335	1.243	20	5		EDBDHM
Nc1ccc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c([O-])c1	ZINC000829938075	594296268	/nfs/dbraw/zinc/29/62/68/594296268.db2.gz	RVVBVOMTCGBPNY-NSHDSACASA-N	-1	3	343.343	1.604	20	5		EDBDHM
CN(Cc1ncc(Cl)n1C)c1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825999273	594301566	/nfs/dbraw/zinc/30/15/66/594301566.db2.gz	UNTCYRBWUDZCJC-UHFFFAOYSA-N	-1	3	349.742	1.193	20	5		EDBDHM
CN(Cc1ncc(Cl)n1C)c1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825999273	594301569	/nfs/dbraw/zinc/30/15/69/594301569.db2.gz	UNTCYRBWUDZCJC-UHFFFAOYSA-N	-1	3	349.742	1.193	20	5		EDBDHM
Cc1c(Cl)cnc(-n2ccc(=O)c([N+](=O)[O-])c2)c1-c1nnn[n-]1	ZINC000826237398	594391840	/nfs/dbraw/zinc/39/18/40/594391840.db2.gz	YGFSIGMAMGZDGT-UHFFFAOYSA-N	-1	3	333.695	1.283	20	5		EDBDHM
Cc1c(Cl)cnc(-n2ccc(=O)c([N+](=O)[O-])c2)c1-c1nn[n-]n1	ZINC000826237398	594391843	/nfs/dbraw/zinc/39/18/43/594391843.db2.gz	YGFSIGMAMGZDGT-UHFFFAOYSA-N	-1	3	333.695	1.283	20	5		EDBDHM
Cc1c(NC(=O)c2nn(C)cc2[N+](=O)[O-])cccc1-c1nnn[n-]1	ZINC000826242241	594394125	/nfs/dbraw/zinc/39/41/25/594394125.db2.gz	GSNFVUJJFVJRGO-UHFFFAOYSA-N	-1	3	328.292	1.069	20	5		EDBDHM
Cc1c(NC(=O)c2nn(C)cc2[N+](=O)[O-])cccc1-c1nn[n-]n1	ZINC000826242241	594394126	/nfs/dbraw/zinc/39/41/26/594394126.db2.gz	GSNFVUJJFVJRGO-UHFFFAOYSA-N	-1	3	328.292	1.069	20	5		EDBDHM
CN(CC(=O)[O-])C(=O)CCN(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000830691810	594457774	/nfs/dbraw/zinc/45/77/74/594457774.db2.gz	DGVPIPNWPKJEFT-UHFFFAOYSA-N	-1	3	335.360	1.492	20	5		EDBDHM
Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1	ZINC000826396446	594458960	/nfs/dbraw/zinc/45/89/60/594458960.db2.gz	YOWUDCXVOQTRPD-UHFFFAOYSA-N	-1	3	344.266	1.144	20	5		EDBDHM
Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1	ZINC000826396446	594458961	/nfs/dbraw/zinc/45/89/61/594458961.db2.gz	YOWUDCXVOQTRPD-UHFFFAOYSA-N	-1	3	344.266	1.144	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CC[C@H]([C@@H]3CCOC3)C2)c(-c2nnn[n-]2)c1	ZINC000826498492	594503028	/nfs/dbraw/zinc/50/30/28/594503028.db2.gz	XDAPGHBHQJGRJZ-WDEREUQCSA-N	-1	3	330.348	1.638	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CC[C@H]([C@@H]3CCOC3)C2)c(-c2nn[n-]n2)c1	ZINC000826498492	594503030	/nfs/dbraw/zinc/50/30/30/594503030.db2.gz	XDAPGHBHQJGRJZ-WDEREUQCSA-N	-1	3	330.348	1.638	20	5		EDBDHM
CCN(OC)C(=O)C[N-]c1c([N+](=O)[O-])cc(CO)c(C)c1[N+](=O)[O-]	ZINC000826755712	594570548	/nfs/dbraw/zinc/57/05/48/594570548.db2.gz	AVMXXFLKALCATO-UHFFFAOYSA-N	-1	3	342.308	1.126	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl)[C@H](C)O	ZINC000832309664	594741826	/nfs/dbraw/zinc/74/18/26/594741826.db2.gz	JKGVRZHUUKGSHI-WPRPVWTQSA-N	-1	3	336.797	1.994	20	5		EDBDHM
O=C([O-])NC[C@H]1CCCN1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000832572892	594760287	/nfs/dbraw/zinc/76/02/87/594760287.db2.gz	JAJKJPUVTNRHPR-CHWSQXEVSA-N	-1	3	339.348	1.067	20	5		EDBDHM
Cc1nn(C)c(C(=O)OCc2cc(=O)[n-]c(C3CC3)n2)c1[N+](=O)[O-]	ZINC000837463896	595117325	/nfs/dbraw/zinc/11/73/25/595117325.db2.gz	ATMBHWDYEBLKPE-UHFFFAOYSA-N	-1	3	333.304	1.367	20	5		EDBDHM
CC[C@]1(C)NC(=O)N([N-]C(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1=O	ZINC000846052097	595130530	/nfs/dbraw/zinc/13/05/30/595130530.db2.gz	KMUDFLKSVXGZOH-AWEZNQCLSA-N	-1	3	338.295	1.028	20	5		EDBDHM
Cn1[n-]c([C@H]2CCCN2C(=O)c2cc(F)ccc2[N+](=O)[O-])nc1=N	ZINC000846068779	595136166	/nfs/dbraw/zinc/13/61/66/595136166.db2.gz	SFZFDMTXIMYDFY-LLVKDONJSA-N	-1	3	334.311	1.252	20	5		EDBDHM
CC(C)NC(=O)C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848580440	595408451	/nfs/dbraw/zinc/40/84/51/595408451.db2.gz	SPSXORISNPMBMG-UHFFFAOYSA-N	-1	3	331.275	1.207	20	5		EDBDHM
COC[C@@](C)(O)C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848582538	595409148	/nfs/dbraw/zinc/40/91/48/595409148.db2.gz	DQLHQQWYZWDHIM-LBPRGKRZSA-N	-1	3	334.275	1.080	20	5		EDBDHM
COCC[C@@](C)(O)C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848583002	595409203	/nfs/dbraw/zinc/40/92/03/595409203.db2.gz	NDQPBRQQQVIQML-CYBMUJFWSA-N	-1	3	348.302	1.470	20	5		EDBDHM
Cn1ccc(CC[N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)n1	ZINC000848587050	595410217	/nfs/dbraw/zinc/41/02/17/595410217.db2.gz	AWNJEJSVEONXBX-UHFFFAOYSA-N	-1	3	340.286	1.659	20	5		EDBDHM
C[C@@H](C[S@](C)=O)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848587444	595410735	/nfs/dbraw/zinc/41/07/35/595410735.db2.gz	UXIPAPDXRAPTDX-ZCAPAMDOSA-N	-1	3	336.316	1.450	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C(OC)OC	ZINC000849406185	595521557	/nfs/dbraw/zinc/52/15/57/595521557.db2.gz	YEBWOQMOIDXOIS-NSHDSACASA-N	-1	3	346.405	1.887	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C(OC)OC	ZINC000849406016	595521636	/nfs/dbraw/zinc/52/16/36/595521636.db2.gz	VBZNXKPBFPCBDU-MRVPVSSYSA-N	-1	3	338.407	1.641	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCN(C3CC3)C2)cc1F	ZINC000866596518	596264234	/nfs/dbraw/zinc/26/42/34/596264234.db2.gz	GPZVVSMOUJYQCG-SNVBAGLBSA-N	-1	3	343.380	1.557	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@H](O)c2ccsc2)cs1	ZINC000120252830	596384700	/nfs/dbraw/zinc/38/47/00/596384700.db2.gz	AVKRJHVXUBIQLY-VIFPVBQESA-N	-1	3	334.400	1.730	20	5		EDBDHM
O=C([N-]C[C@H](O)[C@@H]1CCCO1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000863497617	596599703	/nfs/dbraw/zinc/59/97/03/596599703.db2.gz	YCDFBVRHWWMXRQ-RYUDHWBXSA-N	-1	3	346.286	1.223	20	5		EDBDHM
CC(C)C[C@@H](CCO)C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000119904428	596782830	/nfs/dbraw/zinc/78/28/30/596782830.db2.gz	XINSMRKNGJHDBX-SNVBAGLBSA-N	-1	3	336.435	1.979	20	5		EDBDHM
COC(OC)[C@H](C)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000866105301	596789653	/nfs/dbraw/zinc/78/96/53/596789653.db2.gz	LMWXBFQWWHYWBT-QMMMGPOBSA-N	-1	3	334.275	1.690	20	5		EDBDHM
O=C([N-]c1nc2ccc(F)cn2n1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000129723027	597991321	/nfs/dbraw/zinc/99/13/21/597991321.db2.gz	YAUBEDIFBANXNW-UHFFFAOYSA-N	-1	3	346.234	1.937	20	5		EDBDHM
CCN1CC[C@H]1C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000882766818	598049367	/nfs/dbraw/zinc/04/93/67/598049367.db2.gz	RQTSZOUTWOOGMV-JTQLQIEISA-N	-1	3	333.797	1.621	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2ccc(CO)c(F)c2)c(-c2nnn[n-]2)c1	ZINC000738374269	598500177	/nfs/dbraw/zinc/50/01/77/598500177.db2.gz	MECOBINTMUSWHP-UHFFFAOYSA-N	-1	3	345.294	1.413	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2ccc(CO)c(F)c2)c(-c2nn[n-]n2)c1	ZINC000738374269	598500178	/nfs/dbraw/zinc/50/01/78/598500178.db2.gz	MECOBINTMUSWHP-UHFFFAOYSA-N	-1	3	345.294	1.413	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@]23C[C@H]2COC32CCC2)c(F)c1	ZINC000922107569	709706053	/nfs/dbraw/zinc/70/60/53/709706053.db2.gz	YXZAYKRYFKAQSH-LKFCYVNXSA-N	-1	3	342.348	1.724	20	5		EDBDHM
O=C([N-]c1nncn1C1CC1)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000356167176	304022007	/nfs/dbraw/zinc/02/20/07/304022007.db2.gz	PKQNJMWMKJBWAR-UHFFFAOYSA-N	-1	3	331.288	1.545	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@@H](C)N(C)C2CC2)cc1[N+](=O)[O-]	ZINC000123606587	138319670	/nfs/dbraw/zinc/31/96/70/138319670.db2.gz	ZUDTZAYRUWKAOZ-MRVPVSSYSA-N	-1	3	333.435	1.726	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1nnc2ccccn21	ZINC000096967753	201378473	/nfs/dbraw/zinc/37/84/73/201378473.db2.gz	AOCHTLBVMZDKQV-JTQLQIEISA-N	-1	3	347.356	1.677	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)[C@H](O)C(F)F	ZINC000451706394	305363349	/nfs/dbraw/zinc/36/33/49/305363349.db2.gz	GGPBWASTEJZVBA-RCOVLWMOSA-N	-1	3	344.361	1.648	20	5		EDBDHM
O=C(Nc1ccc(N2CCCC2)nc1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000022390968	284313437	/nfs/dbraw/zinc/31/34/37/284313437.db2.gz	QWBAUWLOEHMKOV-UHFFFAOYSA-N	-1	3	329.316	1.531	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H](C)CCCO)cc1[N+](=O)[O-]	ZINC000126166525	205044187	/nfs/dbraw/zinc/04/41/87/205044187.db2.gz	FENDWYZWZFXBTO-VIFPVBQESA-N	-1	3	336.797	1.996	20	5		EDBDHM
COCCCN1CCC(NC(=O)c2cccc([N+](=O)[O-])c2[O-])CC1	ZINC000130846287	205261382	/nfs/dbraw/zinc/26/13/82/205261382.db2.gz	VMWAHWQWQIYALR-UHFFFAOYSA-N	-1	3	337.376	1.531	20	5		EDBDHM
Cn1[n-]c(-c2ccccc2Cl)nc1=NC(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC000568341236	306478847	/nfs/dbraw/zinc/47/88/47/306478847.db2.gz	CAVVRTWGWPLATR-UHFFFAOYSA-N	-1	3	347.722	1.441	20	5		EDBDHM
COC(=O)[C@H]([N-]S(=O)(=O)CCc1ccccc1[N+](=O)[O-])C1CC1	ZINC000271044275	291767195	/nfs/dbraw/zinc/76/71/95/291767195.db2.gz	HUHPNLXOSUFHTK-CYBMUJFWSA-N	-1	3	342.373	1.008	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CCC[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000416633154	251091823	/nfs/dbraw/zinc/09/18/23/251091823.db2.gz	GQFWXKPGZSKMRA-NEPJUHHUSA-N	-1	3	328.390	1.733	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@]2(C)CCO[C@@H]2C)cc1[N+](=O)[O-]	ZINC000493893486	255225141	/nfs/dbraw/zinc/22/51/41/255225141.db2.gz	GOTBFFFQSPVRLI-AMIZOPFISA-N	-1	3	348.352	1.588	20	5		EDBDHM
CO[C@H](C)CC[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000264020862	139376103	/nfs/dbraw/zinc/37/61/03/139376103.db2.gz	WGQJSVZVSJSTSD-SECBINFHSA-N	-1	3	346.361	1.069	20	5		EDBDHM
COc1cc(C(=O)N2CCc3nc[n-]c(=O)c3C2)cc([N+](=O)[O-])c1C	ZINC000189695455	533525914	/nfs/dbraw/zinc/52/59/14/533525914.db2.gz	QMSBYFUANRQTHF-UHFFFAOYSA-N	-1	3	344.327	1.194	20	5		EDBDHM
CO[C@@H](CC[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1)C(F)(F)F	ZINC000345357679	285588837	/nfs/dbraw/zinc/58/88/37/285588837.db2.gz	SMAPEOZGMYVKKX-JTQLQIEISA-N	-1	3	342.295	1.841	20	5		EDBDHM
CCNC(=O)[C@@H](C)[N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl	ZINC000272471988	140463244	/nfs/dbraw/zinc/46/32/44/140463244.db2.gz	NDHJGOXJNQTTNQ-MRVPVSSYSA-N	-1	3	349.796	1.360	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2CCC[C@H](CO)C2)c(F)c1	ZINC000344954736	143030656	/nfs/dbraw/zinc/03/06/56/143030656.db2.gz	FZSMHIXNGGANIO-MNOVXSKESA-N	-1	3	346.380	1.811	20	5		EDBDHM
COc1nnccc1[N-]C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000346492012	143210567	/nfs/dbraw/zinc/21/05/67/143210567.db2.gz	JFOGRLMOQLAWDX-UHFFFAOYSA-N	-1	3	332.272	1.417	20	5		EDBDHM
Cc1cc(CC[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)on1	ZINC000352632545	149095041	/nfs/dbraw/zinc/09/50/41/149095041.db2.gz	DQUYMJBGDXWLAR-UHFFFAOYSA-N	-1	3	331.375	1.782	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@@H]2CC[C@H](O)C2)cc1[N+](=O)[O-]	ZINC000353821129	149541569	/nfs/dbraw/zinc/54/15/69/149541569.db2.gz	BHYDHKGBHZCNIA-BDAKNGLRSA-N	-1	3	348.352	1.182	20	5		EDBDHM
Cc1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc1C(=O)N(C)C	ZINC000362358948	152688249	/nfs/dbraw/zinc/68/82/49/152688249.db2.gz	LNUZJYWZLSLRDY-UHFFFAOYSA-N	-1	3	344.327	1.958	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCO[C@H]1C1CC1	ZINC000372257903	156290762	/nfs/dbraw/zinc/29/07/62/156290762.db2.gz	HQULLWHYQVFGEE-RISCZKNCSA-N	-1	3	342.373	1.449	20	5		EDBDHM
Cn1ccnc1[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C1CC1	ZINC000352281483	162092200	/nfs/dbraw/zinc/09/22/00/162092200.db2.gz	MPNFXFHQKDQTCI-ZDUSSCGKSA-N	-1	3	336.373	1.758	20	5		EDBDHM
COCC[C@H](COC)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000352528537	162231806	/nfs/dbraw/zinc/23/18/06/162231806.db2.gz	CHANBNOGZDLFNG-SECBINFHSA-N	-1	3	336.341	1.064	20	5		EDBDHM
COCC[C@@H](COC)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000352529321	162233768	/nfs/dbraw/zinc/23/37/68/162233768.db2.gz	IDUGMYNSLDKVFE-LBPRGKRZSA-N	-1	3	346.405	1.541	20	5		EDBDHM
CC(C)(CO)[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C1CC1	ZINC000352552456	162248869	/nfs/dbraw/zinc/24/88/69/162248869.db2.gz	VOBMARMTXKDOPK-CYBMUJFWSA-N	-1	3	328.390	1.670	20	5		EDBDHM
CC[C@]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)(C(N)=O)C(C)C	ZINC000126846792	287428918	/nfs/dbraw/zinc/42/89/18/287428918.db2.gz	OIWCNWFSFOATSA-GFCCVEGCSA-N	-1	3	349.434	1.533	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CCO)C(C)C)cc1C	ZINC000122541456	222108420	/nfs/dbraw/zinc/10/84/20/222108420.db2.gz	IXNDRVOEEMDNBH-GFCCVEGCSA-N	-1	3	330.406	1.897	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)C1CC1	ZINC000276060800	273145312	/nfs/dbraw/zinc/14/53/12/273145312.db2.gz	BOJBLMKTYCPSPW-MRVPVSSYSA-N	-1	3	328.346	1.458	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2CCOC[C@@H]2C)c1[N+](=O)[O-]	ZINC000277747557	273222521	/nfs/dbraw/zinc/22/25/21/273222521.db2.gz	KNHQQHIFDRDXLR-NWDGAFQWSA-N	-1	3	328.390	1.915	20	5		EDBDHM
O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)[N-]CCF)c1	ZINC000280772796	273396594	/nfs/dbraw/zinc/39/65/94/273396594.db2.gz	OPNMLVOMKGAJSA-UHFFFAOYSA-N	-1	3	327.131	1.605	20	5		EDBDHM
CC(C)c1ccc(CN2CCC[C@]3(C2)NC(=O)[N-]C3=O)cc1[N+](=O)[O-]	ZINC000193464683	276053017	/nfs/dbraw/zinc/05/30/17/276053017.db2.gz	YOHBSCXMBMZORV-QGZVFWFLSA-N	-1	3	346.387	1.892	20	5		EDBDHM
CCn1cnnc1[N-]C(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	ZINC000286023734	287917513	/nfs/dbraw/zinc/91/75/13/287917513.db2.gz	ZSBXGJYJLLIXLM-GFCCVEGCSA-N	-1	3	330.304	1.338	20	5		EDBDHM
CC(C)(CN1CCCC1)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000452085412	277298794	/nfs/dbraw/zinc/29/87/94/277298794.db2.gz	OEZHLKGBRVTLGG-UHFFFAOYSA-N	-1	3	327.406	1.748	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]Cc2c[nH]nc2C)cc1[N+](=O)[O-]	ZINC000286572423	288037078	/nfs/dbraw/zinc/03/70/78/288037078.db2.gz	JEULDHSQTXIFQC-UHFFFAOYSA-N	-1	3	344.324	1.253	20	5		EDBDHM
CO[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1(C)C	ZINC000440395490	305205371	/nfs/dbraw/zinc/20/53/71/305205371.db2.gz	CVNZDFAHVDUYSA-RYUDHWBXSA-N	-1	3	332.353	1.826	20	5		EDBDHM
CN1C(=O)Cc2cc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)ccc21	ZINC000447661776	305283971	/nfs/dbraw/zinc/28/39/71/305283971.db2.gz	MBMJFBJKVAJUIT-UHFFFAOYSA-N	-1	3	328.284	1.467	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC2=CCOCC2)c1[N+](=O)[O-]	ZINC000451678703	305361679	/nfs/dbraw/zinc/36/16/79/305361679.db2.gz	FPMIOZLOVFDZDJ-UHFFFAOYSA-N	-1	3	326.374	1.837	20	5		EDBDHM
CNC(=O)C[C@@H](C)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000451953911	305373807	/nfs/dbraw/zinc/37/38/07/305373807.db2.gz	KOWQYAXHRGIZHW-SSDOTTSWSA-N	-1	3	335.769	1.051	20	5		EDBDHM
Cn1[n-]c([C@H]2CCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)nc1=N	ZINC000549726818	306148001	/nfs/dbraw/zinc/14/80/01/306148001.db2.gz	NRMCABNTNXPDRJ-CYBMUJFWSA-N	-1	3	344.375	1.432	20	5		EDBDHM
Cc1cccc(NCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])n1	ZINC000080631620	441185615	/nfs/dbraw/zinc/18/56/15/441185615.db2.gz	MXBORUYVHJXIKJ-UHFFFAOYSA-N	-1	3	336.373	1.689	20	5		EDBDHM
COC(=O)CCCCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000016087764	441215885	/nfs/dbraw/zinc/21/58/85/441215885.db2.gz	TWUMUESRVIXNML-UHFFFAOYSA-N	-1	3	330.362	1.607	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1ccc(C)nc1	ZINC000056086498	441687836	/nfs/dbraw/zinc/68/78/36/441687836.db2.gz	TYQYZLOBWFSYSO-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
CCn1cc([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])ccc1=O	ZINC000158644321	441752268	/nfs/dbraw/zinc/75/22/68/441752268.db2.gz	QGEJWSSCRKEMEZ-UHFFFAOYSA-N	-1	3	337.357	1.886	20	5		EDBDHM
CCN1CCc2nc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)sc2C1	ZINC000124241966	441912276	/nfs/dbraw/zinc/91/22/76/441912276.db2.gz	MHGCQIJEGBLYMF-UHFFFAOYSA-N	-1	3	349.372	1.782	20	5		EDBDHM
CNC(=O)C(C)(C)C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000119871609	441967240	/nfs/dbraw/zinc/96/72/40/441967240.db2.gz	JXLRFSAJALYQRU-UHFFFAOYSA-N	-1	3	343.405	1.262	20	5		EDBDHM
CN(C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[n-]c1=O)c1ccc(F)cc1	ZINC000130779917	442356142	/nfs/dbraw/zinc/35/61/42/442356142.db2.gz	UVMMFPIYLSOXCJ-AWEZNQCLSA-N	-1	3	348.334	1.867	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1Cc2ccccc2[C@H]1O	ZINC000178711749	442460516	/nfs/dbraw/zinc/46/05/16/442460516.db2.gz	FHIQEGSJPPXQQW-IUODEOHRSA-N	-1	3	334.353	1.531	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC2(CCO)CC2)c(Cl)c1	ZINC000157282616	442568575	/nfs/dbraw/zinc/56/85/75/442568575.db2.gz	SBUIAIXFYAXNEG-UHFFFAOYSA-N	-1	3	334.781	1.689	20	5		EDBDHM
Cn1ccnc1CC1CCN(C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)CC1	ZINC000193739686	442777019	/nfs/dbraw/zinc/77/70/19/442777019.db2.gz	YLVIFPVZINUXQP-UHFFFAOYSA-N	-1	3	345.359	1.524	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2nc(C)cs2)c([N+](=O)[O-])c1	ZINC000193771666	442784654	/nfs/dbraw/zinc/78/46/54/442784654.db2.gz	WTRIAWFOQHPHJS-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1[N-][C@@H]1COC[C@H]1O	ZINC000295947944	318653173	/nfs/dbraw/zinc/65/31/73/318653173.db2.gz	IIPPKVJIJVHJKC-HZGVNTEJSA-N	-1	3	337.210	1.693	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2CCCC[C@H]2O)c1[N+](=O)[O-]	ZINC000189987006	443043471	/nfs/dbraw/zinc/04/34/71/443043471.db2.gz	NLNYDLKJPFPSRT-VXGBXAGGSA-N	-1	3	328.390	1.793	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](O)C2CCC2)cc1C	ZINC000316354727	318935183	/nfs/dbraw/zinc/93/51/83/318935183.db2.gz	RRNXDUURQRWKKL-ZDUSSCGKSA-N	-1	3	328.390	1.651	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H](OC)C(C)C	ZINC000266755654	443230094	/nfs/dbraw/zinc/23/00/94/443230094.db2.gz	RNRCMWANBPNPFQ-GFCCVEGCSA-N	-1	3	332.378	1.553	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H](OC)C(C)(C)C	ZINC000266713766	443216953	/nfs/dbraw/zinc/21/69/53/443216953.db2.gz	HZNVTPRRHJKBJA-CYBMUJFWSA-N	-1	3	346.405	1.943	20	5		EDBDHM
COc1cc(-c2noc(Cn3cc([N+](=O)[O-])ccc3=O)n2)ccc1[O-]	ZINC000350573641	319055458	/nfs/dbraw/zinc/05/54/58/319055458.db2.gz	FPLROSYNTMMXSN-UHFFFAOYSA-N	-1	3	344.283	1.569	20	5		EDBDHM
CC(C)c1nc(S(=O)(=O)[N-]Cc2ccccc2[N+](=O)[O-])cn1C	ZINC000416370127	319418775	/nfs/dbraw/zinc/41/87/75/319418775.db2.gz	JIAHPZBJKVSUTD-UHFFFAOYSA-N	-1	3	338.389	1.930	20	5		EDBDHM
Cc1cnc(NCC[N-]S(=O)(=O)c2cccs2)c([N+](=O)[O-])c1	ZINC000269533647	443340178	/nfs/dbraw/zinc/34/01/78/443340178.db2.gz	ZIIMWYSXMSCDTK-UHFFFAOYSA-N	-1	3	342.402	1.750	20	5		EDBDHM
CC(C)c1[nH]nc(C(=O)[N-]c2ccnc(C(=O)N(C)C)c2)c1[N+](=O)[O-]	ZINC000269387501	443299979	/nfs/dbraw/zinc/29/99/79/443299979.db2.gz	LFTNKHFGAWTRNO-UHFFFAOYSA-N	-1	3	346.347	1.790	20	5		EDBDHM
CC(C)(C)OC(=O)C[N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1	ZINC000272588653	443373792	/nfs/dbraw/zinc/37/37/92/443373792.db2.gz	ZNHWSANQEXAEKH-UHFFFAOYSA-N	-1	3	344.389	1.398	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](CO)CC(C)C	ZINC000269676822	443391314	/nfs/dbraw/zinc/39/13/14/443391314.db2.gz	FLNDOGBOHKCYDC-JTQLQIEISA-N	-1	3	332.378	1.289	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](CO)CC(C)(C)C)c([N+](=O)[O-])c1	ZINC000269731342	443415456	/nfs/dbraw/zinc/41/54/56/443415456.db2.gz	YICSXKIRWQIRSM-JTQLQIEISA-N	-1	3	346.405	1.679	20	5		EDBDHM
CCC(O)(CC)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000269766230	443432159	/nfs/dbraw/zinc/43/21/59/443432159.db2.gz	FMGAOCXAMLCWCB-UHFFFAOYSA-N	-1	3	332.378	1.433	20	5		EDBDHM
CC[C@@H](C)C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000420702697	319636938	/nfs/dbraw/zinc/63/69/38/319636938.db2.gz	GPNUTEOZCAFNAS-SECBINFHSA-N	-1	3	330.362	1.690	20	5		EDBDHM
COc1nnc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])[n-]1	ZINC000272385432	443609799	/nfs/dbraw/zinc/60/97/99/443609799.db2.gz	CEFLWBHMDHGOSI-UHFFFAOYSA-N	-1	3	341.711	1.783	20	5		EDBDHM
COc1nc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])n[n-]1	ZINC000272385432	443609800	/nfs/dbraw/zinc/60/98/00/443609800.db2.gz	CEFLWBHMDHGOSI-UHFFFAOYSA-N	-1	3	341.711	1.783	20	5		EDBDHM
COc1n[n-]c(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])n1	ZINC000272385432	443609801	/nfs/dbraw/zinc/60/98/01/443609801.db2.gz	CEFLWBHMDHGOSI-UHFFFAOYSA-N	-1	3	341.711	1.783	20	5		EDBDHM
O=C(c1ccccc1[O-])N1CCC(Nc2ncc([N+](=O)[O-])cn2)CC1	ZINC000436970095	320029805	/nfs/dbraw/zinc/02/98/05/320029805.db2.gz	KRDOJQYFSKCHHN-UHFFFAOYSA-N	-1	3	343.343	1.807	20	5		EDBDHM
CCOc1cc(C(=O)[N-]c2n[nH]c(CC)n2)c([N+](=O)[O-])cc1OC	ZINC000479216373	320354811	/nfs/dbraw/zinc/35/48/11/320354811.db2.gz	NHYVNRHCYHYOFP-UHFFFAOYSA-N	-1	3	335.320	1.935	20	5		EDBDHM
CCNC(=O)[C@@H](C)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276769262	443820231	/nfs/dbraw/zinc/82/02/31/443820231.db2.gz	GZUWPFCDIDAICY-SNVBAGLBSA-N	-1	3	329.378	1.015	20	5		EDBDHM
CCOc1cc([N+](=O)[O-])c(C(=O)[N-]c2nncn2CC)cc1OC	ZINC000285619988	444050191	/nfs/dbraw/zinc/05/01/91/444050191.db2.gz	CLPWBKTVFQQQMT-UHFFFAOYSA-N	-1	3	335.320	1.866	20	5		EDBDHM
C[C@@H](C(=O)N1CCc2c(=O)[n-]cnc2C1)c1ccc([N+](=O)[O-])cc1F	ZINC000558427384	321012680	/nfs/dbraw/zinc/01/26/80/321012680.db2.gz	GPCVHBGZWILEOF-SECBINFHSA-N	-1	3	346.318	1.918	20	5		EDBDHM
CCc1c([N-]C(=O)Cn2ccc([N+](=O)[O-])n2)onc1C(F)(F)F	ZINC000563913293	321115435	/nfs/dbraw/zinc/11/54/35/321115435.db2.gz	DJADXMZHHNWFJT-UHFFFAOYSA-N	-1	3	333.226	1.999	20	5		EDBDHM
Cc1nc([N-]C(=O)c2n[nH]c(C)c2[N+](=O)[O-])n(-c2ccccc2)n1	ZINC000572643843	321433056	/nfs/dbraw/zinc/43/30/56/321433056.db2.gz	QMPNCIINXXUNSN-UHFFFAOYSA-N	-1	3	327.304	1.190	20	5		EDBDHM
CCC[C@@H](C)[C@@H](CO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000581256216	322156366	/nfs/dbraw/zinc/15/63/66/322156366.db2.gz	WCGPUICXQHODPI-ZYHUDNBSSA-N	-1	3	346.405	1.679	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CCC[C@H]1OC	ZINC000341185313	444716382	/nfs/dbraw/zinc/71/63/82/444716382.db2.gz	APHVNVQVNYKAAN-ZYHUDNBSSA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@@]2(O)CCSC2)cc1[N+](=O)[O-]	ZINC000342497025	444716793	/nfs/dbraw/zinc/71/67/93/444716793.db2.gz	MZKHXZWHQXPTFD-JTQLQIEISA-N	-1	3	338.432	1.111	20	5		EDBDHM
O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCc2nc[n-]c(=O)c2C1	ZINC000342945483	444957317	/nfs/dbraw/zinc/95/73/17/444957317.db2.gz	UKHLKPKRGZSRBT-UHFFFAOYSA-N	-1	3	339.311	1.770	20	5		EDBDHM
Cc1nc(CS(=O)(=O)[N-]Cc2ccccc2[N+](=O)[O-])cs1	ZINC000619170572	450421725	/nfs/dbraw/zinc/42/17/25/450421725.db2.gz	KOZIKPPLXPGLCE-UHFFFAOYSA-N	-1	3	327.387	1.979	20	5		EDBDHM
NC(=O)[C@@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000343271369	445171468	/nfs/dbraw/zinc/17/14/68/445171468.db2.gz	GXVLNHSBRILHIA-ZDUSSCGKSA-N	-1	3	335.341	1.100	20	5		EDBDHM
CCOC(=O)c1cnc(C)c([N-]C(=O)c2nn(C)cc2[N+](=O)[O-])c1	ZINC000354655042	445328539	/nfs/dbraw/zinc/32/85/39/445328539.db2.gz	OKASBOKYGBIDLC-UHFFFAOYSA-N	-1	3	333.304	1.461	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC[C@H]2CCOC2)c1[N+](=O)[O-]	ZINC000359988538	445517064	/nfs/dbraw/zinc/51/70/64/445517064.db2.gz	SUCFDBNFHYLANS-LBPRGKRZSA-N	-1	3	328.390	1.917	20	5		EDBDHM
Cn1nc([N+](=O)[O-])cc1C(=O)Nc1nnc(-c2c(F)cccc2F)[n-]1	ZINC000361480871	445780143	/nfs/dbraw/zinc/78/01/43/445780143.db2.gz	HDOFDEFRYAAXPX-UHFFFAOYSA-N	-1	3	349.257	1.644	20	5		EDBDHM
CC[C@]1([N-]S(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)CCOC1	ZINC000616460689	450428950	/nfs/dbraw/zinc/42/89/50/450428950.db2.gz	HMBSXHMRIDJBCG-ZDUSSCGKSA-N	-1	3	348.352	1.590	20	5		EDBDHM
O=C(Nc1ccc(N2CCOCC2)cn1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000361918849	446066690	/nfs/dbraw/zinc/06/66/90/446066690.db2.gz	LXEGOWXYBFMMJI-UHFFFAOYSA-N	-1	3	345.315	1.179	20	5		EDBDHM
COc1cc(C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)ccc1[O-]	ZINC000442811653	446976362	/nfs/dbraw/zinc/97/63/62/446976362.db2.gz	PGSRZARPANMYOD-UHFFFAOYSA-N	-1	3	329.312	1.903	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2ccc3c(c2)C(=O)N(C)C3=O)n1	ZINC000427109860	447546744	/nfs/dbraw/zinc/54/67/44/447546744.db2.gz	SRFWESCXWKBXOQ-UHFFFAOYSA-N	-1	3	343.299	1.289	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000451885957	447773781	/nfs/dbraw/zinc/77/37/81/447773781.db2.gz	CFNXOQDVJUIYEV-ZDUSSCGKSA-N	-1	3	342.373	1.451	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNc1ncc([N+](=O)[O-])cc1C(F)(F)F	ZINC000591147567	448272774	/nfs/dbraw/zinc/27/27/74/448272774.db2.gz	IKFCIVVAZCSOGQ-QMMMGPOBSA-N	-1	3	331.254	1.933	20	5		EDBDHM
COC(=O)[C@H](CC(C)(C)C)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000592075471	448662456	/nfs/dbraw/zinc/66/24/56/448662456.db2.gz	LDFVOGJKLHEHMP-JTQLQIEISA-N	-1	3	344.389	1.851	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCS[C@@H]2C)c([N+](=O)[O-])c1	ZINC000592109728	448689160	/nfs/dbraw/zinc/68/91/60/448689160.db2.gz	CHXNTEUAVUCUFD-SCZZXKLOSA-N	-1	3	332.403	1.776	20	5		EDBDHM
COCC1([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2OC)CCC1	ZINC000585741281	448753202	/nfs/dbraw/zinc/75/32/02/448753202.db2.gz	KKVOPVGWKNFXLA-UHFFFAOYSA-N	-1	3	330.362	1.451	20	5		EDBDHM
O=C(c1cccc([N+](=O)[O-])c1[O-])N1CCC(N2CCCOCC2)CC1	ZINC000600008268	449146636	/nfs/dbraw/zinc/14/66/36/449146636.db2.gz	MDOLYQDPXJYISZ-UHFFFAOYSA-N	-1	3	349.387	1.627	20	5		EDBDHM
CC(C)Oc1nc(N2CCC[C@@H]2c2nc(=N)n(C)[n-]2)ccc1[N+](=O)[O-]	ZINC000596252004	449439741	/nfs/dbraw/zinc/43/97/41/449439741.db2.gz	CHAJVSSXPVZELN-SNVBAGLBSA-N	-1	3	347.379	1.660	20	5		EDBDHM
CC[C@H](CN1CCCC1)[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594762211	449675603	/nfs/dbraw/zinc/67/56/03/449675603.db2.gz	FRCSMDVDKZWVIU-LLVKDONJSA-N	-1	3	328.394	1.143	20	5		EDBDHM
CC(C)(O)C[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594762254	449676872	/nfs/dbraw/zinc/67/68/72/449676872.db2.gz	MZQSLPCDCICZMG-UHFFFAOYSA-N	-1	3	325.346	1.192	20	5		EDBDHM
CO[C@@H](C)C[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594769888	449683480	/nfs/dbraw/zinc/68/34/80/449683480.db2.gz	BGYBIGSIARFTMP-VIFPVBQESA-N	-1	3	325.346	1.456	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-][C@@H]1C[C@H]2CC[C@@H]1O2	ZINC000594794397	449705270	/nfs/dbraw/zinc/70/52/70/449705270.db2.gz	KOWFXNCEZDRNPF-WQAKAFBOSA-N	-1	3	349.368	1.741	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1COC(C)(C)C1	ZINC000594797447	449708535	/nfs/dbraw/zinc/70/85/35/449708535.db2.gz	WLVZCNJTIUDITO-VIFPVBQESA-N	-1	3	330.362	1.449	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@H](CO)C1CCC1	ZINC000594802190	449714661	/nfs/dbraw/zinc/71/46/61/449714661.db2.gz	VVSUJWRELYIRMI-SNVBAGLBSA-N	-1	3	334.781	1.688	20	5		EDBDHM
CCO[C@H]1C[C@H]([N-]S(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)C1	ZINC000594828821	449736512	/nfs/dbraw/zinc/73/65/12/449736512.db2.gz	JMTQSPVXVOWYQZ-KYZUINATSA-N	-1	3	348.352	1.588	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1C[C@@H](O)C12CCC2	ZINC000594865887	449780726	/nfs/dbraw/zinc/78/07/26/449780726.db2.gz	STXWSVJXQKZCAE-CHWSQXEVSA-N	-1	3	342.373	1.185	20	5		EDBDHM
CCN1C[C@@H](C)[C@H]([N-]S(=O)(=O)c2cc(C)sc2[N+](=O)[O-])C1	ZINC000601359039	449873502	/nfs/dbraw/zinc/87/35/02/449873502.db2.gz	PXPPYIXTRXIVIH-PSASIEDQSA-N	-1	3	333.435	1.583	20	5		EDBDHM
CC1(C)OC[C@@H]2C[C@@]21[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000599397341	449943147	/nfs/dbraw/zinc/94/31/47/449943147.db2.gz	PFVBYZCEFKZVIT-SMDDNHRTSA-N	-1	3	326.374	1.582	20	5		EDBDHM
C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000599459382	449992291	/nfs/dbraw/zinc/99/22/91/449992291.db2.gz	IJZJURCFUHFBRH-FBKDDSFISA-N	-1	3	328.390	1.826	20	5		EDBDHM
Cc1noc(CN2CCN(C(=O)c3ccccc3[O-])CC2)c1[N+](=O)[O-]	ZINC000595379131	450093721	/nfs/dbraw/zinc/09/37/21/450093721.db2.gz	XEOLJYPZVUPKCB-UHFFFAOYSA-N	-1	3	346.343	1.555	20	5		EDBDHM
CC(C)N(CC[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-])C(C)C	ZINC000610212067	450154458	/nfs/dbraw/zinc/15/44/58/450154458.db2.gz	JRFLTEIRBDZKKA-UHFFFAOYSA-N	-1	3	330.410	1.387	20	5		EDBDHM
CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000597696762	450204143	/nfs/dbraw/zinc/20/41/43/450204143.db2.gz	YHUYZVUAPVELPS-LSDHHAIUSA-N	-1	3	335.360	1.236	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2CCC[C@H]2N(C)C)c([N+](=O)[O-])s1	ZINC000603313126	450236807	/nfs/dbraw/zinc/23/68/07/450236807.db2.gz	IBBZVATXBKJIDK-NXEZZACHSA-N	-1	3	333.435	1.726	20	5		EDBDHM
CCN1CC[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1=O	ZINC000619797815	450336586	/nfs/dbraw/zinc/33/65/86/450336586.db2.gz	QYQYGMVVFVMPNP-JTQLQIEISA-N	-1	3	347.780	1.147	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](CCO)C(C)(C)C	ZINC000619485472	450486767	/nfs/dbraw/zinc/48/67/67/450486767.db2.gz	YLQUBASRYYYYTQ-LBPRGKRZSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CNC(=O)C1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCCC1	ZINC000725839474	578287404	/nfs/dbraw/zinc/28/74/04/578287404.db2.gz	UDWAEPCOOKSLBB-UHFFFAOYSA-N	-1	3	345.352	1.071	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H](CCO)C2CC2)c(Cl)c1	ZINC000751441165	578551371	/nfs/dbraw/zinc/55/13/71/578551371.db2.gz	ASUJAHVOLWMASH-NSHDSACASA-N	-1	3	334.781	1.688	20	5		EDBDHM
C[C@@H](CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)Cn1cccn1	ZINC000736025110	578947308	/nfs/dbraw/zinc/94/73/08/578947308.db2.gz	DHOPGCHXSHTTRT-VIFPVBQESA-N	-1	3	329.324	1.115	20	5		EDBDHM
C[C@@H](CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)Cn1cccn1	ZINC000736025110	578947309	/nfs/dbraw/zinc/94/73/09/578947309.db2.gz	DHOPGCHXSHTTRT-VIFPVBQESA-N	-1	3	329.324	1.115	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(-c2nnn[n-]2)cn1	ZINC000737114115	579048723	/nfs/dbraw/zinc/04/87/23/579048723.db2.gz	DOJSVBVNZHEGNS-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(-c2nn[n-]n2)cn1	ZINC000737114115	579048724	/nfs/dbraw/zinc/04/87/24/579048724.db2.gz	DOJSVBVNZHEGNS-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
Cn1cc(CCCNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])cn1	ZINC000737602235	579117965	/nfs/dbraw/zinc/11/79/65/579117965.db2.gz	OHCBYSNWUBJZCT-UHFFFAOYSA-N	-1	3	328.336	1.553	20	5		EDBDHM
Cn1cc(CCCNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])cn1	ZINC000737602235	579117967	/nfs/dbraw/zinc/11/79/67/579117967.db2.gz	OHCBYSNWUBJZCT-UHFFFAOYSA-N	-1	3	328.336	1.553	20	5		EDBDHM
Cc1c(NC(=O)CCN2CC[C@@H](NC(=O)[O-])C2)cccc1[N+](=O)[O-]	ZINC000740048445	579283873	/nfs/dbraw/zinc/28/38/73/579283873.db2.gz	HKGAIJUZGZXRTK-LLVKDONJSA-N	-1	3	336.348	1.574	20	5		EDBDHM
O=C([O-])c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1N1CCN2CCC[C@H]2C1	ZINC000740096806	579289548	/nfs/dbraw/zinc/28/95/48/579289548.db2.gz	RAMAVRUOIOUQQO-VIFPVBQESA-N	-1	3	336.304	1.486	20	5		EDBDHM
CCCCOC(=O)C[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000751991085	579832294	/nfs/dbraw/zinc/83/22/94/579832294.db2.gz	DVHDTKVMFWNFOE-UHFFFAOYSA-N	-1	3	330.362	1.358	20	5		EDBDHM
CCn1nc(C)c(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])c1C	ZINC000759168920	580000127	/nfs/dbraw/zinc/00/01/27/580000127.db2.gz	UNKYFZYPMJTFCQ-UHFFFAOYSA-N	-1	3	340.365	1.128	20	5		EDBDHM
CCN(CC)C(=O)C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000765170574	580136633	/nfs/dbraw/zinc/13/66/33/580136633.db2.gz	AKMTUAWMAYCWTG-UHFFFAOYSA-N	-1	3	343.405	1.358	20	5		EDBDHM
O=Cc1n[n-]c2cc(C(=O)OCCn3cc([N+](=O)[O-])cn3)ccc12	ZINC000766172726	580160950	/nfs/dbraw/zinc/16/09/50/580160950.db2.gz	HUQLMYDLHQYOPQ-UHFFFAOYSA-N	-1	3	329.272	1.337	20	5		EDBDHM
O=Cc1[n-]nc2cc(C(=O)OCCn3cc([N+](=O)[O-])cn3)ccc12	ZINC000766172726	580160951	/nfs/dbraw/zinc/16/09/51/580160951.db2.gz	HUQLMYDLHQYOPQ-UHFFFAOYSA-N	-1	3	329.272	1.337	20	5		EDBDHM
CNC(=O)C1CCC([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000768826478	580221472	/nfs/dbraw/zinc/22/14/72/580221472.db2.gz	FBVUZOGCQICNFB-UHFFFAOYSA-N	-1	3	347.418	1.239	20	5		EDBDHM
CSC[C@](C)(O)C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768840660	580221952	/nfs/dbraw/zinc/22/19/52/580221952.db2.gz	AMTBTMKOFLRXBF-SECBINFHSA-N	-1	3	326.421	1.049	20	5		EDBDHM
CCN(C)C(=O)C[N-]c1c(C(=O)OC)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000775545937	580393321	/nfs/dbraw/zinc/39/33/21/580393321.db2.gz	OTQVSKBPNVDZGV-UHFFFAOYSA-N	-1	3	340.292	1.180	20	5		EDBDHM
O=C(CC[C@@H]1NC(=O)[N-]C1=O)OCc1ccc([N+](=O)[O-])cc1Cl	ZINC000782304516	580571486	/nfs/dbraw/zinc/57/14/86/580571486.db2.gz	HOWUOWQQNXZDCJ-JTQLQIEISA-N	-1	3	341.707	1.280	20	5		EDBDHM
Cc1c(C(=O)NCc2ncccc2[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000792619546	580823916	/nfs/dbraw/zinc/82/39/16/580823916.db2.gz	KTRMJZCLXFXPJU-UHFFFAOYSA-N	-1	3	332.272	1.842	20	5		EDBDHM
COc1c([O-])ccc(CN2CC[C@H](C(=O)N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000894510609	591327996	/nfs/dbraw/zinc/32/79/96/591327996.db2.gz	FMRVRXZDRUIRPD-ZDUSSCGKSA-N	-1	3	349.387	1.753	20	5		EDBDHM
O=C(OCc1ccccc1[N+](=O)[O-])c1ccc(-c2nnn[n-]2)cn1	ZINC000738235595	593111195	/nfs/dbraw/zinc/11/11/95/593111195.db2.gz	TVGFYZVBLGLFRO-UHFFFAOYSA-N	-1	3	326.272	1.527	20	5		EDBDHM
O=C(OCc1ccccc1[N+](=O)[O-])c1ccc(-c2nn[n-]n2)cn1	ZINC000738235595	593111197	/nfs/dbraw/zinc/11/11/97/593111197.db2.gz	TVGFYZVBLGLFRO-UHFFFAOYSA-N	-1	3	326.272	1.527	20	5		EDBDHM
CO[C@H]1C[C@@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C12CCC2	ZINC000841549131	593297325	/nfs/dbraw/zinc/29/73/25/593297325.db2.gz	LENLOSILABBKIV-ZJUUUORDSA-N	-1	3	332.403	1.892	20	5		EDBDHM
CCn1nc(C)c(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)n1	ZINC000819891658	593774439	/nfs/dbraw/zinc/77/44/39/593774439.db2.gz	UHNDISNMKUHLIV-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
CC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)[C@H](C)C1	ZINC000823974485	593899055	/nfs/dbraw/zinc/89/90/55/593899055.db2.gz	PMZCJWHEHRYXBM-NOZJJQNGSA-N	-1	3	345.363	1.444	20	5		EDBDHM
CC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)[C@H](C)C1	ZINC000823974485	593899056	/nfs/dbraw/zinc/89/90/56/593899056.db2.gz	PMZCJWHEHRYXBM-NOZJJQNGSA-N	-1	3	345.363	1.444	20	5		EDBDHM
COC(=O)[C@@H]1CN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000821656847	593900391	/nfs/dbraw/zinc/90/03/91/593900391.db2.gz	APCAZVUTPNPRMU-WCBMZHEXSA-N	-1	3	332.320	1.020	20	5		EDBDHM
COC(=O)[C@@H]1CN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000821656847	593900394	/nfs/dbraw/zinc/90/03/94/593900394.db2.gz	APCAZVUTPNPRMU-WCBMZHEXSA-N	-1	3	332.320	1.020	20	5		EDBDHM
COCCCOC1CN(c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C1	ZINC000821687941	593915058	/nfs/dbraw/zinc/91/50/58/593915058.db2.gz	WTGXVPXLDJPWKX-UHFFFAOYSA-N	-1	3	334.336	1.017	20	5		EDBDHM
COCCCOC1CN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C1	ZINC000821687941	593915059	/nfs/dbraw/zinc/91/50/59/593915059.db2.gz	WTGXVPXLDJPWKX-UHFFFAOYSA-N	-1	3	334.336	1.017	20	5		EDBDHM
COc1cccc(CCNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)n1	ZINC000821869025	593957191	/nfs/dbraw/zinc/95/71/91/593957191.db2.gz	YTVLORZDZJRKBD-UHFFFAOYSA-N	-1	3	341.331	1.833	20	5		EDBDHM
COc1cccc(CCNc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)n1	ZINC000821869025	593957192	/nfs/dbraw/zinc/95/71/92/593957192.db2.gz	YTVLORZDZJRKBD-UHFFFAOYSA-N	-1	3	341.331	1.833	20	5		EDBDHM
Cc1nccn1CCCNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000822478102	594054763	/nfs/dbraw/zinc/05/47/63/594054763.db2.gz	QNOURIJOXPSRLC-UHFFFAOYSA-N	-1	3	328.336	1.782	20	5		EDBDHM
Cc1nccn1CCCNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000822478102	594054766	/nfs/dbraw/zinc/05/47/66/594054766.db2.gz	QNOURIJOXPSRLC-UHFFFAOYSA-N	-1	3	328.336	1.782	20	5		EDBDHM
C[C@H]1CN(c2cc(-c3nnn[n-]3)c3cc([N+](=O)[O-])ccc3n2)C[C@@H]1O	ZINC000824995423	594112571	/nfs/dbraw/zinc/11/25/71/594112571.db2.gz	ZMRJKGKKVYNFKB-SDBXPKJASA-N	-1	3	341.331	1.140	20	5		EDBDHM
C[C@H]1CN(c2cc(-c3nn[n-]n3)c3cc([N+](=O)[O-])ccc3n2)C[C@@H]1O	ZINC000824995423	594112572	/nfs/dbraw/zinc/11/25/72/594112572.db2.gz	ZMRJKGKKVYNFKB-SDBXPKJASA-N	-1	3	341.331	1.140	20	5		EDBDHM
O=C(OCc1ccc(F)cc1-c1nnn[n-]1)c1ccc([N+](=O)[O-])cn1	ZINC000823426431	594200738	/nfs/dbraw/zinc/20/07/38/594200738.db2.gz	IICJSAVURQXVQA-UHFFFAOYSA-N	-1	3	344.262	1.666	20	5		EDBDHM
O=C(OCc1ccc(F)cc1-c1nn[n-]n1)c1ccc([N+](=O)[O-])cn1	ZINC000823426431	594200739	/nfs/dbraw/zinc/20/07/39/594200739.db2.gz	IICJSAVURQXVQA-UHFFFAOYSA-N	-1	3	344.262	1.666	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N[C@@H]1CCCn2ncnc21	ZINC000823629725	594222956	/nfs/dbraw/zinc/22/29/56/594222956.db2.gz	FXEIRNYQWPMFHH-SNVBAGLBSA-N	-1	3	327.308	1.313	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N[C@@H]1CCCn2ncnc21	ZINC000823629725	594222957	/nfs/dbraw/zinc/22/29/57/594222957.db2.gz	FXEIRNYQWPMFHH-SNVBAGLBSA-N	-1	3	327.308	1.313	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC(OCC3CC3)CC2)c(-c2nnn[n-]2)c1	ZINC000823648625	594224586	/nfs/dbraw/zinc/22/45/86/594224586.db2.gz	ZIGNWJKDQOKXFP-UHFFFAOYSA-N	-1	3	345.363	1.565	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC(OCC3CC3)CC2)c(-c2nn[n-]n2)c1	ZINC000823648625	594224587	/nfs/dbraw/zinc/22/45/87/594224587.db2.gz	ZIGNWJKDQOKXFP-UHFFFAOYSA-N	-1	3	345.363	1.565	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCc2cccc(F)c2)c(-c2nnn[n-]2)c1	ZINC000823651225	594224611	/nfs/dbraw/zinc/22/46/11/594224611.db2.gz	IRTLHFDFTXSPLG-UHFFFAOYSA-N	-1	3	329.295	1.964	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCc2cccc(F)c2)c(-c2nn[n-]n2)c1	ZINC000823651225	594224612	/nfs/dbraw/zinc/22/46/12/594224612.db2.gz	IRTLHFDFTXSPLG-UHFFFAOYSA-N	-1	3	329.295	1.964	20	5		EDBDHM
O=[N+]([O-])c1ccsc1NCCNc1ccc(-c2nnn[n-]2)cn1	ZINC000826500535	594503452	/nfs/dbraw/zinc/50/34/52/594503452.db2.gz	BGZLBCZDVJETFW-UHFFFAOYSA-N	-1	3	332.349	1.755	20	5		EDBDHM
O=[N+]([O-])c1ccsc1NCCNc1ccc(-c2nn[n-]n2)cn1	ZINC000826500535	594503453	/nfs/dbraw/zinc/50/34/53/594503453.db2.gz	BGZLBCZDVJETFW-UHFFFAOYSA-N	-1	3	332.349	1.755	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2ccc(Cl)cn2)c(-c2nnn[n-]2)c1	ZINC000826500823	594503774	/nfs/dbraw/zinc/50/37/74/594503774.db2.gz	NNUFYGPNBQHKRR-UHFFFAOYSA-N	-1	3	332.711	1.830	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2ccc(Cl)cn2)c(-c2nn[n-]n2)c1	ZINC000826500823	594503775	/nfs/dbraw/zinc/50/37/75/594503775.db2.gz	NNUFYGPNBQHKRR-UHFFFAOYSA-N	-1	3	332.711	1.830	20	5		EDBDHM
O=[N+]([O-])c1cccc([N+](=O)[O-])c1[N-]Cc1ncc2c(n1)CCOC2	ZINC000845642435	595037656	/nfs/dbraw/zinc/03/76/56/595037656.db2.gz	QCWVCBDXUXWOMS-UHFFFAOYSA-N	-1	3	331.288	1.978	20	5		EDBDHM
Nc1c(C(=O)OCc2cc(=O)[n-]c(C3CC3)n2)cccc1[N+](=O)[O-]	ZINC000837579357	595144867	/nfs/dbraw/zinc/14/48/67/595144867.db2.gz	XXZBKRHDJKGJFH-UHFFFAOYSA-N	-1	3	330.300	1.907	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H]2CCN(C)C2)cc1F	ZINC000867374682	595410054	/nfs/dbraw/zinc/41/00/54/595410054.db2.gz	KLUDOOYHZGJOSQ-JTQLQIEISA-N	-1	3	331.369	1.272	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H](C)C2(CO)CC2)cc1[N+](=O)[O-]	ZINC000849434056	595525565	/nfs/dbraw/zinc/52/55/65/595525565.db2.gz	TVIBRMZYAXIOQX-SECBINFHSA-N	-1	3	348.808	1.996	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1COC2(CCC2)C1	ZINC000849449860	595532191	/nfs/dbraw/zinc/53/21/91/595532191.db2.gz	QUUVILYEESAGJZ-SNVBAGLBSA-N	-1	3	342.373	1.593	20	5		EDBDHM
CN(C[C@@H](O)CNC(=O)OC(C)(C)C)c1cc[n-]c(=O)c1[N+](=O)[O-]	ZINC000853652264	595846943	/nfs/dbraw/zinc/84/69/43/595846943.db2.gz	GKWZVVUAONCBBH-VIFPVBQESA-N	-1	3	342.352	1.017	20	5		EDBDHM
CN(CC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)CC(F)F	ZINC000859428563	596093058	/nfs/dbraw/zinc/09/30/58/596093058.db2.gz	KZZAKROXLWHQQM-UHFFFAOYSA-N	-1	3	329.350	1.132	20	5		EDBDHM
O=C(NCCCc1cc(=O)[nH][n-]1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000854486167	596095329	/nfs/dbraw/zinc/09/53/29/596095329.db2.gz	PGFIOHYOKRBVGO-UHFFFAOYSA-N	-1	3	340.286	1.459	20	5		EDBDHM
CC(C)C(=O)NCCC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000120155205	596286596	/nfs/dbraw/zinc/28/65/96/596286596.db2.gz	OQGJASDFQBVVGY-UHFFFAOYSA-N	-1	3	335.407	1.097	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-][C@@H]1[C@H]2C[C@H]3CO[C@H]1[C@H]3C2	ZINC000867612906	596460745	/nfs/dbraw/zinc/46/07/45/596460745.db2.gz	LMQLMBNPSKNELX-JVSQWTDWSA-N	-1	3	338.385	1.438	20	5		EDBDHM
CON(C)C(=O)[C@H](C)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000863629785	596638361	/nfs/dbraw/zinc/63/83/61/596638361.db2.gz	WGTSSKJDHVTDBH-QMMMGPOBSA-N	-1	3	331.275	1.211	20	5		EDBDHM
O=C(OCc1ccc([N+](=O)[O-])cc1F)c1cc(-c2nnn[n-]2)c[nH]1	ZINC000823426171	606235219	/nfs/dbraw/zinc/23/52/19/606235219.db2.gz	BHVSRKUJHZRVMF-UHFFFAOYSA-N	-1	3	332.251	1.599	20	5		EDBDHM
O=C(OCc1ccc([N+](=O)[O-])cc1F)c1cc(-c2nn[n-]n2)c[nH]1	ZINC000823426171	606235221	/nfs/dbraw/zinc/23/52/21/606235221.db2.gz	BHVSRKUJHZRVMF-UHFFFAOYSA-N	-1	3	332.251	1.599	20	5		EDBDHM
Cc1cc(C(=O)Nc2nnc(C(F)(F)F)[n-]2)c(N)c([N+](=O)[O-])c1	ZINC000175225992	697701686	/nfs/dbraw/zinc/70/16/86/697701686.db2.gz	VLGGOJMENSMYSY-UHFFFAOYSA-N	-1	3	330.226	1.875	20	5		EDBDHM
Cc1cc(C(=O)Nc2nc(C(F)(F)F)n[n-]2)c(N)c([N+](=O)[O-])c1	ZINC000175225992	697701688	/nfs/dbraw/zinc/70/16/88/697701688.db2.gz	VLGGOJMENSMYSY-UHFFFAOYSA-N	-1	3	330.226	1.875	20	5		EDBDHM
O=c1[n-]nc(SCc2cccc([N+](=O)[O-])c2)n1C[C@@H]1CCCO1	ZINC000097602094	138297188	/nfs/dbraw/zinc/29/71/88/138297188.db2.gz	SXXFYWLQWIITGD-LBPRGKRZSA-N	-1	3	336.373	1.951	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CCN(C(C)C)C2=O)cc1[N+](=O)[O-]	ZINC000124018288	138323138	/nfs/dbraw/zinc/32/31/38/138323138.db2.gz	GBMCNPPJKYEWTQ-VIFPVBQESA-N	-1	3	347.418	1.252	20	5		EDBDHM
CCOC(=O)CCC[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000298486303	202327389	/nfs/dbraw/zinc/32/73/89/202327389.db2.gz	KUHAZJJPQCWUFM-UHFFFAOYSA-N	-1	3	330.362	1.525	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H](O)C(F)F)c(Cl)c1	ZINC000228620024	139023330	/nfs/dbraw/zinc/02/33/30/139023330.db2.gz	GEVDJMXKWHGSGL-SSDOTTSWSA-N	-1	3	330.696	1.153	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1CCN(c2ccccn2)C1	ZINC000159353186	206239572	/nfs/dbraw/zinc/23/95/72/206239572.db2.gz	RVNZVWQXSCGROY-GFCCVEGCSA-N	-1	3	348.384	1.547	20	5		EDBDHM
O=C(c1ccc([N+](=O)[O-])o1)N1CCN(C(=O)c2ccc([O-])cc2)CC1	ZINC000159718044	206260122	/nfs/dbraw/zinc/26/01/22/206260122.db2.gz	OZBDCUAPNXCOAW-UHFFFAOYSA-N	-1	3	345.311	1.492	20	5		EDBDHM
NC(=O)c1ccc(F)c([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000175773939	207157787	/nfs/dbraw/zinc/15/77/87/207157787.db2.gz	QFYXJPYSINQHFD-UHFFFAOYSA-N	-1	3	339.304	1.634	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2CO)cc1[N+](=O)[O-]	ZINC000452028025	254746789	/nfs/dbraw/zinc/74/67/89/254746789.db2.gz	GLRQGOMFSHBRTK-LDYMZIIASA-N	-1	3	348.352	1.182	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]Cc2cccn2C)cc1[N+](=O)[O-]	ZINC000491587508	255131479	/nfs/dbraw/zinc/13/14/79/255131479.db2.gz	YXDLHKVDRNMXOQ-UHFFFAOYSA-N	-1	3	343.336	1.560	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CC2(CO)CCC2)cc1[N+](=O)[O-]	ZINC000493881928	255224945	/nfs/dbraw/zinc/22/49/45/255224945.db2.gz	GIJVVXJPZPXVDZ-UHFFFAOYSA-N	-1	3	348.352	1.183	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H](C)C[C@H](C)O)cc1[N+](=O)[O-]	ZINC000493923718	255226613	/nfs/dbraw/zinc/22/66/13/255226613.db2.gz	DKVRSFXQYSAOML-SFYZADRCSA-N	-1	3	336.341	1.180	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)[C@@H]1CCCO1	ZINC000339448945	142048307	/nfs/dbraw/zinc/04/83/07/142048307.db2.gz	JLEYQCQGMOPOLI-RYUDHWBXSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CC(=O)N1CCC([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)CC1	ZINC000343506954	142853295	/nfs/dbraw/zinc/85/32/95/142853295.db2.gz	NZLNRWFIPBWHDY-UHFFFAOYSA-N	-1	3	347.418	1.254	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCCn2cccn2)c1[N+](=O)[O-]	ZINC000189833115	292087541	/nfs/dbraw/zinc/08/75/41/292087541.db2.gz	LIXBZRKLMMDWEO-UHFFFAOYSA-N	-1	3	338.389	1.777	20	5		EDBDHM
CCn1ccc(C[N-]S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)n1	ZINC000416575809	304332996	/nfs/dbraw/zinc/33/29/96/304332996.db2.gz	CBRUZRWWUHTWJG-UHFFFAOYSA-N	-1	3	338.389	1.907	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)[C@H]2CCCOC2)c([N+](=O)[O-])c1	ZINC000355722350	150374941	/nfs/dbraw/zinc/37/49/41/150374941.db2.gz	DVCBQBBFNHFGFO-QWRGUYRKSA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cn1cc(-c2cccc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)n2)cn1	ZINC000364342251	153210568	/nfs/dbraw/zinc/21/05/68/153210568.db2.gz	IOJGBZPPWYTLHD-UHFFFAOYSA-N	-1	3	340.299	1.743	20	5		EDBDHM
CCC[C@H](CCO)C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000123797249	222333563	/nfs/dbraw/zinc/33/35/63/222333563.db2.gz	TYYRUCFIYLHPSL-GFCCVEGCSA-N	-1	3	330.406	1.980	20	5		EDBDHM
[NH3+][C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1)c1ccccc1	ZINC000238064795	273014011	/nfs/dbraw/zinc/01/40/11/273014011.db2.gz	FNYQHCGSJNFKMM-JTQLQIEISA-N	-1	3	327.387	1.635	20	5		EDBDHM
N[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1)c1ccccc1	ZINC000238064795	273014013	/nfs/dbraw/zinc/01/40/13/273014013.db2.gz	FNYQHCGSJNFKMM-JTQLQIEISA-N	-1	3	327.387	1.635	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@H](C)SC)cc1[N+](=O)[O-]	ZINC000275131915	268285703	/nfs/dbraw/zinc/28/57/03/268285703.db2.gz	BVZQMEWDLYGSSU-ZETCQYMHSA-N	-1	3	338.382	1.772	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC1CCCC1	ZINC000276246736	273154740	/nfs/dbraw/zinc/15/47/40/273154740.db2.gz	RGICLPPONUDFSX-UHFFFAOYSA-N	-1	3	342.373	1.850	20	5		EDBDHM
CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCc3c(=O)[n-]cnc3C2)c1	ZINC000283013615	273758735	/nfs/dbraw/zinc/75/87/35/273758735.db2.gz	HHABFQGZYAVLIN-UHFFFAOYSA-N	-1	3	344.327	1.688	20	5		EDBDHM
COc1nnc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)[n-]1	ZINC000179715790	278085890	/nfs/dbraw/zinc/08/58/90/278085890.db2.gz	CVNDEUBMBKBMSP-UHFFFAOYSA-N	-1	3	329.276	1.160	20	5		EDBDHM
COc1nc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)n[n-]1	ZINC000179715790	278085892	/nfs/dbraw/zinc/08/58/92/278085892.db2.gz	CVNDEUBMBKBMSP-UHFFFAOYSA-N	-1	3	329.276	1.160	20	5		EDBDHM
COc1n[n-]c(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)n1	ZINC000179715790	278085894	/nfs/dbraw/zinc/08/58/94/278085894.db2.gz	CVNDEUBMBKBMSP-UHFFFAOYSA-N	-1	3	329.276	1.160	20	5		EDBDHM
O=[N+]([O-])c1cccc(CS(=O)(=O)[N-][C@H]2CNCCC2(F)F)c1	ZINC000420448097	304759724	/nfs/dbraw/zinc/75/97/24/304759724.db2.gz	QSWRZUAOGLASEY-NSHDSACASA-N	-1	3	335.332	1.011	20	5		EDBDHM
CC(C)(CCC(=O)Nc1cccc([C@]2(C)NC(=O)[N-]C2=O)c1)[N+](=O)[O-]	ZINC000294335267	303093601	/nfs/dbraw/zinc/09/36/01/303093601.db2.gz	FCJFEJPJUHGACJ-INIZCTEOSA-N	-1	3	348.359	1.515	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@]2(O)CCC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000294422339	303104723	/nfs/dbraw/zinc/10/47/23/303104723.db2.gz	DMNCUDWPOYAFPB-IINYFYTJSA-N	-1	3	344.389	1.433	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@@H]1CCCC[C@H]1O	ZINC000052003429	304799829	/nfs/dbraw/zinc/79/98/29/304799829.db2.gz	UQBBIAGVUSRNHJ-MWLCHTKSSA-N	-1	3	334.781	1.830	20	5		EDBDHM
COC(=O)COc1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000444853883	305253907	/nfs/dbraw/zinc/25/39/07/305253907.db2.gz	VUSOUXVGIVDPNV-UHFFFAOYSA-N	-1	3	347.283	1.500	20	5		EDBDHM
CC/C=C\C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000451770985	305368206	/nfs/dbraw/zinc/36/82/06/305368206.db2.gz	GNGDCHBDPFPAND-ARJAWSKDSA-N	-1	3	328.346	1.611	20	5		EDBDHM
CSc1ccc(C(=O)NCCc2c(C)[n-][nH]c2=O)cc1[N+](=O)[O-]	ZINC000522262923	305802622	/nfs/dbraw/zinc/80/26/22/305802622.db2.gz	CTOOKVJRKZVVGY-SNVBAGLBSA-N	-1	3	336.373	1.559	20	5		EDBDHM
CCN(CC[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-])C1CC1	ZINC000102932896	441173205	/nfs/dbraw/zinc/17/32/05/441173205.db2.gz	NBNIYABOKYQZHD-UHFFFAOYSA-N	-1	3	331.369	1.497	20	5		EDBDHM
CCN(CC)[C@H](C)C[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000047671726	441218574	/nfs/dbraw/zinc/21/85/74/441218574.db2.gz	BIVKQBHOSQPSOF-SNVBAGLBSA-N	-1	3	333.385	1.743	20	5		EDBDHM
Cc1nccn1CCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000055266082	441636105	/nfs/dbraw/zinc/63/61/05/441636105.db2.gz	BRAXQXKCPQXCNS-UHFFFAOYSA-N	-1	3	342.352	1.607	20	5		EDBDHM
Cc1nn(C)c(C)c1C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000173979068	441873205	/nfs/dbraw/zinc/87/32/05/441873205.db2.gz	JGGNQSOUZIVDKP-UHFFFAOYSA-N	-1	3	338.389	1.732	20	5		EDBDHM
CCN1CCC[C@@H]([N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C1	ZINC000119856663	441964345	/nfs/dbraw/zinc/96/43/45/441964345.db2.gz	NYDHNIPMOXFFPW-CYBMUJFWSA-N	-1	3	341.433	1.974	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2CCO)cc1[N+](=O)[O-]	ZINC000494545465	447446581	/nfs/dbraw/zinc/44/65/81/447446581.db2.gz	GVQCIRKZAKUNQN-NXEZZACHSA-N	-1	3	334.419	1.794	20	5		EDBDHM
O=C1CCCN1CCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000096997079	442153246	/nfs/dbraw/zinc/15/32/46/442153246.db2.gz	BGJNHVRRMDKYTG-UHFFFAOYSA-N	-1	3	345.352	1.025	20	5		EDBDHM
CC1(C)[C@@H](O)C[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000130143146	442339983	/nfs/dbraw/zinc/33/99/83/442339983.db2.gz	PRDZEPFMNSPICO-QWRGUYRKSA-N	-1	3	334.781	1.686	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC(=O)NCC2CC2)c1C	ZINC000179929783	442520163	/nfs/dbraw/zinc/52/01/63/442520163.db2.gz	ZLPAZXNBZNSXHH-UHFFFAOYSA-N	-1	3	341.389	1.016	20	5		EDBDHM
O=c1[n-]c(SCCOc2ccccc2[N+](=O)[O-])nc2[nH]ncc21	ZINC000193736199	442776371	/nfs/dbraw/zinc/77/63/71/442776371.db2.gz	GXCMRQPKOMWXPN-UHFFFAOYSA-N	-1	3	333.329	1.726	20	5		EDBDHM
CCOC(=O)Cc1csc([N-]C(=O)c2n[nH]cc2[N+](=O)[O-])n1	ZINC000196747789	443035348	/nfs/dbraw/zinc/03/53/48/443035348.db2.gz	LIHVGQVDFPXXJN-UHFFFAOYSA-N	-1	3	325.306	1.132	20	5		EDBDHM
CC[C@H](COC)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC	ZINC000273468708	443576949	/nfs/dbraw/zinc/57/69/49/443576949.db2.gz	FCGOPMAXNAKKQZ-SECBINFHSA-N	-1	3	346.361	1.085	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C[C@H]2CCC[C@H]2O)c1	ZINC000272398150	443613598	/nfs/dbraw/zinc/61/35/98/443613598.db2.gz	ANRJVJFDODENIK-MWLCHTKSSA-N	-1	3	348.808	1.996	20	5		EDBDHM
NC(=O)[C@H]([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000443705742	320109707	/nfs/dbraw/zinc/10/97/07/320109707.db2.gz	OTZGXRUSZQEUCK-CQSZACIVSA-N	-1	3	349.368	1.241	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)CCC1	ZINC000443772150	320113150	/nfs/dbraw/zinc/11/31/50/320113150.db2.gz	MZMPPXMCKNJWSJ-UHFFFAOYSA-N	-1	3	328.346	1.110	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(N2CCC[C@@H]2C[C@]2(C)NC(=O)[N-]C2=O)c1	ZINC000286319567	443690074	/nfs/dbraw/zinc/69/00/74/443690074.db2.gz	JROARVJOSKGZMR-BZNIZROVSA-N	-1	3	332.360	1.860	20	5		EDBDHM
O=C1[C@H](Sc2n[n-]c(CO)n2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000527060099	320502319	/nfs/dbraw/zinc/50/23/19/320502319.db2.gz	DSHJDXXAPXLMKQ-SNVBAGLBSA-N	-1	3	335.345	1.103	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](C)Cn2cccn2)c1[N+](=O)[O-]	ZINC000276782458	443825283	/nfs/dbraw/zinc/82/52/83/443825283.db2.gz	IGWWPPQCZUZYRT-GFCCVEGCSA-N	-1	3	338.389	1.775	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCN2CC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000564623339	321137961	/nfs/dbraw/zinc/13/79/61/321137961.db2.gz	WODBLRJLCHPXFS-NSHDSACASA-N	-1	3	341.433	1.832	20	5		EDBDHM
Cc1nc(C(C)(C)[N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)no1	ZINC000299652629	444106429	/nfs/dbraw/zinc/10/64/29/444106429.db2.gz	NNYXFHYCODUJGA-UHFFFAOYSA-N	-1	3	340.361	1.808	20	5		EDBDHM
O=c1nc(C2CCN(Cc3nc4cc([N+](=O)[O-])ccc4o3)CC2)[nH][n-]1	ZINC000289562995	444172782	/nfs/dbraw/zinc/17/27/82/444172782.db2.gz	XYEJKWKFARMOTR-UHFFFAOYSA-N	-1	3	344.331	1.527	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCCCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000322346531	444339681	/nfs/dbraw/zinc/33/96/81/444339681.db2.gz	DRFKYTLIGDQGCG-WCQYABFASA-N	-1	3	344.389	1.575	20	5		EDBDHM
CC[C@@](C)([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C(=O)OC	ZINC000337750878	444388260	/nfs/dbraw/zinc/38/82/60/444388260.db2.gz	PWPWERWIHZRDIH-CYBMUJFWSA-N	-1	3	330.362	1.523	20	5		EDBDHM
CCCCS(=O)(=O)[N-]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000340584663	444449646	/nfs/dbraw/zinc/44/96/46/444449646.db2.gz	UZGWXGPZQYFRSI-UHFFFAOYSA-N	-1	3	340.361	1.864	20	5		EDBDHM
CN(C)CC[C@](C)(O)CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000579843461	321977890	/nfs/dbraw/zinc/97/78/90/321977890.db2.gz	HYMVOIJGMPLQHU-AWEZNQCLSA-N	-1	3	345.783	1.386	20	5		EDBDHM
COc1cc(C(=O)[N-]c2nc3ccccn3n2)cc([N+](=O)[O-])c1OC	ZINC000342684741	444812539	/nfs/dbraw/zinc/81/25/39/444812539.db2.gz	OCNPUGRNGLFRAC-UHFFFAOYSA-N	-1	3	343.299	1.907	20	5		EDBDHM
CCOc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)N1CC[C@@H](C)C1	ZINC000337131610	444955108	/nfs/dbraw/zinc/95/51/08/444955108.db2.gz	ACUIKEKBPKSSOZ-SNVBAGLBSA-N	-1	3	329.378	1.992	20	5		EDBDHM
CCOC(=O)c1ncc([N-]C(=O)c2nn(CC)cc2[N+](=O)[O-])s1	ZINC000341946353	445087670	/nfs/dbraw/zinc/08/76/70/445087670.db2.gz	IDNOKERSZQWECR-UHFFFAOYSA-N	-1	3	339.333	1.697	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@]1(C)CCOC1	ZINC000354506297	445269007	/nfs/dbraw/zinc/26/90/07/445269007.db2.gz	ZABPSFOTCGTULN-CYBMUJFWSA-N	-1	3	330.362	1.308	20	5		EDBDHM
Cc1ccsc1[C@H](CO)[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000354623243	445318463	/nfs/dbraw/zinc/31/84/63/445318463.db2.gz	LHYZBNFNWMBNHG-LBPRGKRZSA-N	-1	3	342.398	1.977	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C2(c3nc[nH]n3)CCC2)cc1[N+](=O)[O-]	ZINC000352079284	445477578	/nfs/dbraw/zinc/47/75/78/445477578.db2.gz	IEFSOYKPCSJHJQ-UHFFFAOYSA-N	-1	3	343.390	1.441	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@](C)(O)C2CC2)c1[N+](=O)[O-]	ZINC000360252538	445657798	/nfs/dbraw/zinc/65/77/98/445657798.db2.gz	WJHOBYZHPMGACG-AWEZNQCLSA-N	-1	3	328.390	1.651	20	5		EDBDHM
CO[C@]1(C[N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])CCOC1	ZINC000359230036	446060427	/nfs/dbraw/zinc/06/04/27/446060427.db2.gz	HWNSTHJBFZKSSH-AWEZNQCLSA-N	-1	3	344.389	1.295	20	5		EDBDHM
Cn1ccnc1-c1nnc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)s1	ZINC000365787699	446344502	/nfs/dbraw/zinc/34/45/02/446344502.db2.gz	RMCWFKNQXHTBJC-UHFFFAOYSA-N	-1	3	347.316	1.200	20	5		EDBDHM
CN1Cc2cc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)ccc2NC1=O	ZINC000370634706	446367391	/nfs/dbraw/zinc/36/73/91/446367391.db2.gz	LTOUTXSAESKXON-UHFFFAOYSA-N	-1	3	343.299	1.925	20	5		EDBDHM
CC[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCO1	ZINC000420718992	446767991	/nfs/dbraw/zinc/76/79/91/446767991.db2.gz	FWBSFHUDFVXSKT-KOLCDFICSA-N	-1	3	332.353	1.970	20	5		EDBDHM
CC[C@H](C)[C@@H](O)C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000443275831	447023454	/nfs/dbraw/zinc/02/34/54/447023454.db2.gz	YFJFCMCJFMSIHT-KWQFWETISA-N	-1	3	336.797	1.934	20	5		EDBDHM
C[C@]1(c2ccc(CNc3ncc([N+](=O)[O-])s3)cc2)NC(=O)[N-]C1=O	ZINC000443517660	447059189	/nfs/dbraw/zinc/05/91/89/447059189.db2.gz	JEPSSHZHRAUNKC-CQSZACIVSA-N	-1	3	347.356	1.718	20	5		EDBDHM
Cc1n[nH]cc1-c1nnc([N-]C(=O)c2c(N)cccc2[N+](=O)[O-])s1	ZINC000368736504	447076074	/nfs/dbraw/zinc/07/60/74/447076074.db2.gz	SPNNLXKGPFLWOE-UHFFFAOYSA-N	-1	3	345.344	1.979	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)c2ccn(C)n2)c1C	ZINC000416553579	447645595	/nfs/dbraw/zinc/64/55/95/447645595.db2.gz	CPFFQXNNYPOFQS-NSHDSACASA-N	-1	3	338.389	1.985	20	5		EDBDHM
CN1CC[C@@H](C[N-]S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1	ZINC000416493105	447624793	/nfs/dbraw/zinc/62/47/93/447624793.db2.gz	CNVAXSZVOOZWTK-VIFPVBQESA-N	-1	3	333.797	1.478	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1C[C@H](C)O[C@H]1C	ZINC000416594828	447656365	/nfs/dbraw/zinc/65/63/65/447656365.db2.gz	DSKHENQVVITTFE-DCAQKATOSA-N	-1	3	344.389	1.695	20	5		EDBDHM
CCC[C@@H](C)[C@@H](CO)[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000582790413	448341550	/nfs/dbraw/zinc/34/15/50/448341550.db2.gz	ORHSEYNPBIPCBF-ZYHUDNBSSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CC[C@@H](C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(=O)OC	ZINC000592077492	448664306	/nfs/dbraw/zinc/66/43/06/448664306.db2.gz	KAKBOAMAONVSHF-NSHDSACASA-N	-1	3	344.389	1.689	20	5		EDBDHM
CC(C)Oc1nc([N-]c2ccn(CC(=O)N(C)C)n2)ccc1[N+](=O)[O-]	ZINC000579024491	448699462	/nfs/dbraw/zinc/69/94/62/448699462.db2.gz	HSPQYGVDLGACFR-UHFFFAOYSA-N	-1	3	348.363	1.805	20	5		EDBDHM
O=C([O-])c1cc(N2CCC(CN3CCOCC3)CC2)ccc1[N+](=O)[O-]	ZINC000592969346	449090592	/nfs/dbraw/zinc/09/05/92/449090592.db2.gz	AAICTUUAXFUVKQ-UHFFFAOYSA-N	-1	3	349.387	1.842	20	5		EDBDHM
CC1(C)[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)[C@@H]2CCO[C@@H]21	ZINC000593550680	449342383	/nfs/dbraw/zinc/34/23/83/449342383.db2.gz	GSZCJRIPMGBDOD-WCQGTBRESA-N	-1	3	327.362	1.082	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]Cc2ccnc(C)n2)c(C)c1[N+](=O)[O-]	ZINC000598598988	449484836	/nfs/dbraw/zinc/48/48/36/449484836.db2.gz	LLYGFVIMSMTXDW-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
O=[N+]([O-])c1cccnc1S(=O)(=O)[N-]CC1CCN(C2CC2)CC1	ZINC000594769645	449683108	/nfs/dbraw/zinc/68/31/08/449683108.db2.gz	IZWLGWNEAPIRAN-UHFFFAOYSA-N	-1	3	340.405	1.143	20	5		EDBDHM
CO[C@@H](C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000594800815	449711405	/nfs/dbraw/zinc/71/14/05/449711405.db2.gz	LIWZKIKDDPNDNL-FZMZJTMJSA-N	-1	3	344.389	1.066	20	5		EDBDHM
O=C1[N-]C(=O)[C@@]2(CCCN(c3ccc4cnccc4c3[N+](=O)[O-])C2)N1	ZINC000599081705	449721440	/nfs/dbraw/zinc/72/14/40/449721440.db2.gz	UHFGULZLPNYCJE-INIZCTEOSA-N	-1	3	341.327	1.321	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2C[C@@H](O)C23CCC3)c1[N+](=O)[O-]	ZINC000594864337	449776328	/nfs/dbraw/zinc/77/63/28/449776328.db2.gz	MGMIRDOMTDWCTH-NWDGAFQWSA-N	-1	3	340.401	1.793	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-]CC1CC=CC1)OCCO2	ZINC000599385330	449935262	/nfs/dbraw/zinc/93/52/62/449935262.db2.gz	DPNGJFMISKVBLD-UHFFFAOYSA-N	-1	3	340.357	1.611	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1CCCC[C@@H]1OC	ZINC000619683229	450307866	/nfs/dbraw/zinc/30/78/66/450307866.db2.gz	GWUVEQFCXGHKJY-JQWIXIFHSA-N	-1	3	344.389	1.839	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)C[C@H]1CCOC1	ZINC000610739946	450317498	/nfs/dbraw/zinc/31/74/98/450317498.db2.gz	YAJBQWZCBURKJR-GHMZBOCLSA-N	-1	3	344.389	1.697	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]CC(=O)C(C)(C)C	ZINC000619497049	450491913	/nfs/dbraw/zinc/49/19/13/450491913.db2.gz	WSCFSJGIIUZTGH-UHFFFAOYSA-N	-1	3	330.362	1.497	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1CCOC[C@H]1C	ZINC000619499844	450492980	/nfs/dbraw/zinc/49/29/80/450492980.db2.gz	ZIGFLJSEBFEADM-NXEZZACHSA-N	-1	3	330.362	1.307	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C[C@](C)(O)C2CC2)cc1[N+](=O)[O-]	ZINC000751393427	578550170	/nfs/dbraw/zinc/55/01/70/578550170.db2.gz	PPAVNESDXITPAC-ZDUSSCGKSA-N	-1	3	348.808	1.996	20	5		EDBDHM
COCCN1CC[C@H](Nc2ccc(/C=C\C(=O)[O-])cc2[N+](=O)[O-])C1	ZINC000737809955	578655999	/nfs/dbraw/zinc/65/59/99/578655999.db2.gz	GUQYHDRPKODOFJ-DXTPNHAXSA-N	-1	3	335.360	1.825	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)c1ccc[nH]1	ZINC000760406949	580030119	/nfs/dbraw/zinc/03/01/19/580030119.db2.gz	VAJVMGVCONHADD-SECBINFHSA-N	-1	3	325.346	1.971	20	5		EDBDHM
COc1ccc(OCCn2cc(-c3nnn[n-]3)cn2)c([N+](=O)[O-])c1	ZINC000737110909	579047973	/nfs/dbraw/zinc/04/79/73/579047973.db2.gz	DUDSHAYBTWHAFR-UHFFFAOYSA-N	-1	3	331.292	1.059	20	5		EDBDHM
COc1ccc(OCCn2cc(-c3nn[n-]n3)cn2)c([N+](=O)[O-])c1	ZINC000737110909	579047974	/nfs/dbraw/zinc/04/79/74/579047974.db2.gz	DUDSHAYBTWHAFR-UHFFFAOYSA-N	-1	3	331.292	1.059	20	5		EDBDHM
Cn1c(C(=O)NCc2ccc(-c3nnn[n-]3)cc2F)ccc1[N+](=O)[O-]	ZINC000737590046	579115775	/nfs/dbraw/zinc/11/57/75/579115775.db2.gz	FORAVAYXUZKDOE-UHFFFAOYSA-N	-1	3	345.294	1.183	20	5		EDBDHM
Cn1c(C(=O)NCc2ccc(-c3nn[n-]n3)cc2F)ccc1[N+](=O)[O-]	ZINC000737590046	579115776	/nfs/dbraw/zinc/11/57/76/579115776.db2.gz	FORAVAYXUZKDOE-UHFFFAOYSA-N	-1	3	345.294	1.183	20	5		EDBDHM
O=C([O-])c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1N1CCN2CCC[C@@H]2C1	ZINC000740096804	579289576	/nfs/dbraw/zinc/28/95/76/579289576.db2.gz	RAMAVRUOIOUQQO-SECBINFHSA-N	-1	3	336.304	1.486	20	5		EDBDHM
Cc1cc(C(=O)Nc2cccc(-c3nnn[n-]3)c2)c(N)c([N+](=O)[O-])c1	ZINC000749338001	579722293	/nfs/dbraw/zinc/72/22/93/579722293.db2.gz	LPAUOXRWNHQUQF-UHFFFAOYSA-N	-1	3	339.315	1.918	20	5		EDBDHM
Cc1cc(C(=O)Nc2cccc(-c3nn[n-]n3)c2)c(N)c([N+](=O)[O-])c1	ZINC000749338001	579722294	/nfs/dbraw/zinc/72/22/94/579722294.db2.gz	LPAUOXRWNHQUQF-UHFFFAOYSA-N	-1	3	339.315	1.918	20	5		EDBDHM
CN1CCC[C@@H]([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000778023229	580455116	/nfs/dbraw/zinc/45/51/16/580455116.db2.gz	HWIHLHQUWHVIIT-LLVKDONJSA-N	-1	3	327.287	1.424	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CCO)C2CC2)cc1C	ZINC000751444224	579807328	/nfs/dbraw/zinc/80/73/28/579807328.db2.gz	ZGKNPBHXLMLGTN-LBPRGKRZSA-N	-1	3	328.390	1.651	20	5		EDBDHM
CCO[C@H]1COCC[C@@H]1[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000759181453	580000315	/nfs/dbraw/zinc/00/03/15/580000315.db2.gz	WMIYZIWEAJIAMK-STQMWFEESA-N	-1	3	344.314	1.997	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCN2CCC[C@H]2C)cc1C	ZINC000780867545	580535971	/nfs/dbraw/zinc/53/59/71/580535971.db2.gz	MYVUTDRFLFFZDR-CYBMUJFWSA-N	-1	3	341.433	1.974	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H](C)C[C@@H](C)O)cc1[N+](=O)[O-]	ZINC000783000817	580591049	/nfs/dbraw/zinc/59/10/49/580591049.db2.gz	ZVBPTSVIVCBOPB-RKDXNWHRSA-N	-1	3	336.797	1.994	20	5		EDBDHM
O=[N+]([O-])c1cccc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])c1	ZINC000799536758	581030682	/nfs/dbraw/zinc/03/06/82/581030682.db2.gz	IJPDUMDWNUYAKM-UHFFFAOYSA-N	-1	3	339.289	1.203	20	5		EDBDHM
COC[C@H]1CN(Cc2ccc([O-])c(OC)c2[N+](=O)[O-])C[C@H](C)O1	ZINC000893899797	591129162	/nfs/dbraw/zinc/12/91/62/591129162.db2.gz	JBMRNHHOIAJZGP-CMPLNLGQSA-N	-1	3	326.349	1.545	20	5		EDBDHM
O=C(CNC(=O)c1ccc([O-])cc1)OCc1cccc([N+](=O)[O-])c1	ZINC000727538453	591758654	/nfs/dbraw/zinc/75/86/54/591758654.db2.gz	HAHSFVAINIOXKT-UHFFFAOYSA-N	-1	3	330.296	1.774	20	5		EDBDHM
COc1ccc(NC(=O)[C@@H](C)OC(=O)c2n[n-]nc2C)c([N+](=O)[O-])c1	ZINC000805546670	593465741	/nfs/dbraw/zinc/46/57/41/593465741.db2.gz	LJHCVEZISSNZIJ-MRVPVSSYSA-N	-1	3	349.303	1.214	20	5		EDBDHM
COCCOc1cc([N+](=O)[O-])c(C(=O)[N-]OCC2CC2)cc1OC	ZINC000817334445	593592968	/nfs/dbraw/zinc/59/29/68/593592968.db2.gz	KQOBKURSNDBSQH-UHFFFAOYSA-N	-1	3	340.332	1.700	20	5		EDBDHM
C[C@](O)(CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)c1ccco1	ZINC000820467576	593820942	/nfs/dbraw/zinc/82/09/42/593820942.db2.gz	JXNZMQHIFDGHGT-AWEZNQCLSA-N	-1	3	330.304	1.688	20	5		EDBDHM
C[C@](O)(CNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)c1ccco1	ZINC000820467576	593820943	/nfs/dbraw/zinc/82/09/43/593820943.db2.gz	JXNZMQHIFDGHGT-AWEZNQCLSA-N	-1	3	330.304	1.688	20	5		EDBDHM
CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc(-c2nnn[n-]2)cn1C	ZINC000821615885	593881657	/nfs/dbraw/zinc/88/16/57/593881657.db2.gz	SMQDONDJGBGXEK-UHFFFAOYSA-N	-1	3	341.331	1.386	20	5		EDBDHM
CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc(-c2nn[n-]n2)cn1C	ZINC000821615885	593881659	/nfs/dbraw/zinc/88/16/59/593881659.db2.gz	SMQDONDJGBGXEK-UHFFFAOYSA-N	-1	3	341.331	1.386	20	5		EDBDHM
COc1ccc(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cc1	ZINC000821825360	593949428	/nfs/dbraw/zinc/94/94/28/593949428.db2.gz	YFWQUJRVUAPGPP-UHFFFAOYSA-N	-1	3	327.304	1.791	20	5		EDBDHM
COc1ccc(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)cc1	ZINC000821825360	593949429	/nfs/dbraw/zinc/94/94/29/593949429.db2.gz	YFWQUJRVUAPGPP-UHFFFAOYSA-N	-1	3	327.304	1.791	20	5		EDBDHM
CCNC(=O)C(C)(C)CNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000821276406	594005735	/nfs/dbraw/zinc/00/57/35/594005735.db2.gz	KXZKBFFBDUUCCY-UHFFFAOYSA-N	-1	3	333.352	1.349	20	5		EDBDHM
CCNC(=O)C(C)(C)CNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000821276406	594005738	/nfs/dbraw/zinc/00/57/38/594005738.db2.gz	KXZKBFFBDUUCCY-UHFFFAOYSA-N	-1	3	333.352	1.349	20	5		EDBDHM
Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000822220301	594013102	/nfs/dbraw/zinc/01/31/02/594013102.db2.gz	LESKTKYMRYHGNG-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000822220301	594013104	/nfs/dbraw/zinc/01/31/04/594013104.db2.gz	LESKTKYMRYHGNG-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
C[C@](O)(CNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C(F)(F)F	ZINC000824679506	594055150	/nfs/dbraw/zinc/05/51/50/594055150.db2.gz	SWYXNLKDYKCGFE-JTQLQIEISA-N	-1	3	332.242	1.500	20	5		EDBDHM
C[C@](O)(CNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])C(F)(F)F	ZINC000824679506	594055152	/nfs/dbraw/zinc/05/51/52/594055152.db2.gz	SWYXNLKDYKCGFE-JTQLQIEISA-N	-1	3	332.242	1.500	20	5		EDBDHM
C[C@@H](OC(=O)c1c([N+](=O)[O-])cnn1C)c1ccc(-c2nnn[n-]2)cc1	ZINC000824713967	594060515	/nfs/dbraw/zinc/06/05/15/594060515.db2.gz	LPLZMXLUHPBFMY-MRVPVSSYSA-N	-1	3	343.303	1.426	20	5		EDBDHM
C[C@@H](OC(=O)c1c([N+](=O)[O-])cnn1C)c1ccc(-c2nn[n-]n2)cc1	ZINC000824713967	594060517	/nfs/dbraw/zinc/06/05/17/594060517.db2.gz	LPLZMXLUHPBFMY-MRVPVSSYSA-N	-1	3	343.303	1.426	20	5		EDBDHM
CC(C)(CCC(=O)Nc1ccc([C@]2(C)NC(=O)[N-]C2=O)cc1)[N+](=O)[O-]	ZINC000822528550	594063030	/nfs/dbraw/zinc/06/30/30/594063030.db2.gz	DOOFYKXRFADHMW-INIZCTEOSA-N	-1	3	348.359	1.515	20	5		EDBDHM
COC(=O)CCCO[N-]C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N	ZINC000825567288	594201494	/nfs/dbraw/zinc/20/14/94/594201494.db2.gz	HGYARHKMZNUGKT-UHFFFAOYSA-N	-1	3	346.727	1.837	20	5		EDBDHM
O=[N+]([O-])c1c(-c2nnn[n-]2)ccnc1N1CC[C@@H](N2CCCCC2)C1	ZINC000823619902	594221980	/nfs/dbraw/zinc/22/19/80/594221980.db2.gz	CUGCUYXMIUARNP-LLVKDONJSA-N	-1	3	344.379	1.235	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N[C@H]1CCCn2ncnc21	ZINC000823629724	594223007	/nfs/dbraw/zinc/22/30/07/594223007.db2.gz	FXEIRNYQWPMFHH-JTQLQIEISA-N	-1	3	327.308	1.313	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N[C@H]1CCCn2ncnc21	ZINC000823629724	594223008	/nfs/dbraw/zinc/22/30/08/594223008.db2.gz	FXEIRNYQWPMFHH-JTQLQIEISA-N	-1	3	327.308	1.313	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H](O)c2ccccc2)c(-c2nnn[n-]2)c1	ZINC000823651684	594224669	/nfs/dbraw/zinc/22/46/69/594224669.db2.gz	NISIZKTYTPNTCX-GFCCVEGCSA-N	-1	3	327.304	1.315	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H](O)c2ccccc2)c(-c2nn[n-]n2)c1	ZINC000823651684	594224670	/nfs/dbraw/zinc/22/46/70/594224670.db2.gz	NISIZKTYTPNTCX-GFCCVEGCSA-N	-1	3	327.304	1.315	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCO[C@H](c3ccco3)C2)c(-c2nnn[n-]2)c1	ZINC000823651806	594224834	/nfs/dbraw/zinc/22/48/34/594224834.db2.gz	RDQVDXQBNRILQL-LBPRGKRZSA-N	-1	3	343.303	1.341	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCO[C@H](c3ccco3)C2)c(-c2nn[n-]n2)c1	ZINC000823651806	594224835	/nfs/dbraw/zinc/22/48/35/594224835.db2.gz	RDQVDXQBNRILQL-LBPRGKRZSA-N	-1	3	343.303	1.341	20	5		EDBDHM
COc1ccc(CN(C)c2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cn1	ZINC000826192784	594370251	/nfs/dbraw/zinc/37/02/51/594370251.db2.gz	ATYLISNQDQTTHZ-UHFFFAOYSA-N	-1	3	342.319	1.210	20	5		EDBDHM
COc1ccc(CN(C)c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)cn1	ZINC000826192784	594370254	/nfs/dbraw/zinc/37/02/54/594370254.db2.gz	ATYLISNQDQTTHZ-UHFFFAOYSA-N	-1	3	342.319	1.210	20	5		EDBDHM
Cn1ncc([N+](=O)[O-])c1C(=O)OCc1cccc(-c2nnn[n-]2)c1F	ZINC000826366358	594447504	/nfs/dbraw/zinc/44/75/04/594447504.db2.gz	DUSNGOQBWARJNT-UHFFFAOYSA-N	-1	3	347.266	1.005	20	5		EDBDHM
Cn1ncc([N+](=O)[O-])c1C(=O)OCc1cccc(-c2nn[n-]n2)c1F	ZINC000826366358	594447505	/nfs/dbraw/zinc/44/75/05/594447505.db2.gz	DUSNGOQBWARJNT-UHFFFAOYSA-N	-1	3	347.266	1.005	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N[C@H]3CCOC3)cc(-c3nnn[n-]3)c2c1	ZINC000826499329	594503650	/nfs/dbraw/zinc/50/36/50/594503650.db2.gz	FBCIQYKCGYETNM-QMMMGPOBSA-N	-1	3	327.304	1.524	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N[C@H]3CCOC3)cc(-c3nn[n-]n3)c2c1	ZINC000826499329	594503652	/nfs/dbraw/zinc/50/36/52/594503652.db2.gz	FBCIQYKCGYETNM-QMMMGPOBSA-N	-1	3	327.304	1.524	20	5		EDBDHM
C[C@@H](Cn1cccn1)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848580311	595408000	/nfs/dbraw/zinc/40/80/00/595408000.db2.gz	MLVASPGJBYEQBU-JTQLQIEISA-N	-1	3	340.286	1.968	20	5		EDBDHM
C[C@H](Cn1ccnc1)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848580687	595408258	/nfs/dbraw/zinc/40/82/58/595408258.db2.gz	DXUVWGWEXGTRHY-SNVBAGLBSA-N	-1	3	340.286	1.968	20	5		EDBDHM
O=C([N-][C@H]1CCN(C2CC2)C1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848583112	595408913	/nfs/dbraw/zinc/40/89/13/595408913.db2.gz	VYNKIKYVXMSWCQ-JTQLQIEISA-N	-1	3	341.314	1.919	20	5		EDBDHM
CN1C[C@@H]([N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000848584262	595409448	/nfs/dbraw/zinc/40/94/48/595409448.db2.gz	SBQNAWONBZXHBP-VIFPVBQESA-N	-1	3	343.286	1.303	20	5		EDBDHM
CC1(C[N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)OCCCO1	ZINC000848593139	595412586	/nfs/dbraw/zinc/41/25/86/595412586.db2.gz	YUZQNZPRUBVHPX-UHFFFAOYSA-N	-1	3	346.286	1.836	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1[C@H](C)OC(=O)[C@@H]1CCS(=O)(=O)[N-]1	ZINC000845374336	595486657	/nfs/dbraw/zinc/48/66/57/595486657.db2.gz	BMYJAOAEMCBFOP-CABZTGNLSA-N	-1	3	328.346	1.199	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C[C@@H]2CCC(=O)N2)c1	ZINC000849469633	595542832	/nfs/dbraw/zinc/54/28/32/595542832.db2.gz	LRATXCJUJFYDNT-QMMMGPOBSA-N	-1	3	347.780	1.114	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCC2SCCS2)nc1	ZINC000851849334	595946572	/nfs/dbraw/zinc/94/65/72/595946572.db2.gz	SUIQJKCKBRYYNP-UHFFFAOYSA-N	-1	3	335.432	1.464	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(F)c(C(=O)NCCCc2cc(=O)[nH][n-]2)c1F	ZINC000854483439	596093840	/nfs/dbraw/zinc/09/38/40/596093840.db2.gz	DXZRCBGFSMRUME-UHFFFAOYSA-N	-1	3	340.286	1.567	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1C[C@H](SC)C1	ZINC000867678663	596492455	/nfs/dbraw/zinc/49/24/55/596492455.db2.gz	XJOZTMXBGXLZHT-CZMCAQCFSA-N	-1	3	332.403	1.776	20	5		EDBDHM
CN(C)[C@@H](C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)c1ccco1	ZINC000119338101	596519610	/nfs/dbraw/zinc/51/96/10/596519610.db2.gz	UGWBILVGTULOBA-JTQLQIEISA-N	-1	3	345.402	1.831	20	5		EDBDHM
CC(C)(C(=O)[O-])N1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000863469900	596591684	/nfs/dbraw/zinc/59/16/84/596591684.db2.gz	OCDUPZCJTYJUGH-AWEZNQCLSA-N	-1	3	337.376	1.109	20	5		EDBDHM
O=C([N-]C[C@@H](O)[C@@H]1CCCO1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000863497532	596600000	/nfs/dbraw/zinc/60/00/00/596600000.db2.gz	WMIOFAABIBAIKO-NEPJUHHUSA-N	-1	3	346.286	1.223	20	5		EDBDHM
C[C@](O)(C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)c1ccsc1	ZINC000119839133	596749581	/nfs/dbraw/zinc/74/95/81/596749581.db2.gz	ZIBPSWJAXIYHKE-NSHDSACASA-N	-1	3	348.427	1.904	20	5		EDBDHM
Cc1cc(F)ccc1S(=O)(=O)NN=c1[n-]cccc1[N+](=O)[O-]	ZINC000125549218	596950110	/nfs/dbraw/zinc/95/01/10/596950110.db2.gz	KVWPYVQHEYFRFF-UHFFFAOYSA-N	-1	3	326.309	1.743	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H](O)C2CCCCC2)c(-c2nnn[n-]2)c1	ZINC000738369771	598521384	/nfs/dbraw/zinc/52/13/84/598521384.db2.gz	OAXJBFMXBFMAIG-GFCCVEGCSA-N	-1	3	333.352	1.523	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H](O)C2CCCCC2)c(-c2nn[n-]n2)c1	ZINC000738369771	598521386	/nfs/dbraw/zinc/52/13/86/598521386.db2.gz	OAXJBFMXBFMAIG-GFCCVEGCSA-N	-1	3	333.352	1.523	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1cc(-c2ccco2)[n-]n1	ZINC000917944088	697109090	/nfs/dbraw/zinc/10/90/90/697109090.db2.gz	BBESCUWLGKKVLM-UHFFFAOYSA-N	-1	3	331.288	1.940	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1cc(-c2ccco2)n[n-]1	ZINC000917944088	697109093	/nfs/dbraw/zinc/10/90/93/697109093.db2.gz	BBESCUWLGKKVLM-UHFFFAOYSA-N	-1	3	331.288	1.940	20	5		EDBDHM
CC[C@](C)(O)C[N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl	ZINC000183692947	529377981	/nfs/dbraw/zinc/37/79/81/529377981.db2.gz	FSXLSLAWASFXKB-LBPRGKRZSA-N	-1	3	336.797	1.996	20	5		EDBDHM
CC(C)N1CCC[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000435442222	305140413	/nfs/dbraw/zinc/14/04/13/305140413.db2.gz	HHBNBADQZGZQRL-SNVBAGLBSA-N	-1	3	333.435	1.807	20	5		EDBDHM
CS[C@H]1CN(c2nccc(C(=O)[O-])c2[N+](=O)[O-])C[C@H]1N(C)C	ZINC000563205198	306323501	/nfs/dbraw/zinc/32/35/01/306323501.db2.gz	RUOULYKZPMZJBY-ZJUUUORDSA-N	-1	3	326.378	1.170	20	5		EDBDHM
COc1ncccc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000066327608	201157398	/nfs/dbraw/zinc/15/73/98/201157398.db2.gz	DJSFBSCYRWQDCF-UHFFFAOYSA-N	-1	3	329.359	1.538	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1CCCCC1	ZINC000273146540	201255053	/nfs/dbraw/zinc/25/50/53/201255053.db2.gz	LAICPEQEWQKWLM-UHFFFAOYSA-N	-1	3	342.373	1.992	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCC(=O)N[C@@H]2C)cc1C	ZINC000282575652	201330325	/nfs/dbraw/zinc/33/03/25/201330325.db2.gz	PDYRLEORHFCOIT-GHMZBOCLSA-N	-1	3	341.389	1.157	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)CCCCO)c([N+](=O)[O-])c1	ZINC000295683363	201350900	/nfs/dbraw/zinc/35/09/00/201350900.db2.gz	IJFFKFIXWDNKNK-SNVBAGLBSA-N	-1	3	332.378	1.433	20	5		EDBDHM
COc1cc(CNCCC(C)(C)S(C)(=O)=O)c([N+](=O)[O-])cc1[O-]	ZINC000414516686	304121712	/nfs/dbraw/zinc/12/17/12/304121712.db2.gz	PSBSOYONUPBJOX-UHFFFAOYSA-N	-1	3	346.405	1.612	20	5		EDBDHM
O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCc2c(=O)[n-]cnc2C1	ZINC000566448602	306413886	/nfs/dbraw/zinc/41/38/86/306413886.db2.gz	AKWDFFAQFXIWRN-UONOGXRCSA-N	-1	3	340.339	1.779	20	5		EDBDHM
Cc1nc(C)c(CCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(=O)[n-]1	ZINC000073314078	203263983	/nfs/dbraw/zinc/26/39/83/203263983.db2.gz	GVDPREUTEQZOQN-UHFFFAOYSA-N	-1	3	342.355	1.817	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@]1(O)CCc2ccccc21	ZINC000077180399	203374270	/nfs/dbraw/zinc/37/42/70/203374270.db2.gz	FOJWWWXBUNGBGK-INIZCTEOSA-N	-1	3	348.380	1.707	20	5		EDBDHM
Cc1noc(C)c1C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000130947425	205265817	/nfs/dbraw/zinc/26/58/17/205265817.db2.gz	QPSAHVLDYPBKQB-UHFFFAOYSA-N	-1	3	325.346	1.819	20	5		EDBDHM
CCC(=O)N1CC[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000133213095	205362048	/nfs/dbraw/zinc/36/20/48/205362048.db2.gz	ATZAIZABGZPCLY-SECBINFHSA-N	-1	3	345.352	1.023	20	5		EDBDHM
Cc1cc(C)c(S(=O)(=O)[N-]Cc2ccnc(C)n2)cc1[N+](=O)[O-]	ZINC000493496809	255212120	/nfs/dbraw/zinc/21/21/20/255212120.db2.gz	CKBGDJBLGLFHMK-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
CCOC(=O)[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])[C@@H](C)CC	ZINC000266312933	139528999	/nfs/dbraw/zinc/52/89/99/139528999.db2.gz	QANQUWXFTUFRRT-GWCFXTLKSA-N	-1	3	344.389	1.851	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H](OC)C(C)C	ZINC000266755656	139556721	/nfs/dbraw/zinc/55/67/21/139556721.db2.gz	RNRCMWANBPNPFQ-LBPRGKRZSA-N	-1	3	332.378	1.553	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]CC1=CCCOC1	ZINC000344955650	143030673	/nfs/dbraw/zinc/03/06/73/143030673.db2.gz	OXMPPBBUGLAMCZ-UHFFFAOYSA-N	-1	3	332.765	1.873	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]Cc1nc(CO)cs1	ZINC000347393173	143316258	/nfs/dbraw/zinc/31/62/58/143316258.db2.gz	SMMPWAVQFGFRDN-UHFFFAOYSA-N	-1	3	343.386	1.163	20	5		EDBDHM
COc1ccc([O-])c(C(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1	ZINC000369678410	155133568	/nfs/dbraw/zinc/13/35/68/155133568.db2.gz	CSYDMHSDONYODO-UHFFFAOYSA-N	-1	3	346.343	1.983	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-][C@@H](CO)CC(F)(F)F	ZINC000352938618	149222302	/nfs/dbraw/zinc/22/23/02/149222302.db2.gz	GKVXFSMTDKEECN-SECBINFHSA-N	-1	3	342.295	1.328	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)[C@H]2CCCOC2)c([N+](=O)[O-])c1	ZINC000355722349	150374695	/nfs/dbraw/zinc/37/46/95/150374695.db2.gz	DVCBQBBFNHFGFO-MNOVXSKESA-N	-1	3	344.389	1.697	20	5		EDBDHM
COCCOC[C@@H](C)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000360573038	152103933	/nfs/dbraw/zinc/10/39/33/152103933.db2.gz	ZFDXDLKRGJOVIZ-GFCCVEGCSA-N	-1	3	346.405	1.541	20	5		EDBDHM
Cc1cc(C(=O)N[C@@H]2CCN(c3ccccn3)C2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000367114529	154012736	/nfs/dbraw/zinc/01/27/36/154012736.db2.gz	OXZHWNSOPNLZEX-LLVKDONJSA-N	-1	3	343.343	1.408	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCc2cnn(C)c2)cc1[N+](=O)[O-]	ZINC000123214709	222236151	/nfs/dbraw/zinc/23/61/51/222236151.db2.gz	VOGYQIGKWBECNI-UHFFFAOYSA-N	-1	3	330.391	1.219	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCCC[C@H]2O)cc1[N+](=O)[O-]	ZINC000275039985	268270136	/nfs/dbraw/zinc/27/01/36/268270136.db2.gz	FHOJHHGNSAAUJV-ZYHUDNBSSA-N	-1	3	348.352	1.324	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2C[C@@H](O)C2(C)C)cc1[N+](=O)[O-]	ZINC000275404603	268337729	/nfs/dbraw/zinc/33/77/29/268337729.db2.gz	ONQLPJGEWIDVFJ-WDEREUQCSA-N	-1	3	348.352	1.180	20	5		EDBDHM
CCC(O)(CC)CC[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000276248395	273155040	/nfs/dbraw/zinc/15/50/40/273155040.db2.gz	QMFOAWSTOFBBAF-UHFFFAOYSA-N	-1	3	346.405	1.823	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCOC[C@H]1C	ZINC000278015483	273240770	/nfs/dbraw/zinc/24/07/70/273240770.db2.gz	WEODMAWWNFIXNI-MWLCHTKSSA-N	-1	3	330.362	1.307	20	5		EDBDHM
COc1ccc(-n2c([O-])c(CC(F)(F)F)[nH]c2=O)cc1[N+](=O)[O-]	ZINC000278074284	273247090	/nfs/dbraw/zinc/24/70/90/273247090.db2.gz	JQFZRDPFEXKCPH-ZETCQYMHSA-N	-1	3	333.222	1.981	20	5		EDBDHM
CN(C)CC1([N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])CCC1	ZINC000281576645	276758401	/nfs/dbraw/zinc/75/84/01/276758401.db2.gz	PVSDQLVVDBFALQ-UHFFFAOYSA-N	-1	3	331.369	1.497	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCCC[C@H]2O)c1C	ZINC000158478244	301859783	/nfs/dbraw/zinc/85/97/83/301859783.db2.gz	QYAYVTRBOCRMJO-DGCLKSJQSA-N	-1	3	328.390	1.793	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C)C1CCOCC1	ZINC000132946457	302049447	/nfs/dbraw/zinc/04/94/47/302049447.db2.gz	GTBZUIIFOXPGBZ-LLVKDONJSA-N	-1	3	328.390	1.997	20	5		EDBDHM
CC(C)(O)C(C)(C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000393550627	303852450	/nfs/dbraw/zinc/85/24/50/303852450.db2.gz	XRHOOSZCPPWGNH-UHFFFAOYSA-N	-1	3	334.369	1.809	20	5		EDBDHM
Cn1cc(Cl)c(C[N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)n1	ZINC000451799834	305369799	/nfs/dbraw/zinc/36/97/99/305369799.db2.gz	IBQDSGPYNOWASZ-UHFFFAOYSA-N	-1	3	344.780	1.601	20	5		EDBDHM
CCc1ncc(C[N-]S(=O)(=O)CCc2ccccc2[N+](=O)[O-])o1	ZINC000451954358	305373816	/nfs/dbraw/zinc/37/38/16/305373816.db2.gz	AKZNFLCRDJBHTR-UHFFFAOYSA-N	-1	3	339.373	1.807	20	5		EDBDHM
NC(=O)c1ccc(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000046550128	441114213	/nfs/dbraw/zinc/11/42/13/441114213.db2.gz	JRVCPMSSWFYHMD-UHFFFAOYSA-N	-1	3	335.341	1.172	20	5		EDBDHM
Nc1ccc(C(=O)[N-]N2C(=O)NC3(CCCCC3)C2=O)cc1[N+](=O)[O-]	ZINC000017114436	441237064	/nfs/dbraw/zinc/23/70/64/441237064.db2.gz	HWHDTHWWUVGBJN-UHFFFAOYSA-N	-1	3	347.331	1.077	20	5		EDBDHM
CN(CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1)C1CCCC1	ZINC000104755268	441205066	/nfs/dbraw/zinc/20/50/66/441205066.db2.gz	YDBMZTQMZUGZNO-UHFFFAOYSA-N	-1	3	333.435	1.809	20	5		EDBDHM
CCC[C@H](O)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl	ZINC000119264805	441925089	/nfs/dbraw/zinc/92/50/89/441925089.db2.gz	ZAICISLYOOSDOK-VIFPVBQESA-N	-1	3	336.797	1.996	20	5		EDBDHM
C[C@H](O)C[N-]S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000123108356	441876101	/nfs/dbraw/zinc/87/61/01/441876101.db2.gz	UNGSRROTBQRAKL-LURJTMIESA-N	-1	3	339.167	1.016	20	5		EDBDHM
COCCCN1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2[O-])CC1	ZINC000179474061	442462209	/nfs/dbraw/zinc/46/22/09/442462209.db2.gz	GSMDRPXWCJFVQL-UHFFFAOYSA-N	-1	3	337.376	1.531	20	5		EDBDHM
CCC[C@@](C)([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000268573886	443038787	/nfs/dbraw/zinc/03/87/87/443038787.db2.gz	RQTKHZBLNLWTHZ-CQSZACIVSA-N	-1	3	344.389	1.746	20	5		EDBDHM
CN(CCCN1CCN(C)CC1)C(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000184770127	443074061	/nfs/dbraw/zinc/07/40/61/443074061.db2.gz	CJBZTQFVVHERAV-UHFFFAOYSA-N	-1	3	336.392	1.010	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cnc1N1CCN(C(=O)c2cccc([O-])c2)CC1	ZINC000266453661	443131596	/nfs/dbraw/zinc/13/15/96/443131596.db2.gz	XSBORBWIFWJZOC-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CCc1nc(-c2ccc3n[n-]nc3c2)no1	ZINC000350478072	319050522	/nfs/dbraw/zinc/05/05/22/319050522.db2.gz	GYYGTRUESDTPKL-UHFFFAOYSA-N	-1	3	340.303	1.664	20	5		EDBDHM
CCCCS(=O)(=O)[N-]Cc1nc(-c2ccc([N+](=O)[O-])s2)no1	ZINC000350829703	319073122	/nfs/dbraw/zinc/07/31/22/319073122.db2.gz	BCQHLWOWVXJOPK-UHFFFAOYSA-N	-1	3	346.390	1.926	20	5		EDBDHM
CC(C)(C)OC(=O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000265266883	443589502	/nfs/dbraw/zinc/58/95/02/443589502.db2.gz	ZOOSRKRIOVDBPA-UHFFFAOYSA-N	-1	3	334.325	1.354	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1C[C@H]1C	ZINC000273159084	443552844	/nfs/dbraw/zinc/55/28/44/443552844.db2.gz	NHLXHBBCXOSDNN-RKDXNWHRSA-N	-1	3	328.346	1.316	20	5		EDBDHM
CC1(C)CCCN1C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000281015951	443796775	/nfs/dbraw/zinc/79/67/75/443796775.db2.gz	SUIIHJZDEFLWMT-UHFFFAOYSA-N	-1	3	341.389	1.274	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1C(=O)[N-]N1C(=O)NC2(CCCCC2)C1=O	ZINC000276578681	443753689	/nfs/dbraw/zinc/75/36/89/443753689.db2.gz	ODSGQKQPEURIBP-UHFFFAOYSA-N	-1	3	346.343	1.803	20	5		EDBDHM
O=c1nc(C2CCN(CCOc3ccccc3[N+](=O)[O-])CC2)[nH][n-]1	ZINC000281052701	443805565	/nfs/dbraw/zinc/80/55/65/443805565.db2.gz	QZKDXOMXULKUJX-UHFFFAOYSA-N	-1	3	333.348	1.265	20	5		EDBDHM
CC[C@@H](C)c1nc([C@H](C)NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)n[nH]1	ZINC000277076140	443903615	/nfs/dbraw/zinc/90/36/15/443903615.db2.gz	OALUDGFEFLWORP-SFYZADRCSA-N	-1	3	334.336	1.818	20	5		EDBDHM
CO[C@H]1C[C@@H](CN2CCCC2)N(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)C1	ZINC000331525125	444475684	/nfs/dbraw/zinc/47/56/84/444475684.db2.gz	ZVHISLSAFXQHED-KBPBESRZSA-N	-1	3	349.387	1.626	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CCC[C@@]1(C)CO	ZINC000331188680	444436780	/nfs/dbraw/zinc/43/67/80/444436780.db2.gz	PQTCVIWXWWTFNB-JSGCOSHPSA-N	-1	3	328.390	1.733	20	5		EDBDHM
CS[C@H](CO)[C@@H](C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000342493960	444715613	/nfs/dbraw/zinc/71/56/13/444715613.db2.gz	SISAPWVKFXMVQO-HZGVNTEJSA-N	-1	3	340.448	1.355	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CCC(=O)NC2(C)C)cc1[N+](=O)[O-]	ZINC000338429449	444690566	/nfs/dbraw/zinc/69/05/66/444690566.db2.gz	KHUSLNPTEBQMLU-VIFPVBQESA-N	-1	3	347.418	1.300	20	5		EDBDHM
C[C@H]1[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCCN1C	ZINC000344060788	444757853	/nfs/dbraw/zinc/75/78/53/444757853.db2.gz	LSUNYZSGFOBRTP-JOYOIKCWSA-N	-1	3	331.369	1.495	20	5		EDBDHM
O=C([N-]c1nc2cc3c(cc2s1)OCCO3)c1n[nH]cc1[N+](=O)[O-]	ZINC000343082419	445048535	/nfs/dbraw/zinc/04/85/35/445048535.db2.gz	RUQONYOIYBVTRS-UHFFFAOYSA-N	-1	3	347.312	1.951	20	5		EDBDHM
O=C(c1cc(F)cc2[n-]nnc21)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000337442406	445082652	/nfs/dbraw/zinc/08/26/52/445082652.db2.gz	DOPNNEDJGZZDBK-UHFFFAOYSA-N	-1	3	342.290	1.599	20	5		EDBDHM
O=C(c1cc(F)cc2nn[n-]c21)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000337442406	445082656	/nfs/dbraw/zinc/08/26/56/445082656.db2.gz	DOPNNEDJGZZDBK-UHFFFAOYSA-N	-1	3	342.290	1.599	20	5		EDBDHM
O=C(c1cc(F)cc2n[n-]nc21)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000337442406	445082663	/nfs/dbraw/zinc/08/26/63/445082663.db2.gz	DOPNNEDJGZZDBK-UHFFFAOYSA-N	-1	3	342.290	1.599	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC2(C(F)F)CC2)c([N+](=O)[O-])c1	ZINC000359781104	445425834	/nfs/dbraw/zinc/42/58/34/445425834.db2.gz	DPJQJBDNKLHTIE-UHFFFAOYSA-N	-1	3	336.316	1.927	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2CCCN(C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000360008746	445526009	/nfs/dbraw/zinc/52/60/09/445526009.db2.gz	YLXUMQFEXNZVJN-CHWSQXEVSA-N	-1	3	341.433	1.973	20	5		EDBDHM
CC(C)OC(=O)CC[C@H](C)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000360024028	445532876	/nfs/dbraw/zinc/53/28/76/445532876.db2.gz	MJHYOFKVLFXBCN-NSHDSACASA-N	-1	3	344.389	1.993	20	5		EDBDHM
CCC[C@@H]([N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C(=O)OC	ZINC000360021928	445533147	/nfs/dbraw/zinc/53/31/47/445533147.db2.gz	GHDXMIZNPMSQMV-LLVKDONJSA-N	-1	3	344.389	1.832	20	5		EDBDHM
O=C(Nc1ccc(-c2cnccn2)cn1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000366451643	446221624	/nfs/dbraw/zinc/22/16/24/446221624.db2.gz	GZQKNGPFWNGPFE-UHFFFAOYSA-N	-1	3	338.283	1.800	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1[n-]nnc1C(=O)NC1CC1	ZINC000411104936	446400129	/nfs/dbraw/zinc/40/01/29/446400129.db2.gz	PZLIZNBGOMPIPT-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1nn[n-]c1C(=O)NC1CC1	ZINC000411104936	446400132	/nfs/dbraw/zinc/40/01/32/446400132.db2.gz	PZLIZNBGOMPIPT-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1n[n-]nc1C(=O)NC1CC1	ZINC000411104936	446400134	/nfs/dbraw/zinc/40/01/34/446400134.db2.gz	PZLIZNBGOMPIPT-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CCS(=O)(=O)[N-][C@@H]1CNCCC1(F)F	ZINC000420439926	446615155	/nfs/dbraw/zinc/61/51/55/446615155.db2.gz	GTXQXZOYPLVSMM-GFCCVEGCSA-N	-1	3	349.359	1.054	20	5		EDBDHM
Cc1cc(C(=O)N2CCC[C@H](n3cncn3)C2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375091313	446574067	/nfs/dbraw/zinc/57/40/67/446574067.db2.gz	RHKPIQKXWVFUSY-JTQLQIEISA-N	-1	3	332.320	1.073	20	5		EDBDHM
O=C(COc1cccc([N+](=O)[O-])c1)[N-]c1nncn1-c1cccnc1	ZINC000377164270	446963964	/nfs/dbraw/zinc/96/39/64/446963964.db2.gz	VRAUWZRLQTVWDU-UHFFFAOYSA-N	-1	3	340.299	1.588	20	5		EDBDHM
CC[C@H](C)[C@](C)(O)C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000443299544	447027171	/nfs/dbraw/zinc/02/71/71/447027171.db2.gz	RQTALIIPPMEBEY-SMDDNHRTSA-N	-1	3	330.406	1.979	20	5		EDBDHM
O=C(NC[C@H]1NCCc2ccccc21)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000375967791	447181597	/nfs/dbraw/zinc/18/15/97/447181597.db2.gz	FZEKRTXMMUJBQT-CQSZACIVSA-N	-1	3	327.340	1.917	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])c(OCC(=O)[N-]c2cc(C)no2)c1	ZINC000446065936	447224613	/nfs/dbraw/zinc/22/46/13/447224613.db2.gz	FMSCSTXXFPOQPK-UHFFFAOYSA-N	-1	3	335.272	1.695	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCc2cnc(C)cn2)c([N+](=O)[O-])c1	ZINC000416501924	447629083	/nfs/dbraw/zinc/62/90/83/447629083.db2.gz	NPAUWYGBEUZUDK-UHFFFAOYSA-N	-1	3	336.373	1.523	20	5		EDBDHM
NC(=O)c1ccc(C[N-]c2nc(-c3ccc([N+](=O)[O-])cc3)no2)o1	ZINC000486935914	447826551	/nfs/dbraw/zinc/82/65/51/447826551.db2.gz	DMWZFVTWAUGTMD-UHFFFAOYSA-N	-1	3	329.272	1.949	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCN1CC[C@H](C)C1	ZINC000525819456	448032105	/nfs/dbraw/zinc/03/21/05/448032105.db2.gz	OILDAUIJZHAYKX-NSHDSACASA-N	-1	3	327.406	1.523	20	5		EDBDHM
Cc1cc(NC[C@@H]2CCCN2CCCO)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000582491545	448254558	/nfs/dbraw/zinc/25/45/58/448254558.db2.gz	MMEKHYJZBZBTGJ-LBPRGKRZSA-N	-1	3	337.376	1.860	20	5		EDBDHM
CN(C)CCN1CCC(Nc2ncc(C(=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000573327545	448600856	/nfs/dbraw/zinc/60/08/56/448600856.db2.gz	PGUFJMSKBKNIQH-UHFFFAOYSA-N	-1	3	337.380	1.126	20	5		EDBDHM
Cc1cc(N2CCN(C[C@H]3CCOC3)CC2)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000519782102	448843770	/nfs/dbraw/zinc/84/37/70/448843770.db2.gz	YPOSVVDKYYMVFH-CYBMUJFWSA-N	-1	3	349.387	1.760	20	5		EDBDHM
Cc1cc(N2CCN(C[C@@H](C)O)[C@@H](C)C2)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000574403377	448866462	/nfs/dbraw/zinc/86/64/62/448866462.db2.gz	DIVGEFGNGPNHAL-NWDGAFQWSA-N	-1	3	337.376	1.493	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@@H](C)N2CCCC2)c([N+](=O)[O-])c1	ZINC000548043283	448974320	/nfs/dbraw/zinc/97/43/20/448974320.db2.gz	HRHRBCKHTNLHHB-GFCCVEGCSA-N	-1	3	327.406	1.666	20	5		EDBDHM
CC[C@@H](CO)N1CCN(c2cc(C)c([N+](=O)[O-])c(C(=O)[O-])c2)CC1	ZINC000592976889	449092559	/nfs/dbraw/zinc/09/25/59/449092559.db2.gz	GCBKYYCESHWHJV-LBPRGKRZSA-N	-1	3	337.376	1.494	20	5		EDBDHM
CC1(C)CCC[C@]1(O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593600023	449100592	/nfs/dbraw/zinc/10/05/92/449100592.db2.gz	GOLAXISDRHVEDE-ZDUSSCGKSA-N	-1	3	329.378	1.209	20	5		EDBDHM
CO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C12CCC2	ZINC000593605786	449103179	/nfs/dbraw/zinc/10/31/79/449103179.db2.gz	KQUWOCSVGFIVFB-GHMZBOCLSA-N	-1	3	327.362	1.226	20	5		EDBDHM
CO[C@@](C)([C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C1CC1	ZINC000593609865	449106882	/nfs/dbraw/zinc/10/68/82/449106882.db2.gz	YTSQHYZOXBLMDD-ZANVPECISA-N	-1	3	329.378	1.472	20	5		EDBDHM
CCC[C@@H](C)[C@@H](CO)[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000593624217	449114547	/nfs/dbraw/zinc/11/45/47/449114547.db2.gz	GRVSBNPOIJAQSR-GHMZBOCLSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CCN1C[C@H](C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)CC1=O	ZINC000593640915	449124612	/nfs/dbraw/zinc/12/46/12/449124612.db2.gz	JBPZLKOLFKWARR-VIFPVBQESA-N	-1	3	347.418	1.111	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CO)CC2CC2)c1C	ZINC000611110341	449171758	/nfs/dbraw/zinc/17/17/58/449171758.db2.gz	XASACILOHSRQAK-GFCCVEGCSA-N	-1	3	328.390	1.651	20	5		EDBDHM
C[C@H](CCc1ccco1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593526252	449325795	/nfs/dbraw/zinc/32/57/95/449325795.db2.gz	SPYZXSACCFFBQR-SNVBAGLBSA-N	-1	3	325.346	1.882	20	5		EDBDHM
COCCC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCC1	ZINC000593561769	449351129	/nfs/dbraw/zinc/35/11/29/449351129.db2.gz	FDTBEIOJRWEUKC-UHFFFAOYSA-N	-1	3	329.378	1.475	20	5		EDBDHM
CCOC(=O)c1c(F)cccc1[N-]C(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000611545511	449330822	/nfs/dbraw/zinc/33/08/22/449330822.db2.gz	YXGFGTMIRQAONX-UHFFFAOYSA-N	-1	3	336.279	1.896	20	5		EDBDHM
COCC1(C[N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])CC1	ZINC000594474871	449540020	/nfs/dbraw/zinc/54/00/20/449540020.db2.gz	OPGQQFMZUNZMHG-UHFFFAOYSA-N	-1	3	328.390	1.917	20	5		EDBDHM
Cc1ccnc(C[N-]S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)n1	ZINC000598734293	449569000	/nfs/dbraw/zinc/56/90/00/449569000.db2.gz	FEJLQQMBCDDROD-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-]C[C@H]1CCCO1	ZINC000594744028	449662238	/nfs/dbraw/zinc/66/22/38/449662238.db2.gz	GOCLFFBJNLTHLR-SNVBAGLBSA-N	-1	3	337.357	1.600	20	5		EDBDHM
C[C@H](CCCO)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594759529	449674274	/nfs/dbraw/zinc/67/42/74/449674274.db2.gz	LNPHNMPRHZYVAK-SNVBAGLBSA-N	-1	3	339.373	1.582	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-][C@H]1CCSC1	ZINC000594759512	449674612	/nfs/dbraw/zinc/67/46/12/449674612.db2.gz	ORPLQMSWSJCYEU-VIFPVBQESA-N	-1	3	339.398	1.927	20	5		EDBDHM
CCCCN(C)C[C@H](C)[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594779911	449691751	/nfs/dbraw/zinc/69/17/51/449691751.db2.gz	UKKVBUCUUWTFHW-NSHDSACASA-N	-1	3	330.410	1.389	20	5		EDBDHM
C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000599459380	449992327	/nfs/dbraw/zinc/99/23/27/449992327.db2.gz	IJZJURCFUHFBRH-DEKYYXRVSA-N	-1	3	328.390	1.826	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CO[C@H](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000599486168	450014848	/nfs/dbraw/zinc/01/48/48/450014848.db2.gz	ZQKOFYJPGAEZLK-MFKMUULPSA-N	-1	3	342.373	1.449	20	5		EDBDHM
COC(=O)[C@H]1C[C@H]([N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C1	ZINC000595401246	450114496	/nfs/dbraw/zinc/11/44/96/450114496.db2.gz	CRTKAKVLRYHHKA-XYPYZODXSA-N	-1	3	342.373	1.442	20	5		EDBDHM
CCn1nccc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000595414400	450126068	/nfs/dbraw/zinc/12/60/68/450126068.db2.gz	CPGZXIYYWNCFGP-UHFFFAOYSA-N	-1	3	344.780	1.943	20	5		EDBDHM
CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000597695084	450202879	/nfs/dbraw/zinc/20/28/79/450202879.db2.gz	PWASCSRSMLGOHR-KGLIPLIRSA-N	-1	3	335.360	1.236	20	5		EDBDHM
CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)CC[C@@H]1NC(=O)[N-]C1=O	ZINC000597726718	450223991	/nfs/dbraw/zinc/22/39/91/450223991.db2.gz	FVJWNTKAYVOELF-NSHDSACASA-N	-1	3	349.347	1.342	20	5		EDBDHM
CCOC(=O)C(C)(C)[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000619481326	450485364	/nfs/dbraw/zinc/48/53/64/450485364.db2.gz	FVNWXOFALOMWIJ-UHFFFAOYSA-N	-1	3	346.361	1.223	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC)C1CC1	ZINC000619492789	450489585	/nfs/dbraw/zinc/48/95/85/450489585.db2.gz	LAPKRGUVHTXPSA-JTQLQIEISA-N	-1	3	330.362	1.307	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1CCO[C@H](C)C1	ZINC000619494678	450491046	/nfs/dbraw/zinc/49/10/46/450491046.db2.gz	BBHAWWMVIZRPJE-ZJUUUORDSA-N	-1	3	330.362	1.449	20	5		EDBDHM
CCN1CCN([C@@H](C)CNC(=O)c2cc([O-])ccc2[N+](=O)[O-])CC1	ZINC000352865349	535728863	/nfs/dbraw/zinc/72/88/63/535728863.db2.gz	YVVMKVUYZPENSK-LBPRGKRZSA-N	-1	3	336.392	1.056	20	5		EDBDHM
O=C(COC(=O)c1cncc([O-])c1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000732390990	578708945	/nfs/dbraw/zinc/70/89/45/578708945.db2.gz	CPGAMZGOHHYGSB-UHFFFAOYSA-N	-1	3	335.247	1.630	20	5		EDBDHM
CC[C@@H](CO)Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000736355168	578980945	/nfs/dbraw/zinc/98/09/45/578980945.db2.gz	YQDXGMBYNARBKY-QMMMGPOBSA-N	-1	3	329.320	1.506	20	5		EDBDHM
CC[C@@H](CO)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000736355168	578980946	/nfs/dbraw/zinc/98/09/46/578980946.db2.gz	YQDXGMBYNARBKY-QMMMGPOBSA-N	-1	3	329.320	1.506	20	5		EDBDHM
CCOC[C@H]1CCCN(c2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)C1	ZINC000736611123	579006759	/nfs/dbraw/zinc/00/67/59/579006759.db2.gz	MOAIJFORFOBAKR-JTQLQIEISA-N	-1	3	333.352	1.423	20	5		EDBDHM
CCOC[C@H]1CCCN(c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)C1	ZINC000736611123	579006760	/nfs/dbraw/zinc/00/67/60/579006760.db2.gz	MOAIJFORFOBAKR-JTQLQIEISA-N	-1	3	333.352	1.423	20	5		EDBDHM
O=C(NCCc1ccccc1[N+](=O)[O-])c1ccc(-c2nnn[n-]2)cn1	ZINC000738089249	579158864	/nfs/dbraw/zinc/15/88/64/579158864.db2.gz	WNQNYMHRRDUTGO-UHFFFAOYSA-N	-1	3	339.315	1.142	20	5		EDBDHM
O=C(NCCc1ccccc1[N+](=O)[O-])c1ccc(-c2nn[n-]n2)cn1	ZINC000738089249	579158865	/nfs/dbraw/zinc/15/88/65/579158865.db2.gz	WNQNYMHRRDUTGO-UHFFFAOYSA-N	-1	3	339.315	1.142	20	5		EDBDHM
CN(CCc1ccc([N+](=O)[O-])cc1)CCN1CCN(C(=O)[O-])CC1	ZINC000739704105	579239050	/nfs/dbraw/zinc/23/90/50/579239050.db2.gz	IDXQEYZAXZSWQW-UHFFFAOYSA-N	-1	3	336.392	1.365	20	5		EDBDHM
C[C@@H]1CCN(CC[N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1	ZINC000745942247	579568069	/nfs/dbraw/zinc/56/80/69/579568069.db2.gz	CAZJQHQMQUNNGW-SNVBAGLBSA-N	-1	3	331.369	1.354	20	5		EDBDHM
CC1(C)CN(CC[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CCO1	ZINC000780853825	580535005	/nfs/dbraw/zinc/53/50/05/580535005.db2.gz	WWFWITHNCRUAKS-UHFFFAOYSA-N	-1	3	349.434	1.045	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@H](C)C[C@@H](C)O)c1	ZINC000782999154	580590934	/nfs/dbraw/zinc/59/09/34/580590934.db2.gz	QTPFUWLQXVOOOX-DTWKUNHWSA-N	-1	3	336.797	1.994	20	5		EDBDHM
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NCc1ncccc1[O-]	ZINC000800635375	581055930	/nfs/dbraw/zinc/05/59/30/581055930.db2.gz	ZSJLAGJUUMJRFE-UHFFFAOYSA-N	-1	3	348.290	1.398	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCO[C@H](C(F)(F)F)C1	ZINC000738360374	598855753	/nfs/dbraw/zinc/85/57/53/598855753.db2.gz	WCJDIFJIUULHNB-JTQLQIEISA-N	-1	3	344.253	1.542	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCO[C@H](C(F)(F)F)C1	ZINC000738360374	598855752	/nfs/dbraw/zinc/85/57/52/598855752.db2.gz	WCJDIFJIUULHNB-JTQLQIEISA-N	-1	3	344.253	1.542	20	5		EDBDHM
CCOCCN1CCN(Cc2ccc([O-])c(OC)c2[N+](=O)[O-])CC1	ZINC000891575755	591132411	/nfs/dbraw/zinc/13/24/11/591132411.db2.gz	HAWQREMIDZNDAB-UHFFFAOYSA-N	-1	3	339.392	1.463	20	5		EDBDHM
COc1c([O-])ccc(CN2CCOC[C@H]2[C@@H]2CCCO2)c1[N+](=O)[O-]	ZINC000894409320	591303508	/nfs/dbraw/zinc/30/35/08/591303508.db2.gz	NYVQSPQQSAXWQF-JSGCOSHPSA-N	-1	3	338.360	1.689	20	5		EDBDHM
O=C(OCc1cc(=O)[n-]c(C2CC2)n1)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000838283543	593149291	/nfs/dbraw/zinc/14/92/91/593149291.db2.gz	FBUXFINICVJNDE-CQSZACIVSA-N	-1	3	345.311	1.745	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H]2C[C@H](C)OC2=O)cc1[N+](=O)[O-]	ZINC000841523116	593163929	/nfs/dbraw/zinc/16/39/29/593163929.db2.gz	LBVGUGLIOQSSDR-IONNQARKSA-N	-1	3	348.764	1.539	20	5		EDBDHM
CC(C)(CO)[C@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C1CC1	ZINC000810107272	593383913	/nfs/dbraw/zinc/38/39/13/593383913.db2.gz	ZXULSPFRUUNSKR-LLVKDONJSA-N	-1	3	334.419	1.732	20	5		EDBDHM
COc1ccc(NC(=O)[C@H](C)OC(=O)c2n[n-]nc2C)c([N+](=O)[O-])c1	ZINC000805546671	593465721	/nfs/dbraw/zinc/46/57/21/593465721.db2.gz	LJHCVEZISSNZIJ-QMMMGPOBSA-N	-1	3	349.303	1.214	20	5		EDBDHM
COC(=O)[C@@H](CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)CC(C)C	ZINC000821640758	593892335	/nfs/dbraw/zinc/89/23/35/593892335.db2.gz	OKQBRJAQFRUPJM-SECBINFHSA-N	-1	3	349.351	1.417	20	5		EDBDHM
COC(=O)[C@@H](CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)CC(C)C	ZINC000821640758	593892337	/nfs/dbraw/zinc/89/23/37/593892337.db2.gz	OKQBRJAQFRUPJM-SECBINFHSA-N	-1	3	349.351	1.417	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccccc1-c1nnn[n-]1	ZINC000822471484	594053765	/nfs/dbraw/zinc/05/37/65/594053765.db2.gz	DJEXBXCYYHQRFH-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccccc1-c1nn[n-]n1	ZINC000822471484	594053766	/nfs/dbraw/zinc/05/37/66/594053766.db2.gz	DJEXBXCYYHQRFH-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
C[C@@]1(O)CCN(c2cc(-c3nnn[n-]3)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000824844411	594083244	/nfs/dbraw/zinc/08/32/44/594083244.db2.gz	XBFFFDXNUSKPBY-OAHLLOKOSA-N	-1	3	341.331	1.284	20	5		EDBDHM
C[C@@]1(O)CCN(c2cc(-c3nn[n-]n3)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000824844411	594083245	/nfs/dbraw/zinc/08/32/45/594083245.db2.gz	XBFFFDXNUSKPBY-OAHLLOKOSA-N	-1	3	341.331	1.284	20	5		EDBDHM
NC(=O)[C@H]1CCCCC[C@H]1Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000822860082	594112362	/nfs/dbraw/zinc/11/23/62/594112362.db2.gz	MXDVHTRUSGIXQE-CMPLNLGQSA-N	-1	3	345.363	1.621	20	5		EDBDHM
NC(=O)[C@H]1CCCCC[C@H]1Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000822860082	594112363	/nfs/dbraw/zinc/11/23/63/594112363.db2.gz	MXDVHTRUSGIXQE-CMPLNLGQSA-N	-1	3	345.363	1.621	20	5		EDBDHM
NC(=O)c1cc([N+](=O)[O-])cnc1Sc1cccc(-c2nnn[n-]2)c1	ZINC000822880187	594115945	/nfs/dbraw/zinc/11/59/45/594115945.db2.gz	KTGXDMYFZUNVSI-UHFFFAOYSA-N	-1	3	343.328	1.420	20	5		EDBDHM
NC(=O)c1cc([N+](=O)[O-])cnc1Sc1cccc(-c2nn[n-]n2)c1	ZINC000822880187	594115946	/nfs/dbraw/zinc/11/59/46/594115946.db2.gz	KTGXDMYFZUNVSI-UHFFFAOYSA-N	-1	3	343.328	1.420	20	5		EDBDHM
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)[C@@H](O)C(F)(F)F	ZINC000825146318	594136188	/nfs/dbraw/zinc/13/61/88/594136188.db2.gz	CFKPQMBJNIVGJE-PSASIEDQSA-N	-1	3	346.269	1.889	20	5		EDBDHM
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)[C@@H](O)C(F)(F)F	ZINC000825146318	594136189	/nfs/dbraw/zinc/13/61/89/594136189.db2.gz	CFKPQMBJNIVGJE-PSASIEDQSA-N	-1	3	346.269	1.889	20	5		EDBDHM
O=C(NCc1cc(-c2nnn[n-]2)ccc1F)c1ccc([N+](=O)[O-])[nH]1	ZINC000823242217	594174735	/nfs/dbraw/zinc/17/47/35/594174735.db2.gz	RMIYHWKSZMERHL-UHFFFAOYSA-N	-1	3	331.267	1.172	20	5		EDBDHM
O=C(NCc1cc(-c2nn[n-]n2)ccc1F)c1ccc([N+](=O)[O-])[nH]1	ZINC000823242217	594174737	/nfs/dbraw/zinc/17/47/37/594174737.db2.gz	RMIYHWKSZMERHL-UHFFFAOYSA-N	-1	3	331.267	1.172	20	5		EDBDHM
CN(CC(=O)OC(C)(C)C)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000825897995	594272015	/nfs/dbraw/zinc/27/20/15/594272015.db2.gz	UQCZTBKEARWCDR-UHFFFAOYSA-N	-1	3	334.336	1.553	20	5		EDBDHM
CN(CC(=O)OC(C)(C)C)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000825897995	594272016	/nfs/dbraw/zinc/27/20/16/594272016.db2.gz	UQCZTBKEARWCDR-UHFFFAOYSA-N	-1	3	334.336	1.553	20	5		EDBDHM
O=C([N-]OCC(F)F)c1cc([N+](=O)[O-])ncc1Br	ZINC000828467416	594428036	/nfs/dbraw/zinc/42/80/36/594428036.db2.gz	BIAUESKOEMQCKY-UHFFFAOYSA-N	-1	3	326.053	1.679	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@@H](CO)CC(F)(F)F)c(-c2nnn[n-]2)c1	ZINC000826499179	594502632	/nfs/dbraw/zinc/50/26/32/594502632.db2.gz	YRSKRNNHWHGJLL-ZCFIWIBFSA-N	-1	3	332.242	1.500	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@@H](CO)CC(F)(F)F)c(-c2nn[n-]n2)c1	ZINC000826499179	594502634	/nfs/dbraw/zinc/50/26/34/594502634.db2.gz	YRSKRNNHWHGJLL-ZCFIWIBFSA-N	-1	3	332.242	1.500	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(F)c(C(=O)[N-]Cc2nc(N(C)C)no2)c1F	ZINC000832405508	594748188	/nfs/dbraw/zinc/74/81/88/594748188.db2.gz	KEYUFMNKAOPESM-UHFFFAOYSA-N	-1	3	341.274	1.560	20	5		EDBDHM
Cc1noc(C)c1CCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000845893002	595090568	/nfs/dbraw/zinc/09/05/68/595090568.db2.gz	WJRYPMUEFAEVRE-UHFFFAOYSA-N	-1	3	340.361	1.506	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCc3ccccc3OC2)nc1	ZINC000845928585	595098224	/nfs/dbraw/zinc/09/82/24/595098224.db2.gz	XFZBNAYJQDVLMB-GFCCVEGCSA-N	-1	3	349.368	1.662	20	5		EDBDHM
NC(=O)[C@@H]1CC[C@H]([N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000848590537	595411347	/nfs/dbraw/zinc/41/13/47/595411347.db2.gz	FAZAJRWSCYLTNW-BDAKNGLRSA-N	-1	3	343.286	1.337	20	5		EDBDHM
O=C([N-]C[C@H]1CCCNC1=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848590493	595411696	/nfs/dbraw/zinc/41/16/96/595411696.db2.gz	DJOFFZSNYXLZGN-SECBINFHSA-N	-1	3	343.286	1.209	20	5		EDBDHM
Cn1[n-]c([C@H]2CCCN2c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])nc1=N	ZINC000853659758	595849159	/nfs/dbraw/zinc/84/91/59/595849159.db2.gz	LMJOAFYDOICBOP-SNVBAGLBSA-N	-1	3	333.308	1.386	20	5		EDBDHM
Cc1cnc(C[N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)o1	ZINC000856735467	596065554	/nfs/dbraw/zinc/06/55/54/596065554.db2.gz	UJGZYTVNEUYKIA-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2ccc3c(c2)CCO3)c(-c2nnn[n-]2)c1	ZINC000738374980	598248848	/nfs/dbraw/zinc/24/88/48/598248848.db2.gz	WNCXKOJUWXLKGA-UHFFFAOYSA-N	-1	3	339.315	1.717	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2ccc3c(c2)CCO3)c(-c2nn[n-]n2)c1	ZINC000738374980	598248850	/nfs/dbraw/zinc/24/88/50/598248850.db2.gz	WNCXKOJUWXLKGA-UHFFFAOYSA-N	-1	3	339.315	1.717	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@H]2Cn2cccn2)c(-c2nnn[n-]2)c1	ZINC000738368668	598502735	/nfs/dbraw/zinc/50/27/35/598502735.db2.gz	HWTKOIBVTRUZDH-JTQLQIEISA-N	-1	3	341.335	1.035	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@H]2Cn2cccn2)c(-c2nn[n-]n2)c1	ZINC000738368668	598502736	/nfs/dbraw/zinc/50/27/36/598502736.db2.gz	HWTKOIBVTRUZDH-JTQLQIEISA-N	-1	3	341.335	1.035	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H](O)Cc2ccccc2)c(-c2nnn[n-]2)c1	ZINC000738370128	598798204	/nfs/dbraw/zinc/79/82/04/598798204.db2.gz	QEWFMIBSZJVTIK-LBPRGKRZSA-N	-1	3	341.331	1.185	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H](O)Cc2ccccc2)c(-c2nn[n-]n2)c1	ZINC000738370128	598798205	/nfs/dbraw/zinc/79/82/05/598798205.db2.gz	QEWFMIBSZJVTIK-LBPRGKRZSA-N	-1	3	341.331	1.185	20	5		EDBDHM
O=C(NCCNC(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc([O-])cc1	ZINC000056848609	214391693	/nfs/dbraw/zinc/39/16/93/214391693.db2.gz	FUPYDJCZVLHLDI-UHFFFAOYSA-N	-1	3	347.302	1.599	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]CCCn1ccnc1	ZINC000124513474	138327342	/nfs/dbraw/zinc/32/73/42/138327342.db2.gz	SQNPPAGYSKCXSX-UHFFFAOYSA-N	-1	3	344.780	1.813	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H](CO)c2ccccc2)cc1[N+](=O)[O-]	ZINC000124239434	138325110	/nfs/dbraw/zinc/32/51/10/138325110.db2.gz	QQMJSVRIHYPHPI-LLVKDONJSA-N	-1	3	342.398	1.977	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC(=O)NC(C)(C)C	ZINC000046033650	201106518	/nfs/dbraw/zinc/10/65/18/201106518.db2.gz	QNSAXDUTXCLOQJ-UHFFFAOYSA-N	-1	3	329.378	1.096	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)C1CC1	ZINC000273155928	201255221	/nfs/dbraw/zinc/25/52/21/201255221.db2.gz	MTNXZIYKWKJTNK-QMMMGPOBSA-N	-1	3	328.346	1.458	20	5		EDBDHM
Cc1nc([C@H](C)[N-]S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)n[nH]1	ZINC000285477870	201333746	/nfs/dbraw/zinc/33/37/46/201333746.db2.gz	VPFNDZQKKJXANF-ZETCQYMHSA-N	-1	3	343.340	1.508	20	5		EDBDHM
CN(CCCN1CCN(C)CC1)C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000130510694	205243824	/nfs/dbraw/zinc/24/38/24/205243824.db2.gz	IOGKAXVWZAPFIR-UHFFFAOYSA-N	-1	3	336.392	1.010	20	5		EDBDHM
C[C@@H](CN(C)c1ncc([N+](=O)[O-])cc1Br)c1nnn[n-]1	ZINC000132915313	205348575	/nfs/dbraw/zinc/34/85/75/205348575.db2.gz	IZVYTUBOBONPFB-LURJTMIESA-N	-1	3	342.157	1.505	20	5		EDBDHM
C[C@@H](CN(C)c1ncc([N+](=O)[O-])cc1Br)c1nn[n-]n1	ZINC000132915313	205348578	/nfs/dbraw/zinc/34/85/78/205348578.db2.gz	IZVYTUBOBONPFB-LURJTMIESA-N	-1	3	342.157	1.505	20	5		EDBDHM
C[C@@H]1CC([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C[C@@H](C)O1	ZINC000162970997	206429872	/nfs/dbraw/zinc/42/98/72/206429872.db2.gz	ZHLGJKWOTZUAQN-RKDXNWHRSA-N	-1	3	332.353	1.968	20	5		EDBDHM
O=C(NCc1ccccc1[N+](=O)[O-])c1ccc2c(c1)C(=O)[N-]C2=O	ZINC000104853010	206431166	/nfs/dbraw/zinc/43/11/66/206431166.db2.gz	USJKRUNEPSCBKD-UHFFFAOYSA-N	-1	3	325.280	1.408	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@@H]2CC23CC3)cc1[N+](=O)[O-]	ZINC000416653567	251096633	/nfs/dbraw/zinc/09/66/33/251096633.db2.gz	UKARLSUKFDQVNM-QMMMGPOBSA-N	-1	3	330.337	1.821	20	5		EDBDHM
COC(=O)Cc1n[n-]c(NC(=O)C=Cc2ccc(F)cc2[N+](=O)[O-])n1	ZINC000491848833	255152327	/nfs/dbraw/zinc/15/23/27/255152327.db2.gz	UNMSZKKKLJPBLE-HYXAFXHYSA-N	-1	3	349.278	1.219	20	5		EDBDHM
COC(=O)Cc1nnc(NC(=O)C=Cc2ccc(F)cc2[N+](=O)[O-])[n-]1	ZINC000491848833	255152328	/nfs/dbraw/zinc/15/23/28/255152328.db2.gz	UNMSZKKKLJPBLE-HYXAFXHYSA-N	-1	3	349.278	1.219	20	5		EDBDHM
COC(=O)Cc1nc(NC(=O)C=Cc2ccc(F)cc2[N+](=O)[O-])n[n-]1	ZINC000491848833	255152329	/nfs/dbraw/zinc/15/23/29/255152329.db2.gz	UNMSZKKKLJPBLE-HYXAFXHYSA-N	-1	3	349.278	1.219	20	5		EDBDHM
COC(=O)c1cncc(NC(=O)c2n[n-]c3ccc([N+](=O)[O-])cc32)c1	ZINC000494668467	255256776	/nfs/dbraw/zinc/25/67/76/255256776.db2.gz	RLAPAUJPSFQEEN-UHFFFAOYSA-N	-1	3	341.283	1.905	20	5		EDBDHM
CC(C)(C)C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000263975682	139373344	/nfs/dbraw/zinc/37/33/44/139373344.db2.gz	DEWRPZRKZPIIOG-UHFFFAOYSA-N	-1	3	330.362	1.690	20	5		EDBDHM
CC(C)[C@@H](C)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000263991384	139374398	/nfs/dbraw/zinc/37/43/98/139374398.db2.gz	KHZJNJKISBORHQ-SECBINFHSA-N	-1	3	330.362	1.689	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCCC(C)(C)CO	ZINC000269823070	140000985	/nfs/dbraw/zinc/00/09/85/140000985.db2.gz	WLHJUDVZLOTWTI-UHFFFAOYSA-N	-1	3	346.405	1.680	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2(O)CCOCC2)cc1C	ZINC000269843924	140005048	/nfs/dbraw/zinc/00/50/48/140005048.db2.gz	WGBQYRYEPZDZPP-UHFFFAOYSA-N	-1	3	344.389	1.031	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@]2(C)CCCO2)c([N+](=O)[O-])c1	ZINC000331354701	141010848	/nfs/dbraw/zinc/01/08/48/141010848.db2.gz	ZYEBPTZCMDHNHH-ZDUSSCGKSA-N	-1	3	330.362	1.451	20	5		EDBDHM
O=[N+]([O-])c1cccc(CS(=O)(=O)[N-][C@@H](CO)CC(F)(F)F)c1	ZINC000339786660	142156045	/nfs/dbraw/zinc/15/60/45/142156045.db2.gz	TVIPDTCCMQAUFI-SECBINFHSA-N	-1	3	342.295	1.328	20	5		EDBDHM
O=c1[n-]nc([C@@H]2CCCN(CCOc3ccccc3[N+](=O)[O-])C2)o1	ZINC000340216403	142307151	/nfs/dbraw/zinc/30/71/51/142307151.db2.gz	PYNQIMZDSHOUFY-LLVKDONJSA-N	-1	3	334.332	1.942	20	5		EDBDHM
CSc1nnc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)[n-]1	ZINC000340261209	142323219	/nfs/dbraw/zinc/32/32/19/142323219.db2.gz	GWONROZAGLIXFE-UHFFFAOYSA-N	-1	3	345.344	1.873	20	5		EDBDHM
CSc1n[n-]c(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)n1	ZINC000340261209	142323220	/nfs/dbraw/zinc/32/32/20/142323220.db2.gz	GWONROZAGLIXFE-UHFFFAOYSA-N	-1	3	345.344	1.873	20	5		EDBDHM
CSc1nc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)n[n-]1	ZINC000340261209	142323221	/nfs/dbraw/zinc/32/32/21/142323221.db2.gz	GWONROZAGLIXFE-UHFFFAOYSA-N	-1	3	345.344	1.873	20	5		EDBDHM
Cn1c(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)nc2c1cccc2F	ZINC000345196442	143063129	/nfs/dbraw/zinc/06/31/29/143063129.db2.gz	AGAYEPOWZLSWCN-UHFFFAOYSA-N	-1	3	331.263	1.974	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1CC(C)C1	ZINC000345530113	143102346	/nfs/dbraw/zinc/10/23/46/143102346.db2.gz	VXRFANMYAZEJNA-UHFFFAOYSA-N	-1	3	328.346	1.458	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@@H](C)C(=O)OC(C)C)c([N+](=O)[O-])c1	ZINC000348028958	143393250	/nfs/dbraw/zinc/39/32/50/143393250.db2.gz	GZZVJXPOXCNJPD-LLVKDONJSA-N	-1	3	344.389	1.769	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CCC[C@@H](CO)C2)cc1[N+](=O)[O-]	ZINC000416645961	304341061	/nfs/dbraw/zinc/34/10/61/304341061.db2.gz	GJTJDVADQLXZGI-ZJUUUORDSA-N	-1	3	334.419	1.794	20	5		EDBDHM
CCO[C@H]1COCC[C@H]1[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000352978732	149237977	/nfs/dbraw/zinc/23/79/77/149237977.db2.gz	YEOOWJQUDDKBTH-YPMHNXCESA-N	-1	3	344.389	1.376	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H](C)C(=O)N2CCCC2)cc1[N+](=O)[O-]	ZINC000353208726	149325268	/nfs/dbraw/zinc/32/52/68/149325268.db2.gz	ZFKODBBQHCCICQ-MRVPVSSYSA-N	-1	3	347.418	1.254	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCO[C@@H]1C1CC1	ZINC000361177986	152326664	/nfs/dbraw/zinc/32/66/64/152326664.db2.gz	CLCCEIULIYKTBY-DGCLKSJQSA-N	-1	3	326.374	1.749	20	5		EDBDHM
CCC[C@@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(N)=O	ZINC000352527886	162231688	/nfs/dbraw/zinc/23/16/88/162231688.db2.gz	GJGWYDPUDNHMHZ-SNVBAGLBSA-N	-1	3	329.378	1.144	20	5		EDBDHM
CC(C)[C@@H](O)CC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000122038581	287376893	/nfs/dbraw/zinc/37/68/93/287376893.db2.gz	SXSVFFJFSIOYFN-NSHDSACASA-N	-1	3	336.797	1.934	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1)C1CC1	ZINC000275380453	268333533	/nfs/dbraw/zinc/33/35/33/268333533.db2.gz	MEGGQSSELVSXGN-NSHDSACASA-N	-1	3	348.352	1.446	20	5		EDBDHM
CN(C)CCOc1cc(-c2noc(-c3ccc([N+](=O)[O-])[n-]3)n2)ccn1	ZINC000273829293	273055608	/nfs/dbraw/zinc/05/56/08/273055608.db2.gz	DMVIQNRIWPKDKS-UHFFFAOYSA-N	-1	3	344.331	1.975	20	5		EDBDHM
COc1cc(CNCC2([S@@](C)=O)CCC2)c([N+](=O)[O-])cc1[O-]	ZINC000280607999	273377147	/nfs/dbraw/zinc/37/71/47/273377147.db2.gz	JXEIZUDCGPVFTM-JOCHJYFZSA-N	-1	3	328.390	1.700	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)n(C)n1	ZINC000284537385	274237342	/nfs/dbraw/zinc/23/73/42/274237342.db2.gz	DFPOSWJECCDXRZ-UHFFFAOYSA-N	-1	3	328.325	1.254	20	5		EDBDHM
CC(C)(C)[C@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000276841219	277247947	/nfs/dbraw/zinc/24/79/47/277247947.db2.gz	PUGILTOPEJWFPD-NSHDSACASA-N	-1	3	336.797	1.934	20	5		EDBDHM
O=C(c1c[n-]c(=O)c([N+](=O)[O-])c1)N1CCn2c3ccccc3nc21	ZINC000187932685	280227977	/nfs/dbraw/zinc/22/79/77/280227977.db2.gz	QMKHNNHFVUTURY-UHFFFAOYSA-N	-1	3	325.284	1.706	20	5		EDBDHM
C[C@H](NC(=O)CNC(=O)c1cccc([O-])c1)c1ccccc1[N+](=O)[O-]	ZINC000428023171	305004097	/nfs/dbraw/zinc/00/40/97/305004097.db2.gz	UTTCAJKONBUQOW-NSHDSACASA-N	-1	3	343.339	1.908	20	5		EDBDHM
O=C(c1c([O-])cccc1O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000447548009	305281847	/nfs/dbraw/zinc/28/18/47/305281847.db2.gz	GNKMAZRJRSSNNB-UHFFFAOYSA-N	-1	3	343.339	1.968	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1CC(C)(F)C1	ZINC000451634742	305357940	/nfs/dbraw/zinc/35/79/40/305357940.db2.gz	VOFUECQNHCCAIW-UHFFFAOYSA-N	-1	3	346.336	1.550	20	5		EDBDHM
CNC(=O)C[C@H](C)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000451953149	305373733	/nfs/dbraw/zinc/37/37/33/305373733.db2.gz	IHWSUGNUOOBZRC-JTQLQIEISA-N	-1	3	329.378	1.015	20	5		EDBDHM
CNC(=O)C[C@H](C)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000451961375	305374302	/nfs/dbraw/zinc/37/43/02/305374302.db2.gz	WSMZJWYUJQDZCX-JTQLQIEISA-N	-1	3	329.378	1.015	20	5		EDBDHM
CC(C)([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C1CC1	ZINC000536552724	306022354	/nfs/dbraw/zinc/02/23/54/306022354.db2.gz	UPNMOPWXEHRKBI-UHFFFAOYSA-N	-1	3	342.373	1.833	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCCCn1ccnc1	ZINC000538279778	306030383	/nfs/dbraw/zinc/03/03/83/306030383.db2.gz	MHEJLSCNPOJWNV-UHFFFAOYSA-N	-1	3	338.389	1.858	20	5		EDBDHM
C[C@H](NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccco1	ZINC000090015448	441614526	/nfs/dbraw/zinc/61/45/26/441614526.db2.gz	ZRZSSSHFKLTJGC-NSHDSACASA-N	-1	3	339.373	1.817	20	5		EDBDHM
COc1cc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)ccn1	ZINC000056013152	441682211	/nfs/dbraw/zinc/68/22/11/441682211.db2.gz	LAADIWSZTHZLSF-UHFFFAOYSA-N	-1	3	341.320	1.616	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CCC[C@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000160235163	441868526	/nfs/dbraw/zinc/86/85/26/441868526.db2.gz	SACILFQRKLULFL-QWRGUYRKSA-N	-1	3	341.389	1.226	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)N(C)C1CC1	ZINC000069129211	441895577	/nfs/dbraw/zinc/89/55/77/441895577.db2.gz	VDJVKWKKEFEPGK-VIFPVBQESA-N	-1	3	331.369	1.495	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](C)N(C)C2CC2)cc1C	ZINC000069128971	441895908	/nfs/dbraw/zinc/89/59/08/441895908.db2.gz	CRTYWZIJGVTBNA-GFCCVEGCSA-N	-1	3	341.433	1.973	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCn1cnnc1C1CC1	ZINC000125304381	442006849	/nfs/dbraw/zinc/00/68/49/442006849.db2.gz	JOEXPZBZIMHCHR-UHFFFAOYSA-N	-1	3	337.361	1.042	20	5		EDBDHM
CCN1CCC[C@@H]1C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000162200389	442073620	/nfs/dbraw/zinc/07/36/20/442073620.db2.gz	XENHJOXQJHNLQB-CYBMUJFWSA-N	-1	3	341.433	1.974	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c([N+](=O)[O-])c1	ZINC000153374707	442279204	/nfs/dbraw/zinc/27/92/04/442279204.db2.gz	DVTMAZOFFZZUSE-GDLCADMTSA-N	-1	3	340.401	1.995	20	5		EDBDHM
CS(=O)(=O)[N-]c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)ccc1F	ZINC000192665585	442674604	/nfs/dbraw/zinc/67/46/04/442674604.db2.gz	XLQAVFZHDNRSMA-UHFFFAOYSA-N	-1	3	343.292	1.951	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]Cc2ccc[nH]2)cc1[N+](=O)[O-]	ZINC000187277790	442666811	/nfs/dbraw/zinc/66/68/11/442666811.db2.gz	NDMHVQWUBRJRKP-UHFFFAOYSA-N	-1	3	329.309	1.549	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCN2CCCCC2)c1[N+](=O)[O-]	ZINC000189854781	443019760	/nfs/dbraw/zinc/01/97/60/443019760.db2.gz	ZADKIOJPSORHGZ-UHFFFAOYSA-N	-1	3	341.433	1.976	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](CO)CC(C)C)c1[N+](=O)[O-]	ZINC000189986781	443043547	/nfs/dbraw/zinc/04/35/47/443043547.db2.gz	KDMVPBUAFDOJSJ-LBPRGKRZSA-N	-1	3	330.406	1.897	20	5		EDBDHM
CCOC(=O)[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])[C@@H](C)CC	ZINC000266312934	443094247	/nfs/dbraw/zinc/09/42/47/443094247.db2.gz	QANQUWXFTUFRRT-GXFFZTMASA-N	-1	3	344.389	1.851	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-]CC1CCCC1)OCCO2	ZINC000264009719	443244792	/nfs/dbraw/zinc/24/47/92/443244792.db2.gz	RMOJZVSPDLLMJB-UHFFFAOYSA-N	-1	3	342.373	1.835	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)on1	ZINC000185497399	443208836	/nfs/dbraw/zinc/20/88/36/443208836.db2.gz	GZXUTQBUGCNSMB-UHFFFAOYSA-N	-1	3	348.340	1.918	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CCC[C@H]1O	ZINC000269295973	443270824	/nfs/dbraw/zinc/27/08/24/443270824.db2.gz	NQUKOULHPUZJLK-MWLCHTKSSA-N	-1	3	330.362	1.043	20	5		EDBDHM
C[N-]S(=O)(=O)c1ccc(CNc2ncc([N+](=O)[O-])cc2C)s1	ZINC000264467153	443301811	/nfs/dbraw/zinc/30/18/11/443301811.db2.gz	MHMYXGBZJPPNSV-UHFFFAOYSA-N	-1	3	342.402	1.880	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCCSC1	ZINC000267189089	443371446	/nfs/dbraw/zinc/37/14/46/443371446.db2.gz	LYDHGPDRWHZEGB-VIFPVBQESA-N	-1	3	332.403	1.777	20	5		EDBDHM
CC[C@@H](C)c1nc([C@@H](C)NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)n[nH]1	ZINC000277076129	443903227	/nfs/dbraw/zinc/90/32/27/443903227.db2.gz	OALUDGFEFLWORP-HTQZYQBOSA-N	-1	3	334.336	1.818	20	5		EDBDHM
Cc1nc([C@@H](C)[N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)n[nH]1	ZINC000285425206	443979435	/nfs/dbraw/zinc/97/94/35/443979435.db2.gz	QNQXQDXOSKVSTA-MRVPVSSYSA-N	-1	3	325.350	1.369	20	5		EDBDHM
C[C@H](C(=O)N1CCC[C@@H]1c1nc(=N)n(C)[n-]1)c1cccc([N+](=O)[O-])c1	ZINC000574405461	321482799	/nfs/dbraw/zinc/48/27/99/321482799.db2.gz	DIHVZNMHMSCGIR-GXFFZTMASA-N	-1	3	344.375	1.603	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCCC[C@@H]1O	ZINC000315051610	444303466	/nfs/dbraw/zinc/30/34/66/444303466.db2.gz	MHAZQMHYBNLGQO-MNOVXSKESA-N	-1	3	330.362	1.185	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2CO)cc1C	ZINC000312670628	444295005	/nfs/dbraw/zinc/29/50/05/444295005.db2.gz	MMARAPJLIDMKLZ-VXGBXAGGSA-N	-1	3	328.390	1.651	20	5		EDBDHM
COC(=O)C[C@H](C)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000313991413	444298640	/nfs/dbraw/zinc/29/86/40/444298640.db2.gz	ROARWYNTDFZQHM-ZETCQYMHSA-N	-1	3	336.753	1.478	20	5		EDBDHM
CCN1CCC([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])CC1	ZINC000337816834	444421147	/nfs/dbraw/zinc/42/11/47/444421147.db2.gz	RFMTXWYPKJAWON-UHFFFAOYSA-N	-1	3	327.406	1.666	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC[C@H]1CCOC1	ZINC000343992155	444714173	/nfs/dbraw/zinc/71/41/73/444714173.db2.gz	MRYNLWCCTAHWQB-JTQLQIEISA-N	-1	3	330.362	1.308	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@]1(C)CCO[C@H]1C	ZINC000343994845	444715885	/nfs/dbraw/zinc/71/58/85/444715885.db2.gz	WOLGBIMCPUJPRX-ZANVPECISA-N	-1	3	330.362	1.449	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCN2CCC[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000330426629	444976821	/nfs/dbraw/zinc/97/68/21/444976821.db2.gz	SWOPIAKJJZURIR-ZDUSSCGKSA-N	-1	3	341.433	1.913	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@]2(O)CCC[C@H]2C)cc1[N+](=O)[O-]	ZINC000339093198	445029409	/nfs/dbraw/zinc/02/94/09/445029409.db2.gz	BCRINOOSZXVKPB-PRHODGIISA-N	-1	3	334.419	1.794	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H](C)c2nncn2C)cc1[N+](=O)[O-]	ZINC000343462101	445227361	/nfs/dbraw/zinc/22/73/61/445227361.db2.gz	KLWUZJIDACJAMJ-ZCFIWIBFSA-N	-1	3	331.379	1.133	20	5		EDBDHM
CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1nnc(C(F)(F)F)[n-]1	ZINC000359680122	445372047	/nfs/dbraw/zinc/37/20/47/445372047.db2.gz	YNWZVSRATYGXCN-UHFFFAOYSA-N	-1	3	344.253	1.703	20	5		EDBDHM
CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1n[n-]c(C(F)(F)F)n1	ZINC000359680122	445372049	/nfs/dbraw/zinc/37/20/49/445372049.db2.gz	YNWZVSRATYGXCN-UHFFFAOYSA-N	-1	3	344.253	1.703	20	5		EDBDHM
CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1nc(C(F)(F)F)n[n-]1	ZINC000359680122	445372056	/nfs/dbraw/zinc/37/20/56/445372056.db2.gz	YNWZVSRATYGXCN-UHFFFAOYSA-N	-1	3	344.253	1.703	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC[C@@H]2CCOC2)c1[N+](=O)[O-]	ZINC000359988537	445516845	/nfs/dbraw/zinc/51/68/45/445516845.db2.gz	SUCFDBNFHYLANS-GFCCVEGCSA-N	-1	3	328.390	1.917	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2CCCN(C)[C@H]2C)c1[N+](=O)[O-]	ZINC000360008749	445526332	/nfs/dbraw/zinc/52/63/32/445526332.db2.gz	YLXUMQFEXNZVJN-STQMWFEESA-N	-1	3	341.433	1.973	20	5		EDBDHM
O=C(Nc1nc2c(s1)C(=O)CCC2)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000352680779	445548484	/nfs/dbraw/zinc/54/84/84/445548484.db2.gz	VGUKWCDRJLHGLO-UHFFFAOYSA-N	-1	3	334.313	1.923	20	5		EDBDHM
CCC[C@@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(=O)OC	ZINC000358616477	445677959	/nfs/dbraw/zinc/67/79/59/445677959.db2.gz	ZBDILBCBOBDXHZ-SNVBAGLBSA-N	-1	3	346.361	1.223	20	5		EDBDHM
C[C@H](Cn1ccnc1)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000350314655	445810259	/nfs/dbraw/zinc/81/02/59/445810259.db2.gz	NVGGGECGQQKTKU-SECBINFHSA-N	-1	3	344.780	1.812	20	5		EDBDHM
Cn1c2ccc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)cc2n(C)c1=O	ZINC000361917192	446065189	/nfs/dbraw/zinc/06/51/89/446065189.db2.gz	YBQYOUCREHOMRN-UHFFFAOYSA-N	-1	3	343.299	1.138	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H]2CCCOC2)c1[N+](=O)[O-]	ZINC000189876297	533707938	/nfs/dbraw/zinc/70/79/38/533707938.db2.gz	NVWQGFHPAHESGC-LBPRGKRZSA-N	-1	3	328.390	1.917	20	5		EDBDHM
NC(=O)N1CCc2cc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)ccc21	ZINC000362373861	446338970	/nfs/dbraw/zinc/33/89/70/446338970.db2.gz	QCYYTNOIANPDAA-UHFFFAOYSA-N	-1	3	343.299	1.389	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCCC2(O)CCC2)c([N+](=O)[O-])c1	ZINC000420714811	446767275	/nfs/dbraw/zinc/76/72/75/446767275.db2.gz	GJZMFYSZQFEIAU-UHFFFAOYSA-N	-1	3	328.390	1.877	20	5		EDBDHM
COc1cc(CN2CCC[C@@H]2c2nc(=N)n(C)[n-]2)ccc1[N+](=O)[O-]	ZINC000450905225	447613155	/nfs/dbraw/zinc/61/31/55/447613155.db2.gz	BTJWSFJNSALQKU-GFCCVEGCSA-N	-1	3	332.364	1.482	20	5		EDBDHM
CCO[C@@H]1COC[C@H]1[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000452033819	447806705	/nfs/dbraw/zinc/80/67/05/447806705.db2.gz	CKLCJFDHBSDTNN-PSASIEDQSA-N	-1	3	336.391	1.047	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCN2CC[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000525307670	447995001	/nfs/dbraw/zinc/99/50/01/447995001.db2.gz	FUIXNUGCPOHPRQ-NSHDSACASA-N	-1	3	343.405	1.224	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCn2ccnc2C1	ZINC000492023664	448159331	/nfs/dbraw/zinc/15/93/31/448159331.db2.gz	MVBHDRJMDKTUTO-LLVKDONJSA-N	-1	3	336.373	1.393	20	5		EDBDHM
O=C([O-])[C@]1(c2ccccc2)CCN(CCn2ccc([N+](=O)[O-])n2)C1	ZINC000518200262	448654761	/nfs/dbraw/zinc/65/47/61/448654761.db2.gz	IJYIDWRXSGJAPN-MRXNPFEDSA-N	-1	3	330.344	1.520	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H](C)N1CCCC1	ZINC000548370391	449033533	/nfs/dbraw/zinc/03/35/33/449033533.db2.gz	RDUSBSLCVVPKLY-GFCCVEGCSA-N	-1	3	327.406	1.666	20	5		EDBDHM
CC(C)O[C@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1(C)C	ZINC000593578325	449086618	/nfs/dbraw/zinc/08/66/18/449086618.db2.gz	SJDNTVOOCNLGNP-NEPJUHHUSA-N	-1	3	343.405	1.860	20	5		EDBDHM
COC[C@]1(C(=O)[O-])CCCN(Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000593751618	449179918	/nfs/dbraw/zinc/17/99/18/449179918.db2.gz	FUCRJKCBVZEQOW-INIZCTEOSA-N	-1	3	338.360	1.917	20	5		EDBDHM
C[C@]1(c2ccccc2)C[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593554054	449344407	/nfs/dbraw/zinc/34/44/07/449344407.db2.gz	XQKGFSVKAMVULZ-UKRRQHHQSA-N	-1	3	333.369	1.998	20	5		EDBDHM
CN(CCc1ccccn1)C(=O)CNc1cc[n-]c(=O)c1[N+](=O)[O-]	ZINC000596109622	449365831	/nfs/dbraw/zinc/36/58/31/449365831.db2.gz	ZNWYMDBFBKYHQP-UHFFFAOYSA-N	-1	3	331.332	1.203	20	5		EDBDHM
O=C(N1CCCC1)N1CCC[C@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C1	ZINC000596229388	449427964	/nfs/dbraw/zinc/42/79/64/449427964.db2.gz	AGXWDSBNEMQASJ-NSHDSACASA-N	-1	3	335.364	1.788	20	5		EDBDHM
COC[C@@H](CC(C)(C)C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000594477789	449543099	/nfs/dbraw/zinc/54/30/99/449543099.db2.gz	ARVQXRWHEFASOW-SNVBAGLBSA-N	-1	3	331.394	1.719	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC[C@@H]1CC1(F)F	ZINC000598621506	449498879	/nfs/dbraw/zinc/49/88/79/449498879.db2.gz	HKYPHNQIGJOIGV-MRVPVSSYSA-N	-1	3	336.316	1.927	20	5		EDBDHM
COC(=O)C(C)(C)n1cc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)cn1	ZINC000598774354	449595184	/nfs/dbraw/zinc/59/51/84/449595184.db2.gz	HIGOJZAKQPEFDO-UHFFFAOYSA-N	-1	3	349.303	1.052	20	5		EDBDHM
CCCN1CCC(C[N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])CC1	ZINC000594753909	449668216	/nfs/dbraw/zinc/66/82/16/449668216.db2.gz	WJWURGIXAIOPPK-UHFFFAOYSA-N	-1	3	342.421	1.390	20	5		EDBDHM
CC(C)(C)N1CC[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000594800605	449712324	/nfs/dbraw/zinc/71/23/24/449712324.db2.gz	HMKURQJGLYZQBQ-NSHDSACASA-N	-1	3	327.406	1.746	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@H]2CC[C@@H](C)O2)c(F)cc1[N+](=O)[O-]	ZINC000601434973	449956231	/nfs/dbraw/zinc/95/62/31/449956231.db2.gz	MBRHJNIXEZFWTF-ZJUUUORDSA-N	-1	3	332.353	1.888	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C1CCCC1	ZINC000599472416	450001183	/nfs/dbraw/zinc/00/11/83/450001183.db2.gz	GEHCPWHVDUIFEE-UHFFFAOYSA-N	-1	3	330.337	1.772	20	5		EDBDHM
CC1(C(=O)C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCCC1	ZINC000599473136	450002540	/nfs/dbraw/zinc/00/25/40/450002540.db2.gz	XVWIEXSXNRUVNP-UHFFFAOYSA-N	-1	3	327.362	1.418	20	5		EDBDHM
COc1cc(C[N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)on1	ZINC000595345957	450058983	/nfs/dbraw/zinc/05/89/83/450058983.db2.gz	RCIVIKZWNJDOFS-UHFFFAOYSA-N	-1	3	327.318	1.211	20	5		EDBDHM
COC(=O)c1ccc(S(=O)(=O)[N-][C@H]2CC[C@H](F)C2)cc1[N+](=O)[O-]	ZINC000416491533	491008969	/nfs/dbraw/zinc/00/89/69/491008969.db2.gz	ZOFMXWFFXMKJDT-IUCAKERBSA-N	-1	3	346.336	1.550	20	5		EDBDHM
C[C@H](Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@H](C)N1CCOCC1	ZINC000736136771	578956169	/nfs/dbraw/zinc/95/61/69/578956169.db2.gz	HJZNTAURFDCUDL-QWRGUYRKSA-N	-1	3	347.379	1.296	20	5		EDBDHM
C[C@H](Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])[C@H](C)N1CCOCC1	ZINC000736136771	578956170	/nfs/dbraw/zinc/95/61/70/578956170.db2.gz	HJZNTAURFDCUDL-QWRGUYRKSA-N	-1	3	347.379	1.296	20	5		EDBDHM
C[C@@H]1[C@@H](C)[S@@](=O)CCN1c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000736225248	578964697	/nfs/dbraw/zinc/96/46/97/578964697.db2.gz	PGSIRCIVFIQAMT-LVPZIMMTSA-N	-1	3	336.377	1.121	20	5		EDBDHM
C[C@@H]1[C@@H](C)[S@@](=O)CCN1c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000736225248	578964698	/nfs/dbraw/zinc/96/46/98/578964698.db2.gz	PGSIRCIVFIQAMT-LVPZIMMTSA-N	-1	3	336.377	1.121	20	5		EDBDHM
C[C@@H]1[C@@H](C)[S@](=O)CCN1c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000736225246	578964856	/nfs/dbraw/zinc/96/48/56/578964856.db2.gz	PGSIRCIVFIQAMT-DNKNOMGSSA-N	-1	3	336.377	1.121	20	5		EDBDHM
C[C@@H]1[C@@H](C)[S@](=O)CCN1c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000736225246	578964857	/nfs/dbraw/zinc/96/48/57/578964857.db2.gz	PGSIRCIVFIQAMT-DNKNOMGSSA-N	-1	3	336.377	1.121	20	5		EDBDHM
CO[C@@H](CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)c1ccccc1	ZINC000736963387	579036354	/nfs/dbraw/zinc/03/63/54/579036354.db2.gz	SJZDPWDQLMIAED-ZDUSSCGKSA-N	-1	3	341.331	1.970	20	5		EDBDHM
CO[C@@H](CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)c1ccccc1	ZINC000736963387	579036355	/nfs/dbraw/zinc/03/63/55/579036355.db2.gz	SJZDPWDQLMIAED-ZDUSSCGKSA-N	-1	3	341.331	1.970	20	5		EDBDHM
CO[C@H](CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)C(F)(F)F	ZINC000736964264	579036429	/nfs/dbraw/zinc/03/64/29/579036429.db2.gz	WMGPXLMUGLYZKH-SSDOTTSWSA-N	-1	3	333.230	1.159	20	5		EDBDHM
CO[C@H](CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)C(F)(F)F	ZINC000736964264	579036430	/nfs/dbraw/zinc/03/64/30/579036430.db2.gz	WMGPXLMUGLYZKH-SSDOTTSWSA-N	-1	3	333.230	1.159	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccncc1-c1nnn[n-]1	ZINC000737372801	579080337	/nfs/dbraw/zinc/08/03/37/579080337.db2.gz	KWVPWYQKKDFSNI-UHFFFAOYSA-N	-1	3	325.288	1.153	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccncc1-c1nn[n-]n1	ZINC000737372801	579080339	/nfs/dbraw/zinc/08/03/39/579080339.db2.gz	KWVPWYQKKDFSNI-UHFFFAOYSA-N	-1	3	325.288	1.153	20	5		EDBDHM
CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000737519124	579103610	/nfs/dbraw/zinc/10/36/10/579103610.db2.gz	GZIMIYOPWJJUDD-GJZGRUSLSA-N	-1	3	347.371	1.992	20	5		EDBDHM
Cc1noc(C)c1C[C@@H](C)Nc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000737536306	579106873	/nfs/dbraw/zinc/10/68/73/579106873.db2.gz	GBVJMHBPKHHBIS-SSDOTTSWSA-N	-1	3	344.335	1.818	20	5		EDBDHM
Cc1noc(C)c1C[C@@H](C)Nc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000737536306	579106874	/nfs/dbraw/zinc/10/68/74/579106874.db2.gz	GBVJMHBPKHHBIS-SSDOTTSWSA-N	-1	3	344.335	1.818	20	5		EDBDHM
CN1CCC[C@H]([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000778023231	580455127	/nfs/dbraw/zinc/45/51/27/580455127.db2.gz	HWIHLHQUWHVIIT-NSHDSACASA-N	-1	3	327.287	1.424	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C2CCC(C)(O)CC2)c([N+](=O)[O-])c1	ZINC000751482242	579809591	/nfs/dbraw/zinc/80/95/91/579809591.db2.gz	FZKKMUHBCSCYRG-UHFFFAOYSA-N	-1	3	344.389	1.575	20	5		EDBDHM
CCO[C@@H]1COCC[C@H]1[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000759181446	580000275	/nfs/dbraw/zinc/00/02/75/580000275.db2.gz	WMIYZIWEAJIAMK-CHWSQXEVSA-N	-1	3	344.314	1.997	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@@H]2COC3(CCCC3)O2)cs1	ZINC000768880437	580223296	/nfs/dbraw/zinc/22/32/96/580223296.db2.gz	IBTVEYOQEFRWKL-SECBINFHSA-N	-1	3	348.402	1.620	20	5		EDBDHM
CC(C)COC(=O)[C@H](C)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768882508	580223375	/nfs/dbraw/zinc/22/33/75/580223375.db2.gz	OSDVNBNHLUVGIM-QMMMGPOBSA-N	-1	3	336.391	1.522	20	5		EDBDHM
O=C([N-]C[C@@H](O)c1cccnc1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000778389735	580463991	/nfs/dbraw/zinc/46/39/91/580463991.db2.gz	IGFQXFJKOYIXBV-CYBMUJFWSA-N	-1	3	337.282	1.931	20	5		EDBDHM
COc1ccc(OC(=O)c2c[n-]nc2-c2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000781447680	580549964	/nfs/dbraw/zinc/54/99/64/580549964.db2.gz	HBTYNYYZIDFAJP-UHFFFAOYSA-N	-1	3	343.299	1.946	20	5		EDBDHM
CSc1nnc(NC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)[n-]1	ZINC000781956345	580561371	/nfs/dbraw/zinc/56/13/71/580561371.db2.gz	DFUPXVJZCASHNN-JTQLQIEISA-N	-1	3	348.344	1.567	20	5		EDBDHM
CSc1n[n-]c(NC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)n1	ZINC000781956345	580561372	/nfs/dbraw/zinc/56/13/72/580561372.db2.gz	DFUPXVJZCASHNN-JTQLQIEISA-N	-1	3	348.344	1.567	20	5		EDBDHM
CSc1nc(NC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)n[n-]1	ZINC000781956345	580561373	/nfs/dbraw/zinc/56/13/73/580561373.db2.gz	DFUPXVJZCASHNN-JTQLQIEISA-N	-1	3	348.344	1.567	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCN2CCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000790877490	580780433	/nfs/dbraw/zinc/78/04/33/580780433.db2.gz	ROYJYETVPFIQKS-ZDUSSCGKSA-N	-1	3	341.433	1.974	20	5		EDBDHM
CSCCO[N-]C(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000794184606	580879806	/nfs/dbraw/zinc/87/98/06/580879806.db2.gz	SNZGJQCEDOTBBM-UHFFFAOYSA-N	-1	3	329.334	1.846	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N[C@@H]1CCc2n[nH]cc2C1	ZINC000738357599	598896492	/nfs/dbraw/zinc/89/64/92/598896492.db2.gz	GFVSJEPTKBOMSI-SNVBAGLBSA-N	-1	3	326.320	1.467	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]C[C@H]1CC[C@H](C2CC2)O1	ZINC000907470683	592652086	/nfs/dbraw/zinc/65/20/86/592652086.db2.gz	SIGAATQOQLNUEA-UKRRQHHQSA-N	-1	3	340.401	1.972	20	5		EDBDHM
CC(=O)NC[C@@H]1CCCN(c2ccc(-c3nnn[n-]3)c([N+](=O)[O-])c2)C1	ZINC000819802566	593770302	/nfs/dbraw/zinc/77/03/02/593770302.db2.gz	FOGNQEYGRVVBLJ-NSHDSACASA-N	-1	3	345.363	1.127	20	5		EDBDHM
C[C@H](CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)CC1(C)OCCO1	ZINC000820280258	593805886	/nfs/dbraw/zinc/80/58/86/593805886.db2.gz	CCONXBCYBNQMJI-VIFPVBQESA-N	-1	3	349.351	1.371	20	5		EDBDHM
C[C@H](CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)CC1(C)OCCO1	ZINC000820280258	593805887	/nfs/dbraw/zinc/80/58/87/593805887.db2.gz	CCONXBCYBNQMJI-VIFPVBQESA-N	-1	3	349.351	1.371	20	5		EDBDHM
CN(C)[C@@H](CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)c1ccco1	ZINC000821581562	593868018	/nfs/dbraw/zinc/86/80/18/593868018.db2.gz	OXYACMVOAUVHKQ-NSHDSACASA-N	-1	3	344.335	1.478	20	5		EDBDHM
CN(C)[C@@H](CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)c1ccco1	ZINC000821581562	593868021	/nfs/dbraw/zinc/86/80/21/593868021.db2.gz	OXYACMVOAUVHKQ-NSHDSACASA-N	-1	3	344.335	1.478	20	5		EDBDHM
COC(=O)C1(CNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CCCC1	ZINC000821654281	593898554	/nfs/dbraw/zinc/89/85/54/593898554.db2.gz	ZFTGHCMMLRVEDA-UHFFFAOYSA-N	-1	3	346.347	1.920	20	5		EDBDHM
COC(=O)C1(CNc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CCCC1	ZINC000821654281	593898555	/nfs/dbraw/zinc/89/85/55/593898555.db2.gz	ZFTGHCMMLRVEDA-UHFFFAOYSA-N	-1	3	346.347	1.920	20	5		EDBDHM
C[C@H](O)C[C@H](C)Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000824699467	594058170	/nfs/dbraw/zinc/05/81/70/594058170.db2.gz	SWPRCPCYRFIOMD-IUCAKERBSA-N	-1	3	343.347	1.894	20	5		EDBDHM
C[C@H](O)C[C@H](C)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000824699467	594058172	/nfs/dbraw/zinc/05/81/72/594058172.db2.gz	SWPRCPCYRFIOMD-IUCAKERBSA-N	-1	3	343.347	1.894	20	5		EDBDHM
O=[N+]([O-])c1cc(NCCCOC2CCOCC2)ccc1-c1nnn[n-]1	ZINC000823635192	594223549	/nfs/dbraw/zinc/22/35/49/594223549.db2.gz	SKVLLLVCNDIAQP-UHFFFAOYSA-N	-1	3	348.363	1.773	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCC[C@H](O)c2ccccc2)c(-c2nnn[n-]2)c1	ZINC000823652006	594224919	/nfs/dbraw/zinc/22/49/19/594224919.db2.gz	VRFMRHYBSYSVIU-ZDUSSCGKSA-N	-1	3	341.331	1.706	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCC[C@H](O)c2ccccc2)c(-c2nn[n-]n2)c1	ZINC000823652006	594224920	/nfs/dbraw/zinc/22/49/20/594224920.db2.gz	VRFMRHYBSYSVIU-ZDUSSCGKSA-N	-1	3	341.331	1.706	20	5		EDBDHM
COc1ccc(NC(=O)c2ccc(-c3nnn[n-]3)cn2)cc1[N+](=O)[O-]	ZINC000826209786	594380366	/nfs/dbraw/zinc/38/03/66/594380366.db2.gz	QEGZTTGSFUEIAR-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
COc1ccc(NC(=O)c2ccc(-c3nn[n-]n3)cn2)cc1[N+](=O)[O-]	ZINC000826209786	594380368	/nfs/dbraw/zinc/38/03/68/594380368.db2.gz	QEGZTTGSFUEIAR-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
O=C(Nc1cc(-c2nnn[n-]2)cc([N+](=O)[O-])c1Cl)[C@H]1CCCO1	ZINC000826450302	594480374	/nfs/dbraw/zinc/48/03/74/594480374.db2.gz	FZHUTIBAWMFFLM-SECBINFHSA-N	-1	3	338.711	1.546	20	5		EDBDHM
O=C(Nc1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl)[C@H]1CCCO1	ZINC000826450302	594480375	/nfs/dbraw/zinc/48/03/75/594480375.db2.gz	FZHUTIBAWMFFLM-SECBINFHSA-N	-1	3	338.711	1.546	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOc2ncccc2F)c(-c2nnn[n-]2)c1	ZINC000826498579	594502517	/nfs/dbraw/zinc/50/25/17/594502517.db2.gz	BGSZRLJOYSCUJH-UHFFFAOYSA-N	-1	3	345.294	1.800	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOc2ncccc2F)c(-c2nn[n-]n2)c1	ZINC000826498579	594502518	/nfs/dbraw/zinc/50/25/18/594502518.db2.gz	BGSZRLJOYSCUJH-UHFFFAOYSA-N	-1	3	345.294	1.800	20	5		EDBDHM
O=[N+]([O-])c1cc(NCCOc2cccnc2)ccc1-c1nnn[n-]1	ZINC000826498269	594502580	/nfs/dbraw/zinc/50/25/80/594502580.db2.gz	NTVJOESJKMTLGY-UHFFFAOYSA-N	-1	3	327.304	1.661	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)[C@@H](O)C(F)F	ZINC000831894968	594709734	/nfs/dbraw/zinc/70/97/34/594709734.db2.gz	IVJJQNIGXFWIIA-POYBYMJQSA-N	-1	3	330.334	1.339	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]CC2(CF)CCOCC2)cs1	ZINC000832179928	594732888	/nfs/dbraw/zinc/73/28/88/594732888.db2.gz	JCGJPVJTGBMAAY-UHFFFAOYSA-N	-1	3	338.382	1.701	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]CCC2(CO)CC2)cc1[N+](=O)[O-]	ZINC000832451282	594751348	/nfs/dbraw/zinc/75/13/48/594751348.db2.gz	XGGADCDSFMNQJB-UHFFFAOYSA-N	-1	3	348.808	1.998	20	5		EDBDHM
Cc1nn(CN(C[C@H](C)C(=O)[O-])C2CC2)c2ncc([N+](=O)[O-])cc12	ZINC000833016860	594791572	/nfs/dbraw/zinc/79/15/72/594791572.db2.gz	KZAYBVKJZAZWNB-VIFPVBQESA-N	-1	3	333.348	1.791	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)OCc2cc(=O)[n-]c(C3CC3)n2)n1	ZINC000837665283	595164534	/nfs/dbraw/zinc/16/45/34/595164534.db2.gz	FPCNUKVCMUIWAD-UHFFFAOYSA-N	-1	3	333.304	1.541	20	5		EDBDHM
CN1CC[C@@H]2CN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3[O-])C[C@@H]2C1	ZINC000843891281	595209885	/nfs/dbraw/zinc/20/98/85/595209885.db2.gz	JYIPIUSQPTUKBT-ZJUUUORDSA-N	-1	3	339.779	1.978	20	5		EDBDHM
COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CCN(CC(=O)[O-])CC1	ZINC000844214213	595303620	/nfs/dbraw/zinc/30/36/20/595303620.db2.gz	UTZUUSGOZKNXHQ-UHFFFAOYSA-N	-1	3	346.343	1.358	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CC2(N(C)C)CC2)c1	ZINC000867439594	595322915	/nfs/dbraw/zinc/32/29/15/595322915.db2.gz	WPIQJVBXJNEGOI-UHFFFAOYSA-N	-1	3	347.824	1.929	20	5		EDBDHM
C[C@H](Cc1ccccn1)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000848492520	595395585	/nfs/dbraw/zinc/39/55/85/595395585.db2.gz	CTBQFIIXMASEOS-SECBINFHSA-N	-1	3	327.387	1.961	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)C(OC)OC	ZINC000849405247	595521392	/nfs/dbraw/zinc/52/13/92/595521392.db2.gz	GOIAABDGZJOEIF-CYBMUJFWSA-N	-1	3	346.405	1.454	20	5		EDBDHM
CN(CCN(C)c1cc[n-]c(=O)c1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000853466437	595759014	/nfs/dbraw/zinc/75/90/14/595759014.db2.gz	BOLIATHORQFKQL-UHFFFAOYSA-N	-1	3	326.353	1.999	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC2SCCS2)c(F)c1	ZINC000851831645	595939955	/nfs/dbraw/zinc/93/99/55/595939955.db2.gz	CJPFFHFFIKZUTC-UHFFFAOYSA-N	-1	3	338.407	1.818	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CCCN(CCF)C1	ZINC000867711217	596508961	/nfs/dbraw/zinc/50/89/61/596508961.db2.gz	IVZAKOHOKBUAJR-LBPRGKRZSA-N	-1	3	345.396	1.615	20	5		EDBDHM
O=C([N-]C[C@@H](O)[C@@H]1CCCO1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000863497615	596599844	/nfs/dbraw/zinc/59/98/44/596599844.db2.gz	YCDFBVRHWWMXRQ-NEPJUHHUSA-N	-1	3	346.286	1.223	20	5		EDBDHM
Cc1nn(C)c(Cl)c1S(=O)(=O)[N-]Cc1ccc([N+](=O)[O-])cc1	ZINC000056124743	214359970	/nfs/dbraw/zinc/35/99/70/214359970.db2.gz	VAXZABXXSBJNRG-UHFFFAOYSA-N	-1	3	344.780	1.769	20	5		EDBDHM
Cc1nnnn1-c1ccc(F)c([N-]C(=O)c2ccc([N+](=O)[O-])o2)c1	ZINC000068343478	215301339	/nfs/dbraw/zinc/30/13/39/215301339.db2.gz	MJYVJHFYTLPPRF-UHFFFAOYSA-N	-1	3	332.251	1.863	20	5		EDBDHM
CN(C)[C@@H](CNC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)c1ccc(F)cc1	ZINC000186980306	236085640	/nfs/dbraw/zinc/08/56/40/236085640.db2.gz	MNGMFDLGUUMJSQ-AWEZNQCLSA-N	-1	3	348.334	1.867	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CO[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000564906078	306369282	/nfs/dbraw/zinc/36/92/82/306369282.db2.gz	HSEXZEBDANHHGP-YUMQZZPRSA-N	-1	3	334.325	1.198	20	5		EDBDHM
CS[C@@H](CO)[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000223589259	139021229	/nfs/dbraw/zinc/02/12/29/139021229.db2.gz	WBYZPMBYHQCQDJ-XVKPBYJWSA-N	-1	3	338.382	1.125	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C)C(=O)NC(C)C	ZINC000416622424	251088892	/nfs/dbraw/zinc/08/88/92/251088892.db2.gz	LYTXVVPQZLJCSE-SNVBAGLBSA-N	-1	3	329.378	1.095	20	5		EDBDHM
CCCCN(C)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000112363987	220314971	/nfs/dbraw/zinc/31/49/71/220314971.db2.gz	WCSCEERTPDIOGN-UHFFFAOYSA-N	-1	3	333.385	1.744	20	5		EDBDHM
COC(=O)Cc1n[n-]c(NC(=O)C=Cc2ccccc2[N+](=O)[O-])n1	ZINC000491841939	255151551	/nfs/dbraw/zinc/15/15/51/255151551.db2.gz	DGIKAQYDKXRKGS-VOTSOKGWSA-N	-1	3	331.288	1.080	20	5		EDBDHM
COC(=O)Cc1nnc(NC(=O)C=Cc2ccccc2[N+](=O)[O-])[n-]1	ZINC000491841939	255151552	/nfs/dbraw/zinc/15/15/52/255151552.db2.gz	DGIKAQYDKXRKGS-VOTSOKGWSA-N	-1	3	331.288	1.080	20	5		EDBDHM
COC(=O)Cc1nc(NC(=O)C=Cc2ccccc2[N+](=O)[O-])n[n-]1	ZINC000491841939	255151553	/nfs/dbraw/zinc/15/15/53/255151553.db2.gz	DGIKAQYDKXRKGS-VOTSOKGWSA-N	-1	3	331.288	1.080	20	5		EDBDHM
CCOC[C@H](C)[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	ZINC000494318769	255245762	/nfs/dbraw/zinc/24/57/62/255245762.db2.gz	ZGNYDULBLWEOHZ-QMMMGPOBSA-N	-1	3	336.341	1.446	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CCC(C)(C)O1	ZINC000494366994	255248110	/nfs/dbraw/zinc/24/81/10/255248110.db2.gz	JLRIERDICNLXDN-NSHDSACASA-N	-1	3	344.389	1.839	20	5		EDBDHM
CNC(=O)c1nn[n-]c1NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1	ZINC000415798045	304273512	/nfs/dbraw/zinc/27/35/12/304273512.db2.gz	BXNMTCMLWLARLX-UHFFFAOYSA-N	-1	3	348.319	1.112	20	5		EDBDHM
CNC(=O)c1[n-]nnc1NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1	ZINC000415798045	304273514	/nfs/dbraw/zinc/27/35/14/304273514.db2.gz	BXNMTCMLWLARLX-UHFFFAOYSA-N	-1	3	348.319	1.112	20	5		EDBDHM
CNC(=O)c1n[n-]nc1NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1	ZINC000415798045	304273516	/nfs/dbraw/zinc/27/35/16/304273516.db2.gz	BXNMTCMLWLARLX-UHFFFAOYSA-N	-1	3	348.319	1.112	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCNCc1ccccc1	ZINC000116922510	221010780	/nfs/dbraw/zinc/01/07/80/221010780.db2.gz	YTAVOOPMMQZZPE-UHFFFAOYSA-N	-1	3	335.385	1.663	20	5		EDBDHM
C[C@@H](C(=O)N1CCc2nc[n-]c(=O)c2C1)c1ccc([N+](=O)[O-])cc1F	ZINC000185126303	533221370	/nfs/dbraw/zinc/22/13/70/533221370.db2.gz	QKWWHVAVZICARX-SECBINFHSA-N	-1	3	346.318	1.506	20	5		EDBDHM
CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCN2C(=O)[N-]C(=O)[C@H]2C1	ZINC000347378093	533407545	/nfs/dbraw/zinc/40/75/45/533407545.db2.gz	NEWIEFVEDVIIHW-DPQIITEBSA-N	-1	3	330.344	1.234	20	5		EDBDHM
COCc1nc(SCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)n[n-]1	ZINC000268501618	139790664	/nfs/dbraw/zinc/79/06/64/139790664.db2.gz	SKCARAQCSLSPLZ-UHFFFAOYSA-N	-1	3	341.324	1.729	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H](C)C[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000269837175	140004046	/nfs/dbraw/zinc/00/40/46/140004046.db2.gz	YCWHQPOQNUDCNA-NXEZZACHSA-N	-1	3	332.378	1.289	20	5		EDBDHM
CC(C)c1nc([C@@H](C)[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])n[nH]1	ZINC000270605510	140132803	/nfs/dbraw/zinc/13/28/03/140132803.db2.gz	WYWYLSJRPONJMN-SECBINFHSA-N	-1	3	339.377	1.876	20	5		EDBDHM
CC(C)c1nnc([C@@H](C)[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])[nH]1	ZINC000270605510	140132804	/nfs/dbraw/zinc/13/28/04/140132804.db2.gz	WYWYLSJRPONJMN-SECBINFHSA-N	-1	3	339.377	1.876	20	5		EDBDHM
Cc1n[nH]c(C(=O)[N-]OC[C@H](C)NC(=O)OC(C)(C)C)c1[N+](=O)[O-]	ZINC000271089591	140234830	/nfs/dbraw/zinc/23/48/30/140234830.db2.gz	HSYGRGDHNNVTQG-ZETCQYMHSA-N	-1	3	343.340	1.201	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]Cc2nccn2C(F)F)c([N+](=O)[O-])c1	ZINC000348030119	143393479	/nfs/dbraw/zinc/39/34/79/143393479.db2.gz	ITEQWPZKTYUGOF-UHFFFAOYSA-N	-1	3	346.315	1.973	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C(C)(C)CN(C)C)c([N+](=O)[O-])c1	ZINC000416507617	304326571	/nfs/dbraw/zinc/32/65/71/304326571.db2.gz	LHXDRLLVHUOMAN-UHFFFAOYSA-N	-1	3	331.394	1.222	20	5		EDBDHM
COC(=O)[C@@H](C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])CC(C)C	ZINC000352933355	149220571	/nfs/dbraw/zinc/22/05/71/149220571.db2.gz	GFGSYCVAZJULIL-LLVKDONJSA-N	-1	3	344.389	1.708	20	5		EDBDHM
CCN(C)C(=O)[C@H](C)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000353790297	149529052	/nfs/dbraw/zinc/52/90/52/149529052.db2.gz	IOBLOZRQUFKSQZ-JTQLQIEISA-N	-1	3	329.378	1.048	20	5		EDBDHM
CNC(=O)COc1ccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)cc1	ZINC000355750447	150385097	/nfs/dbraw/zinc/38/50/97/150385097.db2.gz	STWHWBWMNQEENX-UHFFFAOYSA-N	-1	3	346.299	1.073	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)[C@H]1CCCOC1	ZINC000355769451	150393436	/nfs/dbraw/zinc/39/34/36/150393436.db2.gz	YWJURZRLAGIDKV-MNOVXSKESA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC[C@@H](O)C(C)C)c1[N+](=O)[O-]	ZINC000360250269	151966559	/nfs/dbraw/zinc/96/65/59/151966559.db2.gz	OKEBDXBIXNMYEM-GFCCVEGCSA-N	-1	3	330.406	1.897	20	5		EDBDHM
COCCCN1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])CC1	ZINC000371615438	156031276	/nfs/dbraw/zinc/03/12/76/156031276.db2.gz	HAZRGSNIPJSUPG-UHFFFAOYSA-N	-1	3	337.376	1.485	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@H]2CCN(C3CC3)C2)cc1[N+](=O)[O-]	ZINC000123099619	222215312	/nfs/dbraw/zinc/21/53/12/222215312.db2.gz	SNARSNUGYJTBOV-SNVBAGLBSA-N	-1	3	345.446	1.727	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCOC[C@@H]1C	ZINC000278065900	273245813	/nfs/dbraw/zinc/24/58/13/273245813.db2.gz	YZBBVWWTPDPKEO-ONGXEEELSA-N	-1	3	330.362	1.307	20	5		EDBDHM
Cc1cc(Cc2noc([C@@H](C)[N-]S(C)(=O)=O)n2)ccc1[N+](=O)[O-]	ZINC000274091505	268104514	/nfs/dbraw/zinc/10/45/14/268104514.db2.gz	XWXKZODVJDYZHK-SECBINFHSA-N	-1	3	340.361	1.487	20	5		EDBDHM
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])[C@H]1OC	ZINC000274831050	268218143	/nfs/dbraw/zinc/21/81/43/268218143.db2.gz	ZEALARNRFSDPRT-MRVWCRGKSA-N	-1	3	344.389	1.207	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2C[C@H](O)C2(C)C)cc1[N+](=O)[O-]	ZINC000275404595	268337930	/nfs/dbraw/zinc/33/79/30/268337930.db2.gz	ONQLPJGEWIDVFJ-MNOVXSKESA-N	-1	3	348.352	1.180	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCSC1	ZINC000273585465	273046668	/nfs/dbraw/zinc/04/66/68/273046668.db2.gz	PTMOCLNFKSISJJ-QMMMGPOBSA-N	-1	3	346.386	1.165	20	5		EDBDHM
COCCn1nc(C)c(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1C	ZINC000275155234	273104066	/nfs/dbraw/zinc/10/40/66/273104066.db2.gz	SQUULGVKIKMYSN-UHFFFAOYSA-N	-1	3	335.320	1.407	20	5		EDBDHM
C[C@]1(C[C@@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2)NC(=O)[N-]C1=O	ZINC000287739673	288311133	/nfs/dbraw/zinc/31/11/33/288311133.db2.gz	GFCBMTJNLSPCLP-BLLLJJGKSA-N	-1	3	346.343	1.188	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(C)(C)O	ZINC000293890638	303034612	/nfs/dbraw/zinc/03/46/12/303034612.db2.gz	VCNOQYUHTMWAQT-GFCCVEGCSA-N	-1	3	332.378	1.431	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC[C@H](C)CCO	ZINC000296098011	303295746	/nfs/dbraw/zinc/29/57/46/303295746.db2.gz	GEBRUGWHDYUKDR-JTQLQIEISA-N	-1	3	332.378	1.290	20	5		EDBDHM
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)[N-][C@H]1CNCCC1(F)F	ZINC000420436698	304806574	/nfs/dbraw/zinc/80/65/74/304806574.db2.gz	BJQCUGYHDLWKRT-VIFPVBQESA-N	-1	3	339.295	1.009	20	5		EDBDHM
COC(=O)Cc1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000427829173	304998376	/nfs/dbraw/zinc/99/83/76/304998376.db2.gz	QUIZUXCXONNFDK-UHFFFAOYSA-N	-1	3	331.284	1.663	20	5		EDBDHM
C[C@H](CO[C@@H]1CCOC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000441540860	305222754	/nfs/dbraw/zinc/22/27/54/305222754.db2.gz	CHCVDKLPMQUEKO-MWLCHTKSSA-N	-1	3	348.352	1.206	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC2(N(C)C)CCC2)c([N+](=O)[O-])c1	ZINC000445741694	305260102	/nfs/dbraw/zinc/26/01/02/305260102.db2.gz	KQKGFOYDOGCVMQ-UHFFFAOYSA-N	-1	3	327.406	1.666	20	5		EDBDHM
COc1cc(S(=O)(=O)[N-]C2(CF)CCOCC2)ccc1[N+](=O)[O-]	ZINC000451730876	305365454	/nfs/dbraw/zinc/36/54/54/305365454.db2.gz	ADPCSDSCHBPKQN-UHFFFAOYSA-N	-1	3	348.352	1.400	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C)Cc1cnn(C)c1	ZINC000451966147	305374825	/nfs/dbraw/zinc/37/48/25/305374825.db2.gz	LNWLBKICDBOBPV-NSHDSACASA-N	-1	3	338.389	1.546	20	5		EDBDHM
CO[C@@H]([C@@H](C)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C1CC1	ZINC000451985302	305376176	/nfs/dbraw/zinc/37/61/76/305376176.db2.gz	HZALFLRWHUPXOX-MFKMUULPSA-N	-1	3	328.390	1.995	20	5		EDBDHM
CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1c(C)[n-][nH]c1=O	ZINC000547322005	306098875	/nfs/dbraw/zinc/09/88/75/306098875.db2.gz	HLINSSUHMNKZDP-UKRRQHHQSA-N	-1	3	346.387	1.792	20	5		EDBDHM
CCNC(=O)[C@@H](C)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000060497753	441247394	/nfs/dbraw/zinc/24/73/94/441247394.db2.gz	DQKWCEMDTBKRRA-SNVBAGLBSA-N	-1	3	329.378	1.015	20	5		EDBDHM
C[C@H]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)sc2C1	ZINC000025279558	441338260	/nfs/dbraw/zinc/33/82/60/441338260.db2.gz	GLASKVQYUWCTPN-ZETCQYMHSA-N	-1	3	334.357	2.117	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCN(CC3CC3)C2)c(F)c1	ZINC000108403750	441451504	/nfs/dbraw/zinc/45/15/04/441451504.db2.gz	DSPNAKWUIACDMS-LLVKDONJSA-N	-1	3	343.380	1.497	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H](CO)Cc1ccccc1	ZINC000125920370	442061504	/nfs/dbraw/zinc/06/15/04/442061504.db2.gz	OGSSUNUWGVETCX-ZDUSSCGKSA-N	-1	3	336.369	1.477	20	5		EDBDHM
Cn1cnc(-c2cccc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)c2)n1	ZINC000166058665	442213688	/nfs/dbraw/zinc/21/36/88/442213688.db2.gz	BDHWZAQTYNZKMQ-UHFFFAOYSA-N	-1	3	340.299	1.743	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](CO)CC(C)(C)C	ZINC000128814859	442289912	/nfs/dbraw/zinc/28/99/12/442289912.db2.gz	JNCTWXSQIVPMMM-NSHDSACASA-N	-1	3	330.406	1.979	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C[C@H]2CC[C@H](O)C2)cc1[N+](=O)[O-]	ZINC000188334989	442740627	/nfs/dbraw/zinc/74/06/27/442740627.db2.gz	SWTKWXRINOHGMC-UWVGGRQHSA-N	-1	3	348.808	1.996	20	5		EDBDHM
CC1(C)CC[C@@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)O1	ZINC000188755948	442806584	/nfs/dbraw/zinc/80/65/84/442806584.db2.gz	HJBXCGBXCPQVOI-JTQLQIEISA-N	-1	3	332.353	1.970	20	5		EDBDHM
CCCNC(=O)C[N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl	ZINC000182518698	442779926	/nfs/dbraw/zinc/77/99/26/442779926.db2.gz	QQIMQALLPTVBDP-UHFFFAOYSA-N	-1	3	349.796	1.361	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCOC1	ZINC000266132753	443028595	/nfs/dbraw/zinc/02/85/95/443028595.db2.gz	BGNZBAMHMLXZKY-DTWKUNHWSA-N	-1	3	334.781	1.952	20	5		EDBDHM
CC(C)N1C[C@@H](C)[C@H]([N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000266299088	443089924	/nfs/dbraw/zinc/08/99/24/443089924.db2.gz	NKOSHUAWFQHRHH-ZYHUDNBSSA-N	-1	3	345.396	1.741	20	5		EDBDHM
C[C@H]1CCC[C@@H]1[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000264321267	443260172	/nfs/dbraw/zinc/26/01/72/443260172.db2.gz	PIDRBXYVCMDCNP-UWVGGRQHSA-N	-1	3	342.373	1.833	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](C)c2ccn(C)n2)c1[N+](=O)[O-]	ZINC000416563980	319444918	/nfs/dbraw/zinc/44/49/18/319444918.db2.gz	RNHFCZMQOGZOSZ-LLVKDONJSA-N	-1	3	338.389	1.985	20	5		EDBDHM
COCC[C@H](C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000416596413	319448873	/nfs/dbraw/zinc/44/88/73/319448873.db2.gz	YWVYJCBTPXWYRR-JTQLQIEISA-N	-1	3	332.378	1.554	20	5		EDBDHM
CC[C@@H](C)NC(=O)[C@H](C)[N-]c1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000272835002	443461076	/nfs/dbraw/zinc/46/10/76/443461076.db2.gz	LPROLPUPHFXDJT-SFYZADRCSA-N	-1	3	349.434	1.775	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1C[C@H]2CC[C@@H]1O2	ZINC000265233354	443578437	/nfs/dbraw/zinc/57/84/37/443578437.db2.gz	RBKQVPRBMLZHNJ-MXWKQRLJSA-N	-1	3	328.346	1.202	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C[C@@H]2CCC[C@@H]2O)c1	ZINC000272398153	443613422	/nfs/dbraw/zinc/61/34/22/443613422.db2.gz	ANRJVJFDODENIK-ONGXEEELSA-N	-1	3	348.808	1.996	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1c[nH]c(=O)cc1C	ZINC000443895189	320114705	/nfs/dbraw/zinc/11/47/05/320114705.db2.gz	BVUYIBCDPBQWRZ-UHFFFAOYSA-N	-1	3	339.329	1.813	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCOC[C@@H]1CCCO1	ZINC000544714285	320792410	/nfs/dbraw/zinc/79/24/10/320792410.db2.gz	ABLZQOXKIOOOEP-NSHDSACASA-N	-1	3	330.362	1.069	20	5		EDBDHM
C[C@H]([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1ncnn1C	ZINC000277177151	443928809	/nfs/dbraw/zinc/92/88/09/443928809.db2.gz	MDCQNRWXKAIAOD-QMMMGPOBSA-N	-1	3	325.275	1.693	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@H](C)N2CCCC2)c([N+](=O)[O-])c1	ZINC000548043284	320857891	/nfs/dbraw/zinc/85/78/91/320857891.db2.gz	HRHRBCKHTNLHHB-LBPRGKRZSA-N	-1	3	327.406	1.666	20	5		EDBDHM
Cn1cnc([N-]C(=O)c2ccc([N+](=O)[O-])cc2Br)n1	ZINC000558351000	321011605	/nfs/dbraw/zinc/01/16/05/321011605.db2.gz	CURDFUGFHSLTOE-UHFFFAOYSA-N	-1	3	326.110	1.738	20	5		EDBDHM
COC(=O)C[C@@H](C)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000313991412	444298800	/nfs/dbraw/zinc/29/88/00/444298800.db2.gz	ROARWYNTDFZQHM-SSDOTTSWSA-N	-1	3	336.753	1.478	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CCc3c[nH]nc3C2)c([N+](=O)[O-])c1	ZINC000343842746	444621887	/nfs/dbraw/zinc/62/18/87/444621887.db2.gz	REHRDMBNBVWLHD-LLVKDONJSA-N	-1	3	336.373	1.462	20	5		EDBDHM
COC(=O)[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(C)C	ZINC000340999315	444623549	/nfs/dbraw/zinc/62/35/49/444623549.db2.gz	DKOUQHPYKXZLBT-GFCCVEGCSA-N	-1	3	346.361	1.079	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCc2cnccn2)c1C	ZINC000341165749	444705568	/nfs/dbraw/zinc/70/55/68/444705568.db2.gz	GUKDSRJKIQJLFE-UHFFFAOYSA-N	-1	3	336.373	1.523	20	5		EDBDHM
Cn1ccc2c(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)cccc2c1=O	ZINC000337591021	445154942	/nfs/dbraw/zinc/15/49/42/445154942.db2.gz	XIFPVQATVQULSN-UHFFFAOYSA-N	-1	3	340.295	1.800	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@]1(C)CCOC1	ZINC000354500819	445265307	/nfs/dbraw/zinc/26/53/07/445265307.db2.gz	SRAMACPARVOAJY-CYBMUJFWSA-N	-1	3	330.362	1.308	20	5		EDBDHM
COC(=O)c1cccc2nc(NC(=O)c3n[nH]c(C)c3[N+](=O)[O-])[n-]c21	ZINC000348563597	445327081	/nfs/dbraw/zinc/32/70/81/445327081.db2.gz	QMBLWCFCMCCQIC-UHFFFAOYSA-N	-1	3	344.287	1.542	20	5		EDBDHM
COC(=O)c1cccc2[n-]c(NC(=O)c3n[nH]c(C)c3[N+](=O)[O-])nc21	ZINC000348563597	445327084	/nfs/dbraw/zinc/32/70/84/445327084.db2.gz	QMBLWCFCMCCQIC-UHFFFAOYSA-N	-1	3	344.287	1.542	20	5		EDBDHM
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])[C@@H]1OC	ZINC000356221597	445683760	/nfs/dbraw/zinc/68/37/60/445683760.db2.gz	OWZUUPWHYYYFOQ-SUHUHFCYSA-N	-1	3	344.389	1.374	20	5		EDBDHM
Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(Cc2nnn[n-]2)cc1	ZINC000354388362	446169396	/nfs/dbraw/zinc/16/93/96/446169396.db2.gz	LEFIESUAFUZWRC-UHFFFAOYSA-N	-1	3	339.315	1.533	20	5		EDBDHM
Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(Cc2nn[n-]n2)cc1	ZINC000354388362	446169401	/nfs/dbraw/zinc/16/94/01/446169401.db2.gz	LEFIESUAFUZWRC-UHFFFAOYSA-N	-1	3	339.315	1.533	20	5		EDBDHM
COc1ccc(C(=O)[N-]c2ncn(-c3cccnc3)n2)cc1[N+](=O)[O-]	ZINC000370322322	446230724	/nfs/dbraw/zinc/23/07/24/446230724.db2.gz	CYMPQWGEXWJKKN-UHFFFAOYSA-N	-1	3	340.299	1.831	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C2CCC(OC)CC2)c([N+](=O)[O-])c1	ZINC000416541013	447641514	/nfs/dbraw/zinc/64/15/14/447641514.db2.gz	IYARMVNTOAASLM-UHFFFAOYSA-N	-1	3	344.389	1.839	20	5		EDBDHM
O=C(Cc1cncc([O-])c1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000566923867	448587436	/nfs/dbraw/zinc/58/74/36/448587436.db2.gz	JWERXXOYUJPJMH-GFCCVEGCSA-N	-1	3	343.343	1.346	20	5		EDBDHM
C[C@H]1COCCN1C1CCN(Cc2cc([O-])ccc2[N+](=O)[O-])CC1	ZINC000579728706	448867157	/nfs/dbraw/zinc/86/71/57/448867157.db2.gz	IOUSQOBVWVVSKD-ZDUSSCGKSA-N	-1	3	335.404	1.986	20	5		EDBDHM
COC[C@@]1(C(=O)[O-])CCCN(Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000582365856	449077045	/nfs/dbraw/zinc/07/70/45/449077045.db2.gz	PBVYKBCRGORILF-MRXNPFEDSA-N	-1	3	338.360	1.917	20	5		EDBDHM
C[C@H](CCO)C1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCC1	ZINC000593572289	449081258	/nfs/dbraw/zinc/08/12/58/449081258.db2.gz	HUYQUXOMFUNJHA-LLVKDONJSA-N	-1	3	343.405	1.457	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCC1(CO)CCC1	ZINC000593664753	449137479	/nfs/dbraw/zinc/13/74/79/449137479.db2.gz	SZHOJJAXHLBSGM-UHFFFAOYSA-N	-1	3	328.390	1.734	20	5		EDBDHM
C[C@H](CN1CCC[C@H](C)C1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593583152	449089894	/nfs/dbraw/zinc/08/98/94/449089894.db2.gz	ZLPZJXRJFDJNFM-NWDGAFQWSA-N	-1	3	342.421	1.389	20	5		EDBDHM
CCC[C@H](C)[C@@H](CO)[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000593624222	449114090	/nfs/dbraw/zinc/11/40/90/449114090.db2.gz	GRVSBNPOIJAQSR-WDEREUQCSA-N	-1	3	346.405	1.679	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H](C2CC2)C2CCOCC2)nc1	ZINC000593632452	449118920	/nfs/dbraw/zinc/11/89/20/449118920.db2.gz	WROXYWNFHJWAJL-AWEZNQCLSA-N	-1	3	341.389	1.473	20	5		EDBDHM
CCS[C@H]1CCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593557158	449348145	/nfs/dbraw/zinc/34/81/45/449348145.db2.gz	QEIZBOVNNDCRTL-MNOVXSKESA-N	-1	3	331.419	1.942	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C1CCOCC1	ZINC000593559716	449349963	/nfs/dbraw/zinc/34/99/63/449349963.db2.gz	YKOMRKPBNFBRPG-GFCCVEGCSA-N	-1	3	329.378	1.473	20	5		EDBDHM
Cc1ccc(C(=O)N2CCN(c3cc[n-]c(=O)c3[N+](=O)[O-])CC2)cc1	ZINC000596077518	449350649	/nfs/dbraw/zinc/35/06/49/449350649.db2.gz	JYVIFQJLICDSLZ-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
C[C@@]1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCCC[C@H]1O	ZINC000593562694	449351867	/nfs/dbraw/zinc/35/18/67/449351867.db2.gz	XIRYNDFBKCIJNY-YPMHNXCESA-N	-1	3	329.378	1.209	20	5		EDBDHM
COC(=O)c1ccnc([N-]c2cnn(CCN(C)C)c2)c1[N+](=O)[O-]	ZINC000598591464	449479941	/nfs/dbraw/zinc/47/99/41/449479941.db2.gz	BMWHAXPDGLKYNI-UHFFFAOYSA-N	-1	3	334.336	1.278	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC[C@@H]1CC1(F)F	ZINC000598621026	449498789	/nfs/dbraw/zinc/49/87/89/449498789.db2.gz	DZFPFXJIAIRRGL-MRVPVSSYSA-N	-1	3	336.316	1.927	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)ncn1	ZINC000617243803	449521595	/nfs/dbraw/zinc/52/15/95/449521595.db2.gz	ULLXETWLXXANAC-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
C[C@@H]1CCCCN1CCC[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594746092	449662944	/nfs/dbraw/zinc/66/29/44/449662944.db2.gz	YQNURMUVYNBJLD-GFCCVEGCSA-N	-1	3	342.421	1.533	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1C[C@@H](C)n2ncnc21	ZINC000594806402	449718629	/nfs/dbraw/zinc/71/86/29/449718629.db2.gz	KCWLTWYSVCPDAX-ZJUUUORDSA-N	-1	3	337.361	1.479	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1C[C@@H](O)C12CCC2	ZINC000594866252	449780850	/nfs/dbraw/zinc/78/08/50/449780850.db2.gz	UIKNHVSMYDPJCY-VXGBXAGGSA-N	-1	3	326.374	1.485	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2C[C@H](O)C23CCC3)c([N+](=O)[O-])c1	ZINC000594866878	449782611	/nfs/dbraw/zinc/78/26/11/449782611.db2.gz	YUOUVZNFQYVKPS-OLZOCXBDSA-N	-1	3	342.373	1.185	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CCN(C)[C@H](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000601357790	449870614	/nfs/dbraw/zinc/87/06/14/449870614.db2.gz	WUZUTVCYYBQXEU-MNOVXSKESA-N	-1	3	345.396	1.803	20	5		EDBDHM
Cc1nc(C)c(C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])o1	ZINC000599317835	449888517	/nfs/dbraw/zinc/88/85/17/449888517.db2.gz	ZFDVYRJXEGRDNR-UHFFFAOYSA-N	-1	3	325.346	1.819	20	5		EDBDHM
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)[N-][C@H]1CCN(CC2CC2)C1	ZINC000609387672	450022860	/nfs/dbraw/zinc/02/28/60/450022860.db2.gz	CMUBNDQMNSFRKO-NSHDSACASA-N	-1	3	343.380	1.497	20	5		EDBDHM
Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCCc1cc(=O)[nH][n-]1	ZINC000597663706	450178256	/nfs/dbraw/zinc/17/82/56/450178256.db2.gz	BBUVOXWRMBBOGD-UHFFFAOYSA-N	-1	3	338.751	1.943	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)C[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000610739551	450317107	/nfs/dbraw/zinc/31/71/07/450317107.db2.gz	BYBUFRVXTZYLAC-WDEREUQCSA-N	-1	3	344.389	1.697	20	5		EDBDHM
COC(=O)c1ccc(S(=O)(=O)[N-][C@@H]2CC[C@@H](F)C2)cc1[N+](=O)[O-]	ZINC000416491535	491008958	/nfs/dbraw/zinc/00/89/58/491008958.db2.gz	ZOFMXWFFXMKJDT-RKDXNWHRSA-N	-1	3	346.336	1.550	20	5		EDBDHM
COc1nnc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)[n-]1	ZINC000179369969	491018132	/nfs/dbraw/zinc/01/81/32/491018132.db2.gz	ZKBQBEQCKHKVMA-UHFFFAOYSA-N	-1	3	329.276	1.160	20	5		EDBDHM
COc1nc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)n[n-]1	ZINC000179369969	491018133	/nfs/dbraw/zinc/01/81/33/491018133.db2.gz	ZKBQBEQCKHKVMA-UHFFFAOYSA-N	-1	3	329.276	1.160	20	5		EDBDHM
COc1n[n-]c(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)n1	ZINC000179369969	491018134	/nfs/dbraw/zinc/01/81/34/491018134.db2.gz	ZKBQBEQCKHKVMA-UHFFFAOYSA-N	-1	3	329.276	1.160	20	5		EDBDHM
CC[C@H](C)[C@@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)OC	ZINC000340389449	535874171	/nfs/dbraw/zinc/87/41/71/535874171.db2.gz	NKGYAFQSKKLCKN-JOYOIKCWSA-N	-1	3	344.389	1.769	20	5		EDBDHM
C[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)[C@@H](C)N1CCOCC1	ZINC000736139716	578956488	/nfs/dbraw/zinc/95/64/88/578956488.db2.gz	QTKOQTQGUPDQLS-GHMZBOCLSA-N	-1	3	347.379	1.296	20	5		EDBDHM
C[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)[C@@H](C)N1CCOCC1	ZINC000736139716	578956489	/nfs/dbraw/zinc/95/64/89/578956489.db2.gz	QTKOQTQGUPDQLS-GHMZBOCLSA-N	-1	3	347.379	1.296	20	5		EDBDHM
CC[C@](C)(CC(=O)OC)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000748657587	579696681	/nfs/dbraw/zinc/69/66/81/579696681.db2.gz	KPCBDCVLOVHFDB-CQSZACIVSA-N	-1	3	344.389	1.913	20	5		EDBDHM
COC(=O)Cc1n[n-]c(NC(=O)C=C(C)c2ccc([N+](=O)[O-])cc2)n1	ZINC000752406234	579848957	/nfs/dbraw/zinc/84/89/57/579848957.db2.gz	HYHYSNPCNYWLBA-VQHVLOKHSA-N	-1	3	345.315	1.470	20	5		EDBDHM
COC(=O)Cc1nnc(NC(=O)C=C(C)c2ccc([N+](=O)[O-])cc2)[n-]1	ZINC000752406234	579848959	/nfs/dbraw/zinc/84/89/59/579848959.db2.gz	HYHYSNPCNYWLBA-VQHVLOKHSA-N	-1	3	345.315	1.470	20	5		EDBDHM
COC(=O)Cc1nc(NC(=O)C=C(C)c2ccc([N+](=O)[O-])cc2)n[n-]1	ZINC000752406234	579848960	/nfs/dbraw/zinc/84/89/60/579848960.db2.gz	HYHYSNPCNYWLBA-VQHVLOKHSA-N	-1	3	345.315	1.470	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H](CO)CC2CC2)cc1[N+](=O)[O-]	ZINC000754821004	579913571	/nfs/dbraw/zinc/91/35/71/579913571.db2.gz	ZPHWLRLDGWNTTN-JTQLQIEISA-N	-1	3	348.808	1.996	20	5		EDBDHM
O=C([N-][C@H]1CCCS(=O)(=O)C1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000778269301	580460326	/nfs/dbraw/zinc/46/03/26/580460326.db2.gz	LINASPJPYXGKEU-JTQLQIEISA-N	-1	3	348.327	1.380	20	5		EDBDHM
O=C([N-][C@@H]1CCCS(=O)(=O)C1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000778269348	580460342	/nfs/dbraw/zinc/46/03/42/580460342.db2.gz	LINASPJPYXGKEU-SNVBAGLBSA-N	-1	3	348.327	1.380	20	5		EDBDHM
Cc1ccc([C@@H](O)C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)o1	ZINC000768841968	580222149	/nfs/dbraw/zinc/22/21/49/580222149.db2.gz	LBILLRNMINSYFB-VIFPVBQESA-N	-1	3	332.359	1.570	20	5		EDBDHM
CC[C@@](C)(CC(=O)OC)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768850594	580222370	/nfs/dbraw/zinc/22/23/70/580222370.db2.gz	ZVSALDDAWQITOQ-NSHDSACASA-N	-1	3	336.391	1.666	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CC[S@@](C)=O)c1	ZINC000779892090	580501258	/nfs/dbraw/zinc/50/12/58/580501258.db2.gz	CAINSYIGYORECO-LJQANCHMSA-N	-1	3	340.810	1.213	20	5		EDBDHM
C/C=C/C[C@@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C(=O)OCC	ZINC000788668160	580727615	/nfs/dbraw/zinc/72/76/15/580727615.db2.gz	HVDWQTKEGOGGIT-RXNUUUNCSA-N	-1	3	348.402	1.833	20	5		EDBDHM
CCOc1cc([N+](=O)[O-])c(C(=O)[N-]OCC(C)(C)O)cc1OC	ZINC000791262343	580787811	/nfs/dbraw/zinc/78/78/11/580787811.db2.gz	APEWGSNEKHBALC-UHFFFAOYSA-N	-1	3	328.321	1.434	20	5		EDBDHM
COCCO[C@H]1CCCN(Cc2ccc([O-])c(OC)c2[N+](=O)[O-])C1	ZINC000894265368	591255645	/nfs/dbraw/zinc/25/56/45/591255645.db2.gz	VQUMTENAROZQOS-ZDUSSCGKSA-N	-1	3	340.376	1.936	20	5		EDBDHM
COc1c([O-])ccc(CN2CCOC[C@H]2[C@H]2CCCO2)c1[N+](=O)[O-]	ZINC000894409319	591303594	/nfs/dbraw/zinc/30/35/94/591303594.db2.gz	NYVQSPQQSAXWQF-GXTWGEPZSA-N	-1	3	338.360	1.689	20	5		EDBDHM
COc1c([O-])ccc(CN2CCN([C@H]3CCOC3)CC2)c1[N+](=O)[O-]	ZINC000895361328	591727418	/nfs/dbraw/zinc/72/74/18/591727418.db2.gz	ADPWJSKHTIIZIG-ZDUSSCGKSA-N	-1	3	337.376	1.216	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@H]23)c(Cl)c1	ZINC000907765934	592783490	/nfs/dbraw/zinc/78/34/90/592783490.db2.gz	IQYZYGMQNFUNNC-FUTFKJLYSA-N	-1	3	344.776	1.702	20	5		EDBDHM
Cc1nc(Cl)ccc1S(=O)(=O)NN=c1[n-]cccc1[N+](=O)[O-]	ZINC000808098341	593222208	/nfs/dbraw/zinc/22/22/08/593222208.db2.gz	KQJDPKRUEWVNES-UHFFFAOYSA-N	-1	3	343.752	1.652	20	5		EDBDHM
C[C@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)c1cccc(-c2nnn[n-]2)c1	ZINC000820391142	593815699	/nfs/dbraw/zinc/81/56/99/593815699.db2.gz	NQUPLNPJGPXMBA-QMMMGPOBSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)c1cccc(-c2nn[n-]n2)c1	ZINC000820391142	593815700	/nfs/dbraw/zinc/81/57/00/593815700.db2.gz	NQUPLNPJGPXMBA-QMMMGPOBSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@H](C(=O)Nc1cccc(-c2nnn[n-]2)c1)n1cc([N+](=O)[O-])cn1	ZINC000824046648	593917939	/nfs/dbraw/zinc/91/79/39/593917939.db2.gz	UOIVAXPBNYMLKV-MRVPVSSYSA-N	-1	3	328.292	1.171	20	5		EDBDHM
C[C@H](C(=O)Nc1cccc(-c2nn[n-]n2)c1)n1cc([N+](=O)[O-])cn1	ZINC000824046648	593917942	/nfs/dbraw/zinc/91/79/42/593917942.db2.gz	UOIVAXPBNYMLKV-MRVPVSSYSA-N	-1	3	328.292	1.171	20	5		EDBDHM
Cn1cc([C@@H]2CCCN2c2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cn1	ZINC000822674321	594083569	/nfs/dbraw/zinc/08/35/69/594083569.db2.gz	QKRSNCNJXGTJQG-LBPRGKRZSA-N	-1	3	341.335	1.245	20	5		EDBDHM
Cn1cc([C@@H]2CCCN2c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)cn1	ZINC000822674321	594083571	/nfs/dbraw/zinc/08/35/71/594083571.db2.gz	QKRSNCNJXGTJQG-LBPRGKRZSA-N	-1	3	341.335	1.245	20	5		EDBDHM
Nc1c(C(=O)OCc2ccc(-c3nnn[n-]3)cc2)cccc1[N+](=O)[O-]	ZINC000822903375	594119924	/nfs/dbraw/zinc/11/99/24/594119924.db2.gz	KNBVLOOZJFNZSQ-UHFFFAOYSA-N	-1	3	340.299	1.714	20	5		EDBDHM
Nc1c(C(=O)OCc2ccc(-c3nn[n-]n3)cc2)cccc1[N+](=O)[O-]	ZINC000822903375	594119925	/nfs/dbraw/zinc/11/99/25/594119925.db2.gz	KNBVLOOZJFNZSQ-UHFFFAOYSA-N	-1	3	340.299	1.714	20	5		EDBDHM
CC[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)[C@@H](O)C(F)(F)F	ZINC000825146320	594136308	/nfs/dbraw/zinc/13/63/08/594136308.db2.gz	CFKPQMBJNIVGJE-WCBMZHEXSA-N	-1	3	346.269	1.889	20	5		EDBDHM
CC[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)[C@@H](O)C(F)(F)F	ZINC000825146320	594136309	/nfs/dbraw/zinc/13/63/09/594136309.db2.gz	CFKPQMBJNIVGJE-WCBMZHEXSA-N	-1	3	346.269	1.889	20	5		EDBDHM
O=C(NCc1cccc(-c2nnn[n-]2)c1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000823257983	594176791	/nfs/dbraw/zinc/17/67/91/594176791.db2.gz	XSCIIHQJUBRTMX-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=C(NCc1cccc(-c2nn[n-]n2)c1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000823257983	594176792	/nfs/dbraw/zinc/17/67/92/594176792.db2.gz	XSCIIHQJUBRTMX-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@@H](O)c2cccnc2)c(-c2nnn[n-]2)c1	ZINC000823639846	594223883	/nfs/dbraw/zinc/22/38/83/594223883.db2.gz	IPZOYGMHEVDWMN-CYBMUJFWSA-N	-1	3	327.304	1.315	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@@H](O)c2cccnc2)c(-c2nn[n-]n2)c1	ZINC000823639846	594223884	/nfs/dbraw/zinc/22/38/84/594223884.db2.gz	IPZOYGMHEVDWMN-CYBMUJFWSA-N	-1	3	327.304	1.315	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC(c3c[nH]cn3)CC2)c(-c2nnn[n-]2)c1	ZINC000823639856	594223888	/nfs/dbraw/zinc/22/38/88/594223888.db2.gz	JILBFJWZMCURAN-UHFFFAOYSA-N	-1	3	340.347	1.882	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC(c3c[nH]cn3)CC2)c(-c2nn[n-]n2)c1	ZINC000823639856	594223889	/nfs/dbraw/zinc/22/38/89/594223889.db2.gz	JILBFJWZMCURAN-UHFFFAOYSA-N	-1	3	340.347	1.882	20	5		EDBDHM
COC1(CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CCOCC1	ZINC000826144054	594344004	/nfs/dbraw/zinc/34/40/04/594344004.db2.gz	ANCPHQPPPGXXAH-UHFFFAOYSA-N	-1	3	334.336	1.382	20	5		EDBDHM
COC1(CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CCOCC1	ZINC000826144054	594344006	/nfs/dbraw/zinc/34/40/06/594344006.db2.gz	ANCPHQPPPGXXAH-UHFFFAOYSA-N	-1	3	334.336	1.382	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)OCc2cc(-c3nnn[n-]3)ccc2F)n1	ZINC000826362879	594445278	/nfs/dbraw/zinc/44/52/78/594445278.db2.gz	MZOFMCAEIYMJEN-UHFFFAOYSA-N	-1	3	347.266	1.005	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)OCc2cc(-c3nn[n-]n3)ccc2F)n1	ZINC000826362879	594445280	/nfs/dbraw/zinc/44/52/80/594445280.db2.gz	MZOFMCAEIYMJEN-UHFFFAOYSA-N	-1	3	347.266	1.005	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)OCc1cccc(-c2nnn[n-]2)c1F	ZINC000826362647	594445344	/nfs/dbraw/zinc/44/53/44/594445344.db2.gz	BZCUGFWGFFZMIV-UHFFFAOYSA-N	-1	3	346.278	1.610	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)OCc1cccc(-c2nn[n-]n2)c1F	ZINC000826362647	594445345	/nfs/dbraw/zinc/44/53/45/594445345.db2.gz	BZCUGFWGFFZMIV-UHFFFAOYSA-N	-1	3	346.278	1.610	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCC[C@H]1c1ncc[nH]1	ZINC000826497480	594502245	/nfs/dbraw/zinc/50/22/45/594502245.db2.gz	IVJIWBUGGPHWIA-NSHDSACASA-N	-1	3	326.320	1.840	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCC[C@H]1c1ncc[nH]1	ZINC000826497480	594502246	/nfs/dbraw/zinc/50/22/46/594502246.db2.gz	IVJIWBUGGPHWIA-NSHDSACASA-N	-1	3	326.320	1.840	20	5		EDBDHM
CCN(C)C(=O)[C@@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C(C)C	ZINC000831975563	594715942	/nfs/dbraw/zinc/71/59/42/594715942.db2.gz	DZWNZCABINNAMC-NSHDSACASA-N	-1	3	349.434	1.438	20	5		EDBDHM
O=C([O-])N1CCC[C@H]1C1CCN(CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000832003741	594718464	/nfs/dbraw/zinc/71/84/64/594718464.db2.gz	AWCUFGVLBXWOHI-AWEZNQCLSA-N	-1	3	337.380	1.646	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H]([C@H](CO)C2CC2)C2CC2)cs1	ZINC000832232346	594736997	/nfs/dbraw/zinc/73/69/97/594736997.db2.gz	QFUYHGDDTSGHFL-DGCLKSJQSA-N	-1	3	346.430	1.732	20	5		EDBDHM
CC(C)(CO)O[N-]C(=O)c1ccc([N+](=O)[O-])cc1Br	ZINC000836803393	594999516	/nfs/dbraw/zinc/99/95/16/594999516.db2.gz	KLQFYYNXQTYYQY-UHFFFAOYSA-N	-1	3	333.138	1.790	20	5		EDBDHM
CC[C@@H]([N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1)C(=O)NC	ZINC000848590065	595411482	/nfs/dbraw/zinc/41/14/82/595411482.db2.gz	AENVBNRVXITCGT-SNVBAGLBSA-N	-1	3	331.275	1.207	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1[C@H](C)OC(=O)[C@H]1CCS(=O)(=O)[N-]1	ZINC000845374337	595486422	/nfs/dbraw/zinc/48/64/22/595486422.db2.gz	BMYJAOAEMCBFOP-JOYOIKCWSA-N	-1	3	328.346	1.199	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)C(OC)OC	ZINC000849404825	595520933	/nfs/dbraw/zinc/52/09/33/595520933.db2.gz	ATVAAVYVAMBSJA-GFCCVEGCSA-N	-1	3	332.378	1.412	20	5		EDBDHM
CC(C)(C)N1CC[C@@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000849420380	595524203	/nfs/dbraw/zinc/52/42/03/595524203.db2.gz	TYFHZNXCTPRHDT-SECBINFHSA-N	-1	3	333.435	1.807	20	5		EDBDHM
CN1CCOC[C@@H]1C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000863504749	596603484	/nfs/dbraw/zinc/60/34/84/596603484.db2.gz	BFOXORTVHURJQO-NSHDSACASA-N	-1	3	345.302	1.013	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]C[C@@H]1C[C@H]2CCC[C@@H]2O1	ZINC000872557311	596963566	/nfs/dbraw/zinc/96/35/66/596963566.db2.gz	QDOXGTDQEUNKSU-ZLDLUXBVSA-N	-1	3	340.401	1.972	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NC[C@@H](O)Cc1ccccc1	ZINC000738360288	598797804	/nfs/dbraw/zinc/79/78/04/598797804.db2.gz	UYTLXRFORWWMPU-ZDUSSCGKSA-N	-1	3	340.343	1.790	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NC[C@@H](O)Cc1ccccc1	ZINC000738360288	598797806	/nfs/dbraw/zinc/79/78/06/598797806.db2.gz	UYTLXRFORWWMPU-ZDUSSCGKSA-N	-1	3	340.343	1.790	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]C[C@H]1CCCOC1	ZINC000056130083	214360819	/nfs/dbraw/zinc/36/08/19/214360819.db2.gz	PDVKRBRFOYUGAV-SECBINFHSA-N	-1	3	334.781	1.953	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1)CN1CCCC1	ZINC000066333658	138176748	/nfs/dbraw/zinc/17/67/48/138176748.db2.gz	XFAIEJLIILGDNR-JTQLQIEISA-N	-1	3	333.435	1.667	20	5		EDBDHM
Cc1cc(C(=O)Nc2cccc3c2OCC(=O)N3)c([N+](=O)[O-])c(=O)[n-]1	ZINC000368177123	291782720	/nfs/dbraw/zinc/78/27/20/291782720.db2.gz	FOABDJCQSXXJSF-UHFFFAOYSA-N	-1	3	344.283	1.587	20	5		EDBDHM
CCOC(=O)Cn1cnc([N-]C(=O)c2cccc(C)c2[N+](=O)[O-])n1	ZINC000425109034	252299494	/nfs/dbraw/zinc/29/94/94/252299494.db2.gz	RSDXTBVXDHDPRM-UHFFFAOYSA-N	-1	3	333.304	1.310	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H](O)CC(C)(C)C	ZINC000269831726	140002657	/nfs/dbraw/zinc/00/26/57/140002657.db2.gz	XKZWZNCZOPMAFQ-NSHDSACASA-N	-1	3	346.405	1.679	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)CC1	ZINC000270814525	140174445	/nfs/dbraw/zinc/17/44/45/140174445.db2.gz	MQBNGHYZBZUMGX-UHFFFAOYSA-N	-1	3	348.764	1.541	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])[C@H]1CCCO1	ZINC000339451837	142049212	/nfs/dbraw/zinc/04/92/12/142049212.db2.gz	HMFPNUZFNVBQLO-WCQYABFASA-N	-1	3	344.389	1.839	20	5		EDBDHM
CCOC(=O)c1ccnc(N2CCc3nc[n-]c(=O)c3C2)c1[N+](=O)[O-]	ZINC000269736326	285970165	/nfs/dbraw/zinc/97/01/65/285970165.db2.gz	YKVQWHSVYFVZOK-UHFFFAOYSA-N	-1	3	345.315	1.225	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CN(C(C)C)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000360746776	292184808	/nfs/dbraw/zinc/18/48/08/292184808.db2.gz	QCZKHWANJMMDLM-STQMWFEESA-N	-1	3	341.433	1.910	20	5		EDBDHM
O=C(c1c[n-]c(=O)c([N+](=O)[O-])c1)N1CCC(Cc2ncc[nH]2)CC1	ZINC000353122200	149296277	/nfs/dbraw/zinc/29/62/77/149296277.db2.gz	FWNHGRREGWPNCD-UHFFFAOYSA-N	-1	3	331.332	1.513	20	5		EDBDHM
CCN1CC[C@@H]2OCCN(C(=O)c3cc([O-])cc([N+](=O)[O-])c3)[C@H]2C1	ZINC000355368351	150237801	/nfs/dbraw/zinc/23/78/01/150237801.db2.gz	LGYACWGLHYGZQZ-GJZGRUSLSA-N	-1	3	335.360	1.236	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](C)[C@H]2CCCOC2)c([N+](=O)[O-])c1	ZINC000355719890	150374128	/nfs/dbraw/zinc/37/41/28/150374128.db2.gz	XORVXTXTUVYXGP-NEPJUHHUSA-N	-1	3	328.390	1.997	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1C[N-]S(=O)(=O)c1ccc(C)o1	ZINC000358463253	151385209	/nfs/dbraw/zinc/38/52/09/151385209.db2.gz	LXHMACFBDKVZMV-UHFFFAOYSA-N	-1	3	326.330	1.983	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1C[C@H]2OCCC[C@H]12	ZINC000364842405	153348719	/nfs/dbraw/zinc/34/87/19/153348719.db2.gz	JHSULZJBUPKICK-IJLUTSLNSA-N	-1	3	342.373	1.449	20	5		EDBDHM
CC1CCN(C[C@H](O)CNC(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC1	ZINC000119220014	287350814	/nfs/dbraw/zinc/35/08/14/287350814.db2.gz	PWHTWVWCWYBTJG-CYBMUJFWSA-N	-1	3	337.376	1.123	20	5		EDBDHM
O=[N+]([O-])c1cccc(CS(=O)(=O)[N-][C@H](CCO)c2ccco2)c1	ZINC000184271346	267677676	/nfs/dbraw/zinc/67/76/76/267677676.db2.gz	VXQZXEFWGMJLLM-CYBMUJFWSA-N	-1	3	340.357	1.731	20	5		EDBDHM
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])[C@H]1OC	ZINC000274050143	268101116	/nfs/dbraw/zinc/10/11/16/268101116.db2.gz	NZNFGYQUGXRBAW-RAIGVLPGSA-N	-1	3	344.389	1.374	20	5		EDBDHM
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@H]1OC	ZINC000274124588	273071195	/nfs/dbraw/zinc/07/11/95/273071195.db2.gz	VOHAWYLOQOYGGB-UFGOTCBOSA-N	-1	3	330.362	1.066	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCOC[C@@H]2C)cc1C	ZINC000277947945	273237108	/nfs/dbraw/zinc/23/71/08/273237108.db2.gz	RINCLOGAPSADDU-NWDGAFQWSA-N	-1	3	328.390	1.915	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H]1CCO[C@@H]1c1cccnc1	ZINC000281268036	273455217	/nfs/dbraw/zinc/45/52/17/273455217.db2.gz	VZZXPLATWSVWLV-SWLSCSKDSA-N	-1	3	349.368	1.798	20	5		EDBDHM
CCC(CC)(CO)C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000159197844	276209272	/nfs/dbraw/zinc/20/92/72/276209272.db2.gz	VKSYTTJAUSWQBH-UHFFFAOYSA-N	-1	3	330.406	1.980	20	5		EDBDHM
C[C@@H](CN1CCC[C@H](C)C1)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000249180420	278260133	/nfs/dbraw/zinc/26/01/33/278260133.db2.gz	NBTZURGZISWNGR-STQMWFEESA-N	-1	3	341.433	1.994	20	5		EDBDHM
Cc1[nH]nc(C(=O)[N-]c2nc(-c3nccn3C)cs2)c1[N+](=O)[O-]	ZINC000488951956	280190739	/nfs/dbraw/zinc/19/07/39/280190739.db2.gz	SYWCUQJFCUQHOM-UHFFFAOYSA-N	-1	3	333.333	1.736	20	5		EDBDHM
Cc1nnsc1C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000291816658	289187890	/nfs/dbraw/zinc/18/78/90/289187890.db2.gz	DRTMVZFNMLNWCP-UHFFFAOYSA-N	-1	3	342.402	1.850	20	5		EDBDHM
Cc1cc(C(=O)N2CCCC[C@@H]2c2nc[nH]n2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375092784	301091316	/nfs/dbraw/zinc/09/13/16/301091316.db2.gz	DDMQDZVABGEJRS-SNVBAGLBSA-N	-1	3	332.320	1.489	20	5		EDBDHM
Cc1cc(C(=O)N2CCCC[C@@H]2c2nnc[nH]2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375092784	301091318	/nfs/dbraw/zinc/09/13/18/301091318.db2.gz	DDMQDZVABGEJRS-SNVBAGLBSA-N	-1	3	332.320	1.489	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CNCCC2(F)F)c([N+](=O)[O-])c1	ZINC000420449852	304760287	/nfs/dbraw/zinc/76/02/87/304760287.db2.gz	TXRDGUWJJCXQGZ-NSHDSACASA-N	-1	3	335.332	1.179	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C)CO[C@H]1CCOC1	ZINC000267895342	302048028	/nfs/dbraw/zinc/04/80/28/302048028.db2.gz	UGTCWBLLIZTSNM-RYUDHWBXSA-N	-1	3	344.389	1.376	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CCCc2c[nH]nc21	ZINC000268778069	302050156	/nfs/dbraw/zinc/05/01/56/302050156.db2.gz	HOGLLSNPUSAIQZ-NSHDSACASA-N	-1	3	336.373	1.982	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CC[C@@H](CO)C2)cc1C	ZINC000295773366	303264740	/nfs/dbraw/zinc/26/47/40/303264740.db2.gz	PZMDVGSKKNAXJD-NEPJUHHUSA-N	-1	3	328.390	1.651	20	5		EDBDHM
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)[N-][C@@H]1CNCCC1(F)F	ZINC000420436693	304806585	/nfs/dbraw/zinc/80/65/85/304806585.db2.gz	BJQCUGYHDLWKRT-SECBINFHSA-N	-1	3	339.295	1.009	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H]2CCCC(=O)N2)cc1C	ZINC000433444784	305109275	/nfs/dbraw/zinc/10/92/75/305109275.db2.gz	TVAUVYBJLMDKBA-LLVKDONJSA-N	-1	3	341.389	1.159	20	5		EDBDHM
CNC(=O)COc1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc1	ZINC000445194324	305257745	/nfs/dbraw/zinc/25/77/45/305257745.db2.gz	URBUIYRTMUUWGR-UHFFFAOYSA-N	-1	3	346.299	1.073	20	5		EDBDHM
Cn1c(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)nc2ccc(F)cc21	ZINC000445210802	305257946	/nfs/dbraw/zinc/25/79/46/305257946.db2.gz	IYTDNCBDLIQSFY-UHFFFAOYSA-N	-1	3	331.263	1.974	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F	ZINC000544562817	306076488	/nfs/dbraw/zinc/07/64/88/306076488.db2.gz	OCUCQBLLKFORGA-QPUJVOFHSA-N	-1	3	336.323	1.466	20	5		EDBDHM
CCN1CCC[C@H]([N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000060510925	441249261	/nfs/dbraw/zinc/24/92/61/441249261.db2.gz	WEZJXUUKLLAFRY-NSHDSACASA-N	-1	3	343.405	1.366	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]Cc2ccccc2CO)c([N+](=O)[O-])c1	ZINC000159765352	441837241	/nfs/dbraw/zinc/83/72/41/441837241.db2.gz	FCKNMPHMNKIGRL-UHFFFAOYSA-N	-1	3	336.369	1.874	20	5		EDBDHM
Cc1nn(C)c(NCC[N-]S(=O)(=O)c2cccs2)c1[N+](=O)[O-]	ZINC000120035238	441997473	/nfs/dbraw/zinc/99/74/73/441997473.db2.gz	SQRBTANWCRYBHN-UHFFFAOYSA-N	-1	3	345.406	1.089	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]Cc2cnn(C)c2C)cc1[N+](=O)[O-]	ZINC000125778836	442047759	/nfs/dbraw/zinc/04/77/59/442047759.db2.gz	CFSDRFSJWKDSLP-UHFFFAOYSA-N	-1	3	330.391	1.485	20	5		EDBDHM
COCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000162734680	442118977	/nfs/dbraw/zinc/11/89/77/442118977.db2.gz	LMCVGBCBSQLPMX-UHFFFAOYSA-N	-1	3	328.268	1.538	20	5		EDBDHM
CCn1cnnc1C[N-]S(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1	ZINC000120744458	442125744	/nfs/dbraw/zinc/12/57/44/442125744.db2.gz	ZCQXZVMKCPGWJR-UHFFFAOYSA-N	-1	3	343.340	1.132	20	5		EDBDHM
CCc1cc(=O)[n-]c(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1	ZINC000121217121	442193415	/nfs/dbraw/zinc/19/34/15/442193415.db2.gz	XOAMZFDGGPJHSC-LBPRGKRZSA-N	-1	3	344.375	1.734	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCn2cc([N+](=O)[O-])cn2)c(F)cc1F	ZINC000152819797	442246229	/nfs/dbraw/zinc/24/62/29/442246229.db2.gz	ACNNAAXMKZBSEJ-UHFFFAOYSA-N	-1	3	346.315	1.356	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC(C)(C)CCO)c1C	ZINC000178827666	442496196	/nfs/dbraw/zinc/49/61/96/442496196.db2.gz	BJZHELTYZNQRMN-UHFFFAOYSA-N	-1	3	330.406	1.899	20	5		EDBDHM
CCc1ncc([N-]S(=O)(=O)CCc2ccccc2[N+](=O)[O-])cn1	ZINC000157386811	442578208	/nfs/dbraw/zinc/57/82/08/442578208.db2.gz	XOYSEWAUSDAXFH-UHFFFAOYSA-N	-1	3	336.373	1.932	20	5		EDBDHM
C[C@@H](C[S@@](C)=O)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000183209849	442904669	/nfs/dbraw/zinc/90/46/69/442904669.db2.gz	BXHHTOKTVHMXFI-ZDVLTJLQSA-N	-1	3	340.810	1.294	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H](O)C2CCC2)c(Cl)c1	ZINC000315957774	318933791	/nfs/dbraw/zinc/93/37/91/318933791.db2.gz	CNNULSFISKKIPM-LLVKDONJSA-N	-1	3	334.781	1.688	20	5		EDBDHM
CCOc1cc(-c2noc(Cn3cc([N+](=O)[O-])cn3)n2)ccc1[O-]	ZINC000350791630	319070230	/nfs/dbraw/zinc/07/02/30/319070230.db2.gz	JNMUWYIVFJWSSV-UHFFFAOYSA-N	-1	3	331.288	1.994	20	5		EDBDHM
CCOC(=O)[C@@H](C)C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000269273659	443261584	/nfs/dbraw/zinc/26/15/84/443261584.db2.gz	HMSHISFIJMNJTL-JTQLQIEISA-N	-1	3	344.389	1.689	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CCCC[C@@H]1O	ZINC000269726342	443412711	/nfs/dbraw/zinc/41/27/11/443412711.db2.gz	BXXQFTGUKRXDFQ-PWSUYJOCSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CSC1(CNC(=O)c2cc([N+](=O)[O-])ccc2[O-])CCN(C)CC1	ZINC000436800607	320023771	/nfs/dbraw/zinc/02/37/71/320023771.db2.gz	WNKFNZMJBBLDEH-UHFFFAOYSA-N	-1	3	339.417	1.858	20	5		EDBDHM
CN1CCCC(C)(C)[C@H]1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000447940710	320148808	/nfs/dbraw/zinc/14/88/08/320148808.db2.gz	OVVVLJGCMTUQTA-CQSZACIVSA-N	-1	3	341.433	1.994	20	5		EDBDHM
Cc1nc([C@@H](C)[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])n[nH]1	ZINC000285227663	443903677	/nfs/dbraw/zinc/90/36/77/443903677.db2.gz	AXKVDCRGPPMEEM-MRVPVSSYSA-N	-1	3	325.350	1.369	20	5		EDBDHM
Cc1nnc([C@@H](C)[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])[nH]1	ZINC000285227663	443903681	/nfs/dbraw/zinc/90/36/81/443903681.db2.gz	AXKVDCRGPPMEEM-MRVPVSSYSA-N	-1	3	325.350	1.369	20	5		EDBDHM
CC(C)N1CCC[C@@H]([N-]S(=O)(=O)c2cccnc2[N+](=O)[O-])C1	ZINC000562432768	321058048	/nfs/dbraw/zinc/05/80/48/321058048.db2.gz	UYHWVBPSAHBDOP-LLVKDONJSA-N	-1	3	328.394	1.141	20	5		EDBDHM
Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1[n-]nnc1C(=O)NC1CC1	ZINC000297692367	444319292	/nfs/dbraw/zinc/31/92/92/444319292.db2.gz	IYBNYQMBTHBQME-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1nn[n-]c1C(=O)NC1CC1	ZINC000297692367	444319295	/nfs/dbraw/zinc/31/92/95/444319295.db2.gz	IYBNYQMBTHBQME-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1n[n-]nc1C(=O)NC1CC1	ZINC000297692367	444319297	/nfs/dbraw/zinc/31/92/97/444319297.db2.gz	IYBNYQMBTHBQME-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
C[C@@H]1C[C@H]1N1CCN(c2nc(C(=O)[O-])ccc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000581134059	322140671	/nfs/dbraw/zinc/14/06/71/322140671.db2.gz	KWQGZPVCJWPPCL-MISXGVKJSA-N	-1	3	334.376	1.855	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H]2CCCS2)c([N+](=O)[O-])c1	ZINC000340891698	444562169	/nfs/dbraw/zinc/56/21/69/444562169.db2.gz	WJHSODISPKDKLE-SNVBAGLBSA-N	-1	3	332.403	1.777	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCc2ccncc2)cc1[N+](=O)[O-]	ZINC000342503239	444719690	/nfs/dbraw/zinc/71/96/90/444719690.db2.gz	RBQGRPAAILORJT-UHFFFAOYSA-N	-1	3	327.387	1.881	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C2(CC(N)=O)CCC2)cc1[N+](=O)[O-]	ZINC000342568811	444748529	/nfs/dbraw/zinc/74/85/29/444748529.db2.gz	QDHYPRKZBTWKQH-UHFFFAOYSA-N	-1	3	333.391	1.041	20	5		EDBDHM
C[C@]1(C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCOC1	ZINC000354503213	445266808	/nfs/dbraw/zinc/26/68/08/445266808.db2.gz	VRNAHZHTWKFGAG-GFCCVEGCSA-N	-1	3	334.781	1.953	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCN(C)[C@H](C)C2)c1C	ZINC000360215015	445633076	/nfs/dbraw/zinc/63/30/76/445633076.db2.gz	IOOVIZQDXMECSZ-YPMHNXCESA-N	-1	3	341.433	1.973	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCCCF	ZINC000360253885	445658478	/nfs/dbraw/zinc/65/84/78/445658478.db2.gz	ULOLGCSDNLDAGO-UHFFFAOYSA-N	-1	3	334.325	1.409	20	5		EDBDHM
CCOC(=O)c1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c([O-])c1	ZINC000356794007	446026470	/nfs/dbraw/zinc/02/64/70/446026470.db2.gz	DATOCHWABAFJEB-UHFFFAOYSA-N	-1	3	334.288	1.312	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](CO)c2ccsc2)c([N+](=O)[O-])c1	ZINC000351577933	446174140	/nfs/dbraw/zinc/17/41/40/446174140.db2.gz	WKFAKAKTJIGAHR-LLVKDONJSA-N	-1	3	342.398	1.977	20	5		EDBDHM
CC[C@@H](C)[C@@](C)(O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000443296060	447026109	/nfs/dbraw/zinc/02/61/09/447026109.db2.gz	OWZQFWDNSSAKMJ-YGRLFVJLSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CC[C@H](C)[C@](C)(O)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000443305197	447028521	/nfs/dbraw/zinc/02/85/21/447028521.db2.gz	KOZDEJMIICFDKW-IINYFYTJSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CC[C@@H](C[C@@H](C)CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000443306079	447029816	/nfs/dbraw/zinc/02/98/16/447029816.db2.gz	IPGJVOPMALPLKS-MNOVXSKESA-N	-1	3	346.405	1.679	20	5		EDBDHM
Cc1cc(C(=O)N2CC=C(c3ccnn3C)CC2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375948483	447167032	/nfs/dbraw/zinc/16/70/32/447167032.db2.gz	ZWBRALWOTHQJBB-UHFFFAOYSA-N	-1	3	343.343	1.667	20	5		EDBDHM
Cc1ccc(-c2cc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)[nH]n2)o1	ZINC000447800547	447291611	/nfs/dbraw/zinc/29/16/11/447291611.db2.gz	UKLFPCPBAQWPGC-UHFFFAOYSA-N	-1	3	329.272	2.239	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C(C)(C)CN(C)C)c1[N+](=O)[O-]	ZINC000416512012	447631963	/nfs/dbraw/zinc/63/19/63/447631963.db2.gz	ZZWHIMJIQDIKBH-UHFFFAOYSA-N	-1	3	329.422	1.830	20	5		EDBDHM
CC1(C)CCCN1CC[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000452088633	447814515	/nfs/dbraw/zinc/81/45/15/447814515.db2.gz	OLBWDEGCRWKVQR-UHFFFAOYSA-N	-1	3	345.396	1.887	20	5		EDBDHM
CNC(=O)Cn1cc([N-]c2nc3c(cc2[N+](=O)[O-])CCCC3)cn1	ZINC000514858174	448215294	/nfs/dbraw/zinc/21/52/94/448215294.db2.gz	FDZJYGMKUMJDRC-UHFFFAOYSA-N	-1	3	330.348	1.555	20	5		EDBDHM
C[C@H](C(=O)Nc1[n-]nnc1C(=O)NC1CC1)c1cccc([N+](=O)[O-])c1	ZINC000574018509	448769814	/nfs/dbraw/zinc/76/98/14/448769814.db2.gz	VMPMHEBJUSGGAN-QMMMGPOBSA-N	-1	3	344.331	1.347	20	5		EDBDHM
C[C@H](C(=O)Nc1nn[n-]c1C(=O)NC1CC1)c1cccc([N+](=O)[O-])c1	ZINC000574018509	448769820	/nfs/dbraw/zinc/76/98/20/448769820.db2.gz	VMPMHEBJUSGGAN-QMMMGPOBSA-N	-1	3	344.331	1.347	20	5		EDBDHM
C[C@H](C(=O)Nc1n[n-]nc1C(=O)NC1CC1)c1cccc([N+](=O)[O-])c1	ZINC000574018509	448769826	/nfs/dbraw/zinc/76/98/26/448769826.db2.gz	VMPMHEBJUSGGAN-QMMMGPOBSA-N	-1	3	344.331	1.347	20	5		EDBDHM
C[C@@H](C(=O)Nc1[n-]nnc1C(=O)NC1CC1)c1cccc([N+](=O)[O-])c1	ZINC000574018508	448770246	/nfs/dbraw/zinc/77/02/46/448770246.db2.gz	VMPMHEBJUSGGAN-MRVPVSSYSA-N	-1	3	344.331	1.347	20	5		EDBDHM
C[C@@H](C(=O)Nc1nn[n-]c1C(=O)NC1CC1)c1cccc([N+](=O)[O-])c1	ZINC000574018508	448770250	/nfs/dbraw/zinc/77/02/50/448770250.db2.gz	VMPMHEBJUSGGAN-MRVPVSSYSA-N	-1	3	344.331	1.347	20	5		EDBDHM
C[C@@H](C(=O)Nc1n[n-]nc1C(=O)NC1CC1)c1cccc([N+](=O)[O-])c1	ZINC000574018508	448770255	/nfs/dbraw/zinc/77/02/55/448770255.db2.gz	VMPMHEBJUSGGAN-MRVPVSSYSA-N	-1	3	344.331	1.347	20	5		EDBDHM
Cc1cc(N2CCN(C[C@@H]3CCOC3)CC2)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000519782113	448843339	/nfs/dbraw/zinc/84/33/39/448843339.db2.gz	YPOSVVDKYYMVFH-ZDUSSCGKSA-N	-1	3	349.387	1.760	20	5		EDBDHM
CC(C)[C@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCO1	ZINC000593573083	449080808	/nfs/dbraw/zinc/08/08/08/449080808.db2.gz	VMAPPSZDMHVOCJ-CMPLNLGQSA-N	-1	3	329.378	1.472	20	5		EDBDHM
CCC[C@H](C)[C@H](CO)[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000593624221	449114671	/nfs/dbraw/zinc/11/46/71/449114671.db2.gz	GRVSBNPOIJAQSR-QWRGUYRKSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CC[C@@H](C)[C@@H](O)C[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F	ZINC000590590337	449206560	/nfs/dbraw/zinc/20/65/60/449206560.db2.gz	FVBQGCMKRCIAAA-PELKAZGASA-N	-1	3	334.369	1.728	20	5		EDBDHM
O=c1[n-]ccc(N2CCN(Cc3cccc(O)c3)CC2)c1[N+](=O)[O-]	ZINC000596106278	449364323	/nfs/dbraw/zinc/36/43/23/449364323.db2.gz	RZNQQQBHKWNYRE-UHFFFAOYSA-N	-1	3	330.344	1.723	20	5		EDBDHM
CC1(C)C[C@]1(C)NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000598386325	449375347	/nfs/dbraw/zinc/37/53/47/449375347.db2.gz	NSSMEXRSDDIUSW-AWEZNQCLSA-N	-1	3	341.389	1.178	20	5		EDBDHM
O=C(c1cc(F)c[n-]c1=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000598740654	449575577	/nfs/dbraw/zinc/57/55/77/449575577.db2.gz	UVTBRZBOWWMCMG-UHFFFAOYSA-N	-1	3	347.306	1.192	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)C1(CO)CC1	ZINC000594826989	449733629	/nfs/dbraw/zinc/73/36/29/449733629.db2.gz	JDFLASLWPDKLGE-VIFPVBQESA-N	-1	3	330.362	1.043	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-]CC1=CCCOC1	ZINC000594778559	449690547	/nfs/dbraw/zinc/69/05/47/449690547.db2.gz	KDAUWLYVEPLWQI-UHFFFAOYSA-N	-1	3	349.368	1.768	20	5		EDBDHM
C[C@@]1(O)C[C@H]([N-]S(=O)(=O)c2ccc3ncccc3c2[N+](=O)[O-])C1	ZINC000594783671	449693495	/nfs/dbraw/zinc/69/34/95/449693495.db2.gz	VCBSMKBJUPAWNY-DEZZCRIOSA-N	-1	3	337.357	1.335	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1C[C@@H](O)C12CCC2	ZINC000594866249	449780431	/nfs/dbraw/zinc/78/04/31/449780431.db2.gz	UIKNHVSMYDPJCY-NWDGAFQWSA-N	-1	3	326.374	1.485	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN2CCC(C)CC2)c([N+](=O)[O-])s1	ZINC000601303623	449812954	/nfs/dbraw/zinc/81/29/54/449812954.db2.gz	HDECBFSEEUTNJG-UHFFFAOYSA-N	-1	3	347.462	1.975	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@H](C)CN2CCCC2)c([N+](=O)[O-])s1	ZINC000601310619	449820739	/nfs/dbraw/zinc/82/07/39/449820739.db2.gz	RGUAYISBHCFEEO-SNVBAGLBSA-N	-1	3	347.462	1.975	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2CCN(C3CC3)C2)c(F)cc1[N+](=O)[O-]	ZINC000601318544	449828052	/nfs/dbraw/zinc/82/80/52/449828052.db2.gz	OFCSESBJZSVULG-SNVBAGLBSA-N	-1	3	343.380	1.557	20	5		EDBDHM
Cn1nc(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21	ZINC000612799502	449883197	/nfs/dbraw/zinc/88/31/97/449883197.db2.gz	QJNASUKEHHDRKT-UHFFFAOYSA-N	-1	3	346.368	1.960	20	5		EDBDHM
O=C([O-])[C@@H]1CSCCN1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000595280708	449997578	/nfs/dbraw/zinc/99/75/78/449997578.db2.gz	WVMDVGONVHJIOV-ZDUSSCGKSA-N	-1	3	326.374	1.866	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1CO[C@@H](C2CC2)C1	ZINC000599483278	450010778	/nfs/dbraw/zinc/01/07/78/450010778.db2.gz	UVZAYVXGAVEWTE-CMPLNLGQSA-N	-1	3	342.373	1.449	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000609793539	450098542	/nfs/dbraw/zinc/09/85/42/450098542.db2.gz	FHWJYPZUANHAJX-LLVKDONJSA-N	-1	3	338.751	1.419	20	5		EDBDHM
Cc1cc(OCC(=O)NCCCc2cc(=O)[nH][n-]2)ccc1[N+](=O)[O-]	ZINC000597665618	450180905	/nfs/dbraw/zinc/18/09/05/450180905.db2.gz	TWJQFMZNNZNJAW-UHFFFAOYSA-N	-1	3	334.332	1.054	20	5		EDBDHM
CC[C@@H](CN1CCCC1)[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000610576968	450265468	/nfs/dbraw/zinc/26/54/68/450265468.db2.gz	NUZOUUJVEVKNQC-NSHDSACASA-N	-1	3	345.396	1.887	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)C[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000610739549	450316972	/nfs/dbraw/zinc/31/69/72/450316972.db2.gz	BYBUFRVXTZYLAC-MNOVXSKESA-N	-1	3	344.389	1.697	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)c2cc([N+](=O)[O-])ccc2OC)[n-]1	ZINC000619447960	450476793	/nfs/dbraw/zinc/47/67/93/450476793.db2.gz	WYVLICWLHOMSKM-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)c2cc([N+](=O)[O-])ccc2OC)c[n-]1	ZINC000619447960	450476794	/nfs/dbraw/zinc/47/67/94/450476794.db2.gz	WYVLICWLHOMSKM-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1nnc(C)s1	ZINC000619495932	450491904	/nfs/dbraw/zinc/49/19/04/450491904.db2.gz	NENUKFOZYZAHQS-UHFFFAOYSA-N	-1	3	344.374	1.242	20	5		EDBDHM
CC1(C)[C@H](O)C[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000130143357	527892732	/nfs/dbraw/zinc/89/27/32/527892732.db2.gz	PRDZEPFMNSPICO-GHMZBOCLSA-N	-1	3	334.781	1.686	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H](CO)C2CC2)cc1[N+](=O)[O-]	ZINC000751416451	578550658	/nfs/dbraw/zinc/55/06/58/578550658.db2.gz	BTTOMTOTYKLOSV-SNVBAGLBSA-N	-1	3	334.781	1.606	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H](CCO)C2CC2)c(Cl)c1	ZINC000751441164	578551375	/nfs/dbraw/zinc/55/13/75/578551375.db2.gz	ASUJAHVOLWMASH-LLVKDONJSA-N	-1	3	334.781	1.688	20	5		EDBDHM
CC1(C)COCCN1CCNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000736215378	578965593	/nfs/dbraw/zinc/96/55/93/578965593.db2.gz	WSUBHWJJUMIHAG-UHFFFAOYSA-N	-1	3	347.379	1.298	20	5		EDBDHM
CC1(C)COCCN1CCNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000736215378	578965594	/nfs/dbraw/zinc/96/55/94/578965594.db2.gz	WSUBHWJJUMIHAG-UHFFFAOYSA-N	-1	3	347.379	1.298	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccncc2-c2nnn[n-]2)c1	ZINC000737367894	579080058	/nfs/dbraw/zinc/08/00/58/579080058.db2.gz	CHWICICWQVBHDN-UHFFFAOYSA-N	-1	3	325.288	1.153	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccncc2-c2nn[n-]n2)c1	ZINC000737367894	579080060	/nfs/dbraw/zinc/08/00/60/579080060.db2.gz	CHWICICWQVBHDN-UHFFFAOYSA-N	-1	3	325.288	1.153	20	5		EDBDHM
NC(=O)C1([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CCCC1	ZINC000777999445	580454592	/nfs/dbraw/zinc/45/45/92/580454592.db2.gz	IQPWGHGQACPYQI-UHFFFAOYSA-N	-1	3	327.287	1.601	20	5		EDBDHM
CC[C@H](CN1CCCC1)[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000751254314	579799279	/nfs/dbraw/zinc/79/92/79/579799279.db2.gz	QHEXZGZWPKYYGZ-LLVKDONJSA-N	-1	3	345.396	1.887	20	5		EDBDHM
C[C@](O)(C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccsc1	ZINC000751438349	579806716	/nfs/dbraw/zinc/80/67/16/579806716.db2.gz	LZRZHRRKGPCRLE-ZDUSSCGKSA-N	-1	3	342.398	1.842	20	5		EDBDHM
Nc1c(C(=O)OCC(=O)[N-]C(=O)c2cccs2)cccc1[N+](=O)[O-]	ZINC000758956805	579995223	/nfs/dbraw/zinc/99/52/23/579995223.db2.gz	UGPKZOVYMQWYGB-UHFFFAOYSA-N	-1	3	349.324	1.352	20	5		EDBDHM
O=C([N-]CCn1cc([N+](=O)[O-])cn1)C(F)(F)c1ccccc1F	ZINC000765863078	580152742	/nfs/dbraw/zinc/15/27/42/580152742.db2.gz	GNLDFZLQBKSHTK-UHFFFAOYSA-N	-1	3	328.250	1.839	20	5		EDBDHM
CN1C(=S)N=NC1C[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000778260106	580460173	/nfs/dbraw/zinc/46/01/73/580460173.db2.gz	AXDPGHVGRDEQHX-UHFFFAOYSA-N	-1	3	343.315	1.420	20	5		EDBDHM
O=C([N-]c1cnccn1)c1c2c(cc([N+](=O)[O-])c1[N+](=O)[O-])OCCO2	ZINC000766362068	580165229	/nfs/dbraw/zinc/16/52/29/580165229.db2.gz	YPOVYONQBDVMPS-UHFFFAOYSA-N	-1	3	347.243	1.317	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@H]2CCCc3c[nH]nc32)cs1	ZINC000768863013	580222855	/nfs/dbraw/zinc/22/28/55/580222855.db2.gz	ODVFPPNSOWHGTG-VIFPVBQESA-N	-1	3	328.375	1.735	20	5		EDBDHM
O=C([N-]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(F)(F)C1(O)CCC1	ZINC000769600334	580241316	/nfs/dbraw/zinc/24/13/16/580241316.db2.gz	MCSPMTPOHPNMNW-UHFFFAOYSA-N	-1	3	340.286	1.638	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)[C@H]1CCCO1	ZINC000788711087	580728327	/nfs/dbraw/zinc/72/83/27/580728327.db2.gz	UCJSCQPTNMSXAC-VHSXEESVSA-N	-1	3	336.391	1.129	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]Cc2nncn2C2CC2)cs1	ZINC000795960847	580942225	/nfs/dbraw/zinc/94/22/25/580942225.db2.gz	QZNXNEMEUPUQKA-UHFFFAOYSA-N	-1	3	329.363	1.061	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NCCCOC[C@@H]1CCOC1	ZINC000738357955	598973711	/nfs/dbraw/zinc/97/37/11/598973711.db2.gz	JHSHSNSYEICKRM-NSHDSACASA-N	-1	3	348.363	1.630	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NCCCOC[C@@H]1CCOC1	ZINC000738357955	598973712	/nfs/dbraw/zinc/97/37/12/598973712.db2.gz	JHSHSNSYEICKRM-NSHDSACASA-N	-1	3	348.363	1.630	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]C[C@@H]1CC[C@@H](C2CC2)O1	ZINC000907470684	592652092	/nfs/dbraw/zinc/65/20/92/592652092.db2.gz	SIGAATQOQLNUEA-ZFWWWQNUSA-N	-1	3	340.401	1.972	20	5		EDBDHM
CCc1ccc(OC(=O)c2cc(-c3nnn[n-]3)cn2C)c([N+](=O)[O-])c1	ZINC000821487454	593845173	/nfs/dbraw/zinc/84/51/73/593845173.db2.gz	UBSBLOFAPLMYSI-UHFFFAOYSA-N	-1	3	342.315	1.895	20	5		EDBDHM
CCc1ccc(OC(=O)c2cc(-c3nn[n-]n3)cn2C)c([N+](=O)[O-])c1	ZINC000821487454	593845175	/nfs/dbraw/zinc/84/51/75/593845175.db2.gz	UBSBLOFAPLMYSI-UHFFFAOYSA-N	-1	3	342.315	1.895	20	5		EDBDHM
COc1cc(C(=O)OC[C@@H]2CCCN2CC(=O)[O-])ccc1[N+](=O)[O-]	ZINC000820759286	593884251	/nfs/dbraw/zinc/88/42/51/593884251.db2.gz	NTHPGSKEZBKZGT-NSHDSACASA-N	-1	3	338.316	1.309	20	5		EDBDHM
COC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C[C@H]1C	ZINC000821656825	593899801	/nfs/dbraw/zinc/89/98/01/593899801.db2.gz	ACGNGZCBNUBEEB-LDYMZIIASA-N	-1	3	332.320	1.020	20	5		EDBDHM
COC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C[C@H]1C	ZINC000821656825	593899802	/nfs/dbraw/zinc/89/98/02/593899802.db2.gz	ACGNGZCBNUBEEB-LDYMZIIASA-N	-1	3	332.320	1.020	20	5		EDBDHM
CC(C)C(=O)NCCCNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000824178052	593946813	/nfs/dbraw/zinc/94/68/13/593946813.db2.gz	LQAJFDBBDWIVEE-UHFFFAOYSA-N	-1	3	333.352	1.349	20	5		EDBDHM
CC(C)C(=O)NCCCNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000824178052	593946814	/nfs/dbraw/zinc/94/68/14/593946814.db2.gz	LQAJFDBBDWIVEE-UHFFFAOYSA-N	-1	3	333.352	1.349	20	5		EDBDHM
C[C@@H](CCO)C1(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CCC1	ZINC000824407713	594005015	/nfs/dbraw/zinc/00/50/15/594005015.db2.gz	ZAJACPLXLMZQPQ-JTQLQIEISA-N	-1	3	347.379	1.771	20	5		EDBDHM
C[C@@H](CCO)C1(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CCC1	ZINC000824407713	594005017	/nfs/dbraw/zinc/00/50/17/594005017.db2.gz	ZAJACPLXLMZQPQ-JTQLQIEISA-N	-1	3	347.379	1.771	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cnc1NCCNc1ncccc1-c1nnn[n-]1	ZINC000822213044	594011854	/nfs/dbraw/zinc/01/18/54/594011854.db2.gz	RSZRMRGWYWGNOR-UHFFFAOYSA-N	-1	3	341.335	1.397	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cnc1NCCNc1ncccc1-c1nn[n-]n1	ZINC000822213044	594011857	/nfs/dbraw/zinc/01/18/57/594011857.db2.gz	RSZRMRGWYWGNOR-UHFFFAOYSA-N	-1	3	341.335	1.397	20	5		EDBDHM
O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccncc1-c1nnn[n-]1	ZINC000822982823	594131985	/nfs/dbraw/zinc/13/19/85/594131985.db2.gz	IXDNMEMNDQBAJU-UHFFFAOYSA-N	-1	3	339.315	1.163	20	5		EDBDHM
O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccncc1-c1nn[n-]n1	ZINC000822982823	594131986	/nfs/dbraw/zinc/13/19/86/594131986.db2.gz	IXDNMEMNDQBAJU-UHFFFAOYSA-N	-1	3	339.315	1.163	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCC2(C1)CCOCC2	ZINC000823629825	594223002	/nfs/dbraw/zinc/22/30/02/594223002.db2.gz	IVIFVFYJUBZXAQ-UHFFFAOYSA-N	-1	3	330.348	1.782	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCC2(C1)CCOCC2	ZINC000823629825	594223003	/nfs/dbraw/zinc/22/30/03/594223003.db2.gz	IVIFVFYJUBZXAQ-UHFFFAOYSA-N	-1	3	330.348	1.782	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(NC[C@@H](O)C3CC3)cc(-c3nnn[n-]3)c2c1	ZINC000823644224	594224340	/nfs/dbraw/zinc/22/43/40/594224340.db2.gz	GXDDBXDUTGAJOY-CYBMUJFWSA-N	-1	3	341.331	1.506	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(NC[C@@H](O)C3CC3)cc(-c3nn[n-]n3)c2c1	ZINC000823644224	594224341	/nfs/dbraw/zinc/22/43/41/594224341.db2.gz	GXDDBXDUTGAJOY-CYBMUJFWSA-N	-1	3	341.331	1.506	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2ccn3ccnc3c2)c(-c2nnn[n-]2)c1	ZINC000823651496	594224710	/nfs/dbraw/zinc/22/47/10/594224710.db2.gz	MICNJGCBEMHCRB-UHFFFAOYSA-N	-1	3	337.303	1.430	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2ccn3ccnc3c2)c(-c2nn[n-]n2)c1	ZINC000823651496	594224711	/nfs/dbraw/zinc/22/47/11/594224711.db2.gz	MICNJGCBEMHCRB-UHFFFAOYSA-N	-1	3	337.303	1.430	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@@H]2CCC[C@H]3OCC[C@@H]32)c(-c2nnn[n-]2)c1	ZINC000823651441	594224781	/nfs/dbraw/zinc/22/47/81/594224781.db2.gz	JQKXYMWIEHEPGH-YUSALJHKSA-N	-1	3	331.336	1.539	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@@H]2CCC[C@H]3OCC[C@@H]32)c(-c2nn[n-]n2)c1	ZINC000823651441	594224782	/nfs/dbraw/zinc/22/47/82/594224782.db2.gz	JQKXYMWIEHEPGH-YUSALJHKSA-N	-1	3	331.336	1.539	20	5		EDBDHM
NC(=O)c1ccc(COc2ccc(-c3nnn[n-]3)cc2)c([N+](=O)[O-])c1	ZINC000826393443	594457725	/nfs/dbraw/zinc/45/77/25/594457725.db2.gz	SEAMNGDEPCFUGL-UHFFFAOYSA-N	-1	3	340.299	1.453	20	5		EDBDHM
NC(=O)c1ccc(COc2ccc(-c3nn[n-]n3)cc2)c([N+](=O)[O-])c1	ZINC000826393443	594457727	/nfs/dbraw/zinc/45/77/27/594457727.db2.gz	SEAMNGDEPCFUGL-UHFFFAOYSA-N	-1	3	340.299	1.453	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCN(CC3CC3)CC2)cc1-c1nnn[n-]1	ZINC000826499135	594502500	/nfs/dbraw/zinc/50/25/00/594502500.db2.gz	WWILDMAXGNTRQM-UHFFFAOYSA-N	-1	3	329.364	1.307	20	5		EDBDHM
O=[N+]([O-])c1ccc([C@H](O)COc2cccc(-c3nnn[n-]3)c2)cc1	ZINC000826498205	594503022	/nfs/dbraw/zinc/50/30/22/594503022.db2.gz	LGQLTRNDXQSUEE-CQSZACIVSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1ccc([C@H](O)COc2cccc(-c3nn[n-]n3)c2)cc1	ZINC000826498205	594503024	/nfs/dbraw/zinc/50/30/24/594503024.db2.gz	LGQLTRNDXQSUEE-CQSZACIVSA-N	-1	3	327.300	1.887	20	5		EDBDHM
CC(C)OC[C@H](C(=O)[O-])N(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000833505835	594861268	/nfs/dbraw/zinc/86/12/68/594861268.db2.gz	OIHXHWOGMVHUPS-ZIAGYGMSSA-N	-1	3	326.349	1.438	20	5		EDBDHM
COc1ccc([C@@H]2C[C@H]2[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)cc1	ZINC000845929442	595098376	/nfs/dbraw/zinc/09/83/76/595098376.db2.gz	UUPUCOVCUIZGSN-UONOGXRCSA-N	-1	3	349.368	1.833	20	5		EDBDHM
CC(C)(C(=O)OCc1cc(=O)[n-]c(C2CC2)n1)n1cc([N+](=O)[O-])cn1	ZINC000837490902	595124174	/nfs/dbraw/zinc/12/41/74/595124174.db2.gz	AMUUKXSTZCFLME-UHFFFAOYSA-N	-1	3	347.331	1.643	20	5		EDBDHM
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC[C@H]2CN3CCC[C@H]3CO2)n1	ZINC000844208178	595302844	/nfs/dbraw/zinc/30/28/44/595302844.db2.gz	JWZHDVQRQBLQMS-QWRGUYRKSA-N	-1	3	336.348	1.272	20	5		EDBDHM
C[C@@H](Cn1cncn1)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848582445	595409278	/nfs/dbraw/zinc/40/92/78/595409278.db2.gz	LIAOWFJLBZDASX-VIFPVBQESA-N	-1	3	341.274	1.363	20	5		EDBDHM
C[C@@H]([N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)c1nnc[nH]1	ZINC000848585631	595409948	/nfs/dbraw/zinc/40/99/48/595409948.db2.gz	NLLVNIMDDSCNJB-SSDOTTSWSA-N	-1	3	327.247	1.562	20	5		EDBDHM
C[S@](=O)C1(C[N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000848590003	595410996	/nfs/dbraw/zinc/41/09/96/595410996.db2.gz	LGIOSQZACHQYLF-QHCPKHFHSA-N	-1	3	348.327	1.594	20	5		EDBDHM
COc1cc(OC)cc([C@@H](O)CNc2cc[n-]c(=O)c2[N+](=O)[O-])c1	ZINC000853351908	595741139	/nfs/dbraw/zinc/74/11/39/595741139.db2.gz	ZEBVGVKPMDDKFT-ZDUSSCGKSA-N	-1	3	335.316	1.858	20	5		EDBDHM
CC1(C)CO[C@@H](C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000872549551	596960799	/nfs/dbraw/zinc/96/07/99/596960799.db2.gz	VXRNRQHGBBCUHR-GFCCVEGCSA-N	-1	3	328.390	1.829	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@@H]2C[C@@H]3CCC[C@@H]3O2)cs1	ZINC000872557716	596964151	/nfs/dbraw/zinc/96/41/51/596964151.db2.gz	RWBWBRLUAPXHSA-QXEWZRGKSA-N	-1	3	332.403	1.892	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCc2cn3c(n2)CCCC3)c(-c2nnn[n-]2)c1	ZINC000738371612	598395241	/nfs/dbraw/zinc/39/52/41/598395241.db2.gz	UKPBMAACKYWFPU-UHFFFAOYSA-N	-1	3	340.347	1.920	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCc2cn3c(n2)CCCC3)c(-c2nn[n-]n2)c1	ZINC000738371612	598395243	/nfs/dbraw/zinc/39/52/43/598395243.db2.gz	UKPBMAACKYWFPU-UHFFFAOYSA-N	-1	3	340.347	1.920	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@@H](n3ccnc3)C2)c(-c2nnn[n-]2)c1	ZINC000738368659	598502525	/nfs/dbraw/zinc/50/25/25/598502525.db2.gz	HPWCNXZFNDIJES-SNVBAGLBSA-N	-1	3	341.335	1.208	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@@H](n3ccnc3)C2)c(-c2nn[n-]n2)c1	ZINC000738368659	598502527	/nfs/dbraw/zinc/50/25/27/598502527.db2.gz	HPWCNXZFNDIJES-SNVBAGLBSA-N	-1	3	341.335	1.208	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H](O)Cc2ccccc2)c(-c2nnn[n-]2)c1	ZINC000738370127	598798212	/nfs/dbraw/zinc/79/82/12/598798212.db2.gz	QEWFMIBSZJVTIK-GFCCVEGCSA-N	-1	3	341.331	1.185	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H](O)Cc2ccccc2)c(-c2nn[n-]n2)c1	ZINC000738370127	598798213	/nfs/dbraw/zinc/79/82/13/598798213.db2.gz	QEWFMIBSZJVTIK-GFCCVEGCSA-N	-1	3	341.331	1.185	20	5		EDBDHM
Cc1cc(N2CCN(C[C@@H]3CCOC3)CC2)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000564334073	306358952	/nfs/dbraw/zinc/35/89/52/306358952.db2.gz	AQBQWUOLNVFLOT-ZDUSSCGKSA-N	-1	3	349.387	1.760	20	5		EDBDHM
O=[N+]([O-])c1ccc(CS(=O)(=O)[N-][C@H]2Cc3ccccc3[C@H]2O)cc1	ZINC000178717587	138744912	/nfs/dbraw/zinc/74/49/12/138744912.db2.gz	GNNKRQWADFNDJN-JKSUJKDBSA-N	-1	3	348.380	1.673	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CO[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000564906077	306369321	/nfs/dbraw/zinc/36/93/21/306369321.db2.gz	HSEXZEBDANHHGP-SFYZADRCSA-N	-1	3	334.325	1.198	20	5		EDBDHM
Cc1cc(N2CCO[C@H](CN(C)CC(=O)[O-])C2)c(F)cc1[N+](=O)[O-]	ZINC000416403370	251067587	/nfs/dbraw/zinc/06/75/87/251067587.db2.gz	NJJPCFPUYJPCCN-LLVKDONJSA-N	-1	3	341.339	1.264	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2C[C@H](C)O[C@@H]2C)c([N+](=O)[O-])c1	ZINC000416613044	251082877	/nfs/dbraw/zinc/08/28/77/251082877.db2.gz	ZQIXGFLEJONNIO-AXFHLTTASA-N	-1	3	344.389	1.695	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CCc2ccco2)cc1[N+](=O)[O-]	ZINC000493505764	255212835	/nfs/dbraw/zinc/21/28/35/255212835.db2.gz	ZBGYWWHHIKCQFZ-UHFFFAOYSA-N	-1	3	344.320	1.857	20	5		EDBDHM
CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCN2C(=O)[N-]C(=O)[C@H]2C1	ZINC000347378100	533383145	/nfs/dbraw/zinc/38/31/45/533383145.db2.gz	NEWIEFVEDVIIHW-SMJHDNPOSA-N	-1	3	330.344	1.234	20	5		EDBDHM
CC[C@H](NC(=O)CC[C@H]1NC(=O)[N-]C1=O)c1cccc([N+](=O)[O-])c1	ZINC000267254347	139592186	/nfs/dbraw/zinc/59/21/86/139592186.db2.gz	DULKDCCHMXQNGC-NWDGAFQWSA-N	-1	3	334.332	1.150	20	5		EDBDHM
CCOC(=O)CC[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000267513190	139626808	/nfs/dbraw/zinc/62/68/08/139626808.db2.gz	CKXIUZFKFBPAAB-UHFFFAOYSA-N	-1	3	330.362	1.443	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H]2CCC[C@H]2O)cc1C	ZINC000270220457	140062352	/nfs/dbraw/zinc/06/23/52/140062352.db2.gz	PHKDYOLMHUAXRR-WCQYABFASA-N	-1	3	328.390	1.651	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CC[C@@H](F)C1	ZINC000344907382	143025823	/nfs/dbraw/zinc/02/58/23/143025823.db2.gz	IFECTHIYLBFJCT-BDAKNGLRSA-N	-1	3	346.336	1.550	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@@H]2C[C@H](C)O[C@H]2C)c([N+](=O)[O-])c1	ZINC000416610546	304337878	/nfs/dbraw/zinc/33/78/78/304337878.db2.gz	WWGBRFVPVPPDJB-SRVKXCTJSA-N	-1	3	328.390	1.995	20	5		EDBDHM
CCN1CC[C@@H]2OCCN(C(=O)c3cccc([O-])c3[N+](=O)[O-])[C@@H]2C1	ZINC000355328889	150220246	/nfs/dbraw/zinc/22/02/46/150220246.db2.gz	YUNBBVJJVPSVGD-OCCSQVGLSA-N	-1	3	335.360	1.236	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1ncccc1C	ZINC000355387803	150248705	/nfs/dbraw/zinc/24/87/05/150248705.db2.gz	AWQRKTZEGTZGLN-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
Cc1nc(C)c(Cc2nc(Cc3ccc([N+](=O)[O-])cn3)no2)c(=O)[n-]1	ZINC000357335315	151000068	/nfs/dbraw/zinc/00/00/68/151000068.db2.gz	XWHYEUGQNXAMMV-UHFFFAOYSA-N	-1	3	342.315	1.667	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@]1(C)CCCOC1	ZINC000357419335	151026297	/nfs/dbraw/zinc/02/62/97/151026297.db2.gz	UNCMNVUQEBLERS-CYBMUJFWSA-N	-1	3	330.362	1.451	20	5		EDBDHM
Cc1c(CNC(=O)c2cnc3c(cnn3C)c2[O-])cccc1[N+](=O)[O-]	ZINC000360529022	152082177	/nfs/dbraw/zinc/08/21/77/152082177.db2.gz	OADLSZFILJPFMD-UHFFFAOYSA-N	-1	3	341.327	1.821	20	5		EDBDHM
CC(C)(CO)[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C1CC1	ZINC000352552457	162248989	/nfs/dbraw/zinc/24/89/89/162248989.db2.gz	VOBMARMTXKDOPK-ZDUSSCGKSA-N	-1	3	328.390	1.670	20	5		EDBDHM
COCCOC[C@H](C)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000360573257	292589915	/nfs/dbraw/zinc/58/99/15/292589915.db2.gz	ZXWQOXPCZDHTKF-NSHDSACASA-N	-1	3	332.378	1.233	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-]	ZINC000275039982	268270181	/nfs/dbraw/zinc/27/01/81/268270181.db2.gz	FHOJHHGNSAAUJV-JQWIXIFHSA-N	-1	3	348.352	1.324	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2C[C@H](O)C2(C)C)c([N+](=O)[O-])c1	ZINC000275356594	268329109	/nfs/dbraw/zinc/32/91/09/268329109.db2.gz	HWUMUYLRVQNAOE-NEPJUHHUSA-N	-1	3	330.362	1.041	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H](C)[C@@H]2CCOC2)cc1[N+](=O)[O-]	ZINC000275076964	273099557	/nfs/dbraw/zinc/09/95/57/273099557.db2.gz	MGNRSIBSURONRT-RKDXNWHRSA-N	-1	3	348.352	1.446	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C(C)C)C(C)(C)O	ZINC000277128833	273181821	/nfs/dbraw/zinc/18/18/21/273181821.db2.gz	WJOWWCCGMLPCED-ZDUSSCGKSA-N	-1	3	346.405	1.677	20	5		EDBDHM
CC1CCN(C(=O)C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000280852046	273406571	/nfs/dbraw/zinc/40/65/71/273406571.db2.gz	WRHRQVWIDAMFCR-UHFFFAOYSA-N	-1	3	341.389	1.132	20	5		EDBDHM
O=C(/C=C\c1cncc([O-])c1)NCCNc1ccccc1[N+](=O)[O-]	ZINC000254966936	287825729	/nfs/dbraw/zinc/82/57/29/287825729.db2.gz	NGFIFUROHBFWAY-WAYWQWQTSA-N	-1	3	328.328	1.937	20	5		EDBDHM
CCN(CC[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C1CC1	ZINC000077389275	276131114	/nfs/dbraw/zinc/13/11/14/276131114.db2.gz	FTGMUFUPDNQEMO-UHFFFAOYSA-N	-1	3	341.433	1.974	20	5		EDBDHM
CC(C)(C(=O)N1CCc2nc[n-]c(=O)c2C1)c1ccccc1[N+](=O)[O-]	ZINC000343404243	278268926	/nfs/dbraw/zinc/26/89/26/278268926.db2.gz	QSGQPZBFCRMBJM-UHFFFAOYSA-N	-1	3	342.355	1.953	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC2=CCCOC2)c(Cl)c1	ZINC000287139824	288164632	/nfs/dbraw/zinc/16/46/32/288164632.db2.gz	BUBZIJQFAGXSKM-UHFFFAOYSA-N	-1	3	332.765	1.873	20	5		EDBDHM
CCNC(=O)[C@@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(C)C	ZINC000292507084	289366605	/nfs/dbraw/zinc/36/66/05/289366605.db2.gz	GOVSFODHSPWZPR-LBPRGKRZSA-N	-1	3	343.405	1.342	20	5		EDBDHM
CO[C@@H](C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C1CC1	ZINC000293739585	303012342	/nfs/dbraw/zinc/01/23/42/303012342.db2.gz	HMFVPWGKMWRPCG-LBPRGKRZSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCCC1(O)CCC1	ZINC000420724263	304776666	/nfs/dbraw/zinc/77/66/66/304776666.db2.gz	ZSHWDPKJUCUCRI-UHFFFAOYSA-N	-1	3	328.390	1.877	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H]1CCO[C@]2(CCOC2)C1	ZINC000371401468	304810475	/nfs/dbraw/zinc/81/04/75/304810475.db2.gz	PFAOXPUWXANIMR-SMDDNHRTSA-N	-1	3	342.373	1.211	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C2(c3nc[nH]n3)CCC2)c([N+](=O)[O-])c1	ZINC000439217877	305195362	/nfs/dbraw/zinc/19/53/62/305195362.db2.gz	SJRRFUIVSZNTSU-UHFFFAOYSA-N	-1	3	337.361	1.379	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2C[C@@H](OC)C2(C)C)c([N+](=O)[O-])c1	ZINC000440397907	305205615	/nfs/dbraw/zinc/20/56/15/305205615.db2.gz	MCRKRNYSVDXDQY-CHWSQXEVSA-N	-1	3	344.389	1.695	20	5		EDBDHM
COC(=O)c1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1O	ZINC000445177745	305257480	/nfs/dbraw/zinc/25/74/80/305257480.db2.gz	WYAIIDOMSLHCPT-UHFFFAOYSA-N	-1	3	333.256	1.440	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CO)[C@@H]2CCCO2)c1C	ZINC000447945089	305289507	/nfs/dbraw/zinc/28/95/07/305289507.db2.gz	PAIFBVMHTKKORG-AAEUAGOBSA-N	-1	3	344.389	1.030	20	5		EDBDHM
CO[C@H]1COCC[C@@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000451780994	305368677	/nfs/dbraw/zinc/36/86/77/305368677.db2.gz	WTDPKSGUKFWLET-SKDRFNHKSA-N	-1	3	348.352	1.064	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)[C@@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000451987725	305376480	/nfs/dbraw/zinc/37/64/80/305376480.db2.gz	JVKVHRIOQILYLU-LKFCYVNXSA-N	-1	3	344.389	1.695	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C	ZINC000536689433	306025223	/nfs/dbraw/zinc/02/52/23/306025223.db2.gz	QQXAODMOQCSQNG-LBPRGKRZSA-N	-1	3	332.360	1.762	20	5		EDBDHM
CC(C)(C)n1cnc([N-]C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)n1	ZINC000541314989	306044870	/nfs/dbraw/zinc/04/48/70/306044870.db2.gz	OTGITWJEFQIAMF-UHFFFAOYSA-N	-1	3	347.331	1.965	20	5		EDBDHM
O=C(NCCNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc([O-])cc1	ZINC000047545220	441203024	/nfs/dbraw/zinc/20/30/24/441203024.db2.gz	BUIYTQDQUYTGAW-UHFFFAOYSA-N	-1	3	329.312	1.460	20	5		EDBDHM
CN(CC[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-])C1CCCC1	ZINC000104755285	441204994	/nfs/dbraw/zinc/20/49/94/441204994.db2.gz	BEIDURVUUHHAHK-UHFFFAOYSA-N	-1	3	345.396	1.887	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C(N)=O)C(C)(C)C)cc1C	ZINC000113290398	441598428	/nfs/dbraw/zinc/59/84/28/441598428.db2.gz	WSDAJIHGKXIFFB-LBPRGKRZSA-N	-1	3	343.405	1.390	20	5		EDBDHM
COC(=O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000039051089	441616738	/nfs/dbraw/zinc/61/67/38/441616738.db2.gz	QKIYIPREQMDWDV-UHFFFAOYSA-N	-1	3	342.251	1.065	20	5		EDBDHM
CCC[C@](C)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)OC	ZINC000056036813	441683828	/nfs/dbraw/zinc/68/38/28/441683828.db2.gz	IUMWFIBSCVSVGE-ZDUSSCGKSA-N	-1	3	348.352	1.744	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H](C)[C@@H](C)CO)cc1[N+](=O)[O-]	ZINC000120494141	442082724	/nfs/dbraw/zinc/08/27/24/442082724.db2.gz	IJJXYHQDBXWZDG-IUCAKERBSA-N	-1	3	336.797	1.852	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCO[C@H](C3CC3)C2)c(F)c1	ZINC000162781057	442121246	/nfs/dbraw/zinc/12/12/46/442121246.db2.gz	HUJFRNOSYGKFBZ-MFKMUULPSA-N	-1	3	344.364	1.970	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCO[C@@H](C3CC3)C2)c(F)c1	ZINC000162781421	442122234	/nfs/dbraw/zinc/12/22/34/442122234.db2.gz	HUJFRNOSYGKFBZ-GXFFZTMASA-N	-1	3	344.364	1.970	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CCC[C@H]2CCO)cc1[N+](=O)[O-]	ZINC000494545469	447446789	/nfs/dbraw/zinc/44/67/89/447446789.db2.gz	GVQCIRKZAKUNQN-UWVGGRQHSA-N	-1	3	334.419	1.794	20	5		EDBDHM
COc1nnc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)[n-]1	ZINC000179365725	442632685	/nfs/dbraw/zinc/63/26/85/442632685.db2.gz	RZOKWFHDUKOKMD-UHFFFAOYSA-N	-1	3	346.347	1.964	20	5		EDBDHM
COc1nc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)n[n-]1	ZINC000179365725	442632690	/nfs/dbraw/zinc/63/26/90/442632690.db2.gz	RZOKWFHDUKOKMD-UHFFFAOYSA-N	-1	3	346.347	1.964	20	5		EDBDHM
COc1n[n-]c(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)n1	ZINC000179365725	442632693	/nfs/dbraw/zinc/63/26/93/442632693.db2.gz	RZOKWFHDUKOKMD-UHFFFAOYSA-N	-1	3	346.347	1.964	20	5		EDBDHM
CCN1CCC[C@@H]1C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000193804683	442789639	/nfs/dbraw/zinc/78/96/39/442789639.db2.gz	GNSAIABGMDPKFU-CYBMUJFWSA-N	-1	3	341.433	1.974	20	5		EDBDHM
CN(CCNC(=O)c1cc([N+](=O)[O-])c[n-]c1=O)Cc1ccccc1	ZINC000193704799	442770615	/nfs/dbraw/zinc/77/06/15/442770615.db2.gz	MSVXLTNLGMQHGM-UHFFFAOYSA-N	-1	3	330.344	1.557	20	5		EDBDHM
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000189555915	442978184	/nfs/dbraw/zinc/97/81/84/442978184.db2.gz	CAESEDRWAXNQOQ-LBPRGKRZSA-N	-1	3	344.371	1.946	20	5		EDBDHM
C[C@@H]1CN(C2CC2)C[C@@H]1[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000268816956	443117941	/nfs/dbraw/zinc/11/79/41/443117941.db2.gz	WCRQFZUCILVWHA-SKDRFNHKSA-N	-1	3	343.380	1.495	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H](C)C[C@H](C)O	ZINC000269814252	443452762	/nfs/dbraw/zinc/45/27/62/443452762.db2.gz	UZXYBRXWAQEXJW-UWVGGRQHSA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]CCn2cncn2)cc1[N+](=O)[O-]	ZINC000267676005	443537019	/nfs/dbraw/zinc/53/70/19/443537019.db2.gz	OYAVKJGTLGGQIM-UHFFFAOYSA-N	-1	3	345.768	1.127	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC1(C(N)=O)CCCC1	ZINC000265251199	443583568	/nfs/dbraw/zinc/58/35/68/443583568.db2.gz	WGXODGLWGPKBFH-UHFFFAOYSA-N	-1	3	341.389	1.227	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C[C@@H]2CCOC2)cc1[N+](=O)[O-]	ZINC000267713055	443551533	/nfs/dbraw/zinc/55/15/33/443551533.db2.gz	WAZVFMJKADIDAI-VIFPVBQESA-N	-1	3	334.781	1.871	20	5		EDBDHM
CN1C(=O)COc2ccc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)cc21	ZINC000440861972	320084417	/nfs/dbraw/zinc/08/44/17/320084417.db2.gz	NDLSEMBFDLNAOQ-UHFFFAOYSA-N	-1	3	344.283	1.303	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)C(=O)OC(C)C	ZINC000451990385	320240795	/nfs/dbraw/zinc/24/07/95/320240795.db2.gz	QABQOQYFVFCVDK-VIFPVBQESA-N	-1	3	346.361	1.222	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])N1CCC[C@@H](C)C1	ZINC000298498988	443784350	/nfs/dbraw/zinc/78/43/50/443784350.db2.gz	LVQBNMYFUOXTOC-CHWSQXEVSA-N	-1	3	341.433	1.994	20	5		EDBDHM
C[C@@H]1COCC[C@@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000285684089	444072137	/nfs/dbraw/zinc/07/21/37/444072137.db2.gz	RGEYVXJSNFAIPH-NXEZZACHSA-N	-1	3	332.353	1.685	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc[nH]c1=O	ZINC000568741697	321304082	/nfs/dbraw/zinc/30/40/82/321304082.db2.gz	WMYCLCKZWPIDLD-UHFFFAOYSA-N	-1	3	325.302	1.505	20	5		EDBDHM
Cc1cc(N2C[C@H](C)N(CCO)C[C@H]2C)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000571566339	321392738	/nfs/dbraw/zinc/39/27/38/321392738.db2.gz	QTGSWEUTSSSYLR-NWDGAFQWSA-N	-1	3	337.376	1.493	20	5		EDBDHM
CC[C@@H](O)[C@@H](CC)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000313122720	444295634	/nfs/dbraw/zinc/29/56/34/444295634.db2.gz	SVARDGYLLOSJDI-GHMZBOCLSA-N	-1	3	332.378	1.431	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CC[C@@H](OC)C2)c([N+](=O)[O-])c1	ZINC000331014138	444359497	/nfs/dbraw/zinc/35/94/97/444359497.db2.gz	UBQXBSMOXNJMJI-NXEZZACHSA-N	-1	3	330.362	1.449	20	5		EDBDHM
COC(=O)c1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc23)[n-]1	ZINC000343918476	444668482	/nfs/dbraw/zinc/66/84/82/444668482.db2.gz	DJFGRNJCODVTBB-UHFFFAOYSA-N	-1	3	329.272	1.838	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]Cc2ccc(F)cn2)cc1[N+](=O)[O-]	ZINC000342573150	444750199	/nfs/dbraw/zinc/75/01/99/444750199.db2.gz	SPYXIZJQJFWISU-UHFFFAOYSA-N	-1	3	331.350	1.977	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCN2CCC[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000330426628	444976624	/nfs/dbraw/zinc/97/66/24/444976624.db2.gz	SWOPIAKJJZURIR-CYBMUJFWSA-N	-1	3	341.433	1.913	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)c2ncc(C)o2)c([N+](=O)[O-])c1	ZINC000352090122	445486222	/nfs/dbraw/zinc/48/62/22/445486222.db2.gz	VUYWBINSOSXWPW-VIFPVBQESA-N	-1	3	341.345	1.939	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]Cc2nncn2C2CC2)cc1[N+](=O)[O-]	ZINC000352092810	445486839	/nfs/dbraw/zinc/48/68/39/445486839.db2.gz	YNHBWCKIEOTGSJ-UHFFFAOYSA-N	-1	3	343.390	1.370	20	5		EDBDHM
COc1c(C(=O)N2CCC[C@H]2c2nc(=N)n(C)[n-]2)cccc1[N+](=O)[O-]	ZINC000584058021	326192336	/nfs/dbraw/zinc/19/23/36/326192336.db2.gz	FRSGYGXSASYXGO-NSHDSACASA-N	-1	3	346.347	1.122	20	5		EDBDHM
CC[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])CCO1	ZINC000420722817	446772372	/nfs/dbraw/zinc/77/23/72/446772372.db2.gz	JHGOHAXWMXNKGA-MNOVXSKESA-N	-1	3	344.389	1.839	20	5		EDBDHM
O=C(Nc1ccc(N2CCNC2=O)cc1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000444826616	447138089	/nfs/dbraw/zinc/13/80/89/447138089.db2.gz	IEXLMRJQBPHOAD-UHFFFAOYSA-N	-1	3	343.299	1.477	20	5		EDBDHM
COC(=O)[C@@H](CC1CC1)[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000416579879	447653664	/nfs/dbraw/zinc/65/36/64/447653664.db2.gz	IBKUWWDDDHLROS-SECBINFHSA-N	-1	3	348.402	1.585	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)nc1=N	ZINC000575753955	447890689	/nfs/dbraw/zinc/89/06/89/447890689.db2.gz	CMIAFBBUCOJUME-NSHDSACASA-N	-1	3	334.311	1.252	20	5		EDBDHM
NC(=O)c1ccc([N-]C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c(F)c1	ZINC000530633145	447929776	/nfs/dbraw/zinc/92/97/76/447929776.db2.gz	NXRGBIWBYHBKQY-UHFFFAOYSA-N	-1	3	347.258	1.814	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(C)C	ZINC000525189222	447975092	/nfs/dbraw/zinc/97/50/92/447975092.db2.gz	MPULMJKFVWHLDK-NSHDSACASA-N	-1	3	332.378	1.553	20	5		EDBDHM
C[C@H]1CCN(CC[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000525307529	447994767	/nfs/dbraw/zinc/99/47/67/447994767.db2.gz	QGSSTEDASKXYAY-JTQLQIEISA-N	-1	3	347.824	1.868	20	5		EDBDHM
CCc1ccc(C(=O)N2CCC[C@@H]2c2nc(=N)n(C)[n-]2)cc1[N+](=O)[O-]	ZINC000555532737	448082775	/nfs/dbraw/zinc/08/27/75/448082775.db2.gz	ASSULIRCJVEVHU-GFCCVEGCSA-N	-1	3	344.375	1.676	20	5		EDBDHM
COC(=O)c1sc([N-]C(=O)c2c[nH]nc2[N+](=O)[O-])nc1C(C)C	ZINC000573456607	448634161	/nfs/dbraw/zinc/63/41/61/448634161.db2.gz	SYUBUWYBWBQMSY-UHFFFAOYSA-N	-1	3	339.333	1.937	20	5		EDBDHM
CC(C)[C@H](O)C1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CC1	ZINC000593572887	449081391	/nfs/dbraw/zinc/08/13/91/449081391.db2.gz	MZIMKHGMTKSLLY-LBPRGKRZSA-N	-1	3	329.378	1.065	20	5		EDBDHM
COC(=O)CCCCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593525628	449324348	/nfs/dbraw/zinc/32/43/48/449324348.db2.gz	UPIVSSLFCJXJTM-UHFFFAOYSA-N	-1	3	331.350	1.002	20	5		EDBDHM
CC1(C)[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)[C@H]2CCCO[C@@H]21	ZINC000593552557	449343029	/nfs/dbraw/zinc/34/30/29/449343029.db2.gz	LYPJSLYYOIIPGY-RTXFEEFZSA-N	-1	3	341.389	1.472	20	5		EDBDHM
COC1(CS(=O)(=O)[N-]Cc2ccccc2[N+](=O)[O-])CCOCC1	ZINC000593533115	449330330	/nfs/dbraw/zinc/33/03/30/449330330.db2.gz	XDCGMCGMXXBOQK-UHFFFAOYSA-N	-1	3	344.389	1.210	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2OCCc3ccccc32)nc1	ZINC000593544415	449336984	/nfs/dbraw/zinc/33/69/84/449336984.db2.gz	NACZMLDBLQNOAE-CQSZACIVSA-N	-1	3	349.368	1.582	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCCN3CCCC[C@@H]23)nc1	ZINC000594484592	449548426	/nfs/dbraw/zinc/54/84/26/449548426.db2.gz	VHYLLRPHRPWSNT-STQMWFEESA-N	-1	3	340.405	1.285	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]Cc2cocn2)cc1[N+](=O)[O-]	ZINC000614543699	449679742	/nfs/dbraw/zinc/67/97/42/449679742.db2.gz	XJIRZBSOTXVXKO-UHFFFAOYSA-N	-1	3	331.281	1.209	20	5		EDBDHM
COC[C@H](CC[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)OC	ZINC000594795495	449706081	/nfs/dbraw/zinc/70/60/81/449706081.db2.gz	NLCWPHOIEUQKJR-VIFPVBQESA-N	-1	3	338.407	1.295	20	5		EDBDHM
Cn1nc(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c2ccccc21	ZINC000612687377	449835619	/nfs/dbraw/zinc/83/56/19/449835619.db2.gz	HWILYCSCJDALTI-UHFFFAOYSA-N	-1	3	346.368	1.960	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H](O)[C@@H]2CCCO2)c1[N+](=O)[O-]	ZINC000599390690	449937751	/nfs/dbraw/zinc/93/77/51/449937751.db2.gz	DSHUUGQDKLGSOC-NEPJUHHUSA-N	-1	3	344.389	1.030	20	5		EDBDHM
CO[C@@H](C[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F)C1CC1	ZINC000601421624	449939042	/nfs/dbraw/zinc/93/90/42/449939042.db2.gz	ILYHCENFJIIQRY-LBPRGKRZSA-N	-1	3	332.353	1.746	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2COCC2(C)C)c(F)cc1[N+](=O)[O-]	ZINC000601431389	449952392	/nfs/dbraw/zinc/95/23/92/449952392.db2.gz	LVSSEIUMQDJDNQ-GFCCVEGCSA-N	-1	3	332.353	1.746	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC2(N(C)C)CC2)c1[N+](=O)[O-]	ZINC000601449859	449972667	/nfs/dbraw/zinc/97/26/67/449972667.db2.gz	DHGOUUAMAFTFTD-UHFFFAOYSA-N	-1	3	327.406	1.584	20	5		EDBDHM
CC[C@H](CN1CCCC1)[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000610576967	450265704	/nfs/dbraw/zinc/26/57/04/450265704.db2.gz	NUZOUUJVEVKNQC-LLVKDONJSA-N	-1	3	345.396	1.887	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C)C[C@@H]1CCOC1	ZINC000610740006	450317842	/nfs/dbraw/zinc/31/78/42/450317842.db2.gz	ZVGCXKIRKPMGNL-NEPJUHHUSA-N	-1	3	328.390	1.997	20	5		EDBDHM
CC(=O)Nc1cc(F)c(F)cc1[N-]C(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000345404636	534696332	/nfs/dbraw/zinc/69/63/32/534696332.db2.gz	KSDDNIDCVHFTNE-UHFFFAOYSA-N	-1	3	339.258	1.817	20	5		EDBDHM
C[C@@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)c1cccc(-c2nnn[n-]2)c1	ZINC000736158329	578958019	/nfs/dbraw/zinc/95/80/19/578958019.db2.gz	FSYQVKNBBRJSAI-SECBINFHSA-N	-1	3	343.303	1.276	20	5		EDBDHM
C[C@@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)c1cccc(-c2nn[n-]n2)c1	ZINC000736158329	578958020	/nfs/dbraw/zinc/95/80/20/578958020.db2.gz	FSYQVKNBBRJSAI-SECBINFHSA-N	-1	3	343.303	1.276	20	5		EDBDHM
CCc1nc(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cs1	ZINC000736703596	579013650	/nfs/dbraw/zinc/01/36/50/579013650.db2.gz	DBHHUHFWXBYTBV-UHFFFAOYSA-N	-1	3	332.349	1.801	20	5		EDBDHM
CCc1nc(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)cs1	ZINC000736703596	579013651	/nfs/dbraw/zinc/01/36/51/579013651.db2.gz	DBHHUHFWXBYTBV-UHFFFAOYSA-N	-1	3	332.349	1.801	20	5		EDBDHM
O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(-c2nnn[n-]2)cn1	ZINC000737970622	579145502	/nfs/dbraw/zinc/14/55/02/579145502.db2.gz	XRSVYUSLPILLBZ-UHFFFAOYSA-N	-1	3	325.288	1.351	20	5		EDBDHM
O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(-c2nn[n-]n2)cn1	ZINC000737970622	579145503	/nfs/dbraw/zinc/14/55/03/579145503.db2.gz	XRSVYUSLPILLBZ-UHFFFAOYSA-N	-1	3	325.288	1.351	20	5		EDBDHM
O=C(c1ccc(-c2nnn[n-]2)cn1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000738262047	579179309	/nfs/dbraw/zinc/17/93/09/579179309.db2.gz	ZCXCKBFIJOZRPP-UHFFFAOYSA-N	-1	3	337.299	1.373	20	5		EDBDHM
O=C(c1ccc(-c2nn[n-]n2)cn1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000738262047	579179310	/nfs/dbraw/zinc/17/93/10/579179310.db2.gz	ZCXCKBFIJOZRPP-UHFFFAOYSA-N	-1	3	337.299	1.373	20	5		EDBDHM
COCCO[N-]C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-]	ZINC000748768723	579699641	/nfs/dbraw/zinc/69/96/41/579699641.db2.gz	ZXKGZNCENCGJFR-UHFFFAOYSA-N	-1	3	338.238	1.844	20	5		EDBDHM
Cc1ccc([C@@H](O)C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)o1	ZINC000751446035	579807446	/nfs/dbraw/zinc/80/74/46/579807446.db2.gz	KZEYETXAGUKKAM-NSHDSACASA-N	-1	3	344.320	1.647	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)[N-]c2cc(C)no2)n1	ZINC000755590190	579930285	/nfs/dbraw/zinc/93/02/85/579930285.db2.gz	BEHDPRWAFUCRAD-MRVPVSSYSA-N	-1	3	337.292	1.292	20	5		EDBDHM
CNC(=O)C1([N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])CCCC1	ZINC000759020849	579996977	/nfs/dbraw/zinc/99/69/77/579996977.db2.gz	FQAQZIYNILMFHU-UHFFFAOYSA-N	-1	3	341.389	1.073	20	5		EDBDHM
O=C([N-]c1n[nH]c(SCCO)n1)c1cccc(Cl)c1[N+](=O)[O-]	ZINC000764638308	580125399	/nfs/dbraw/zinc/12/53/99/580125399.db2.gz	XZVQSYHMGSZZHE-UHFFFAOYSA-N	-1	3	343.752	1.703	20	5		EDBDHM
Cc1[n-]ncc1S(=O)(=O)Oc1ccc([N+](=O)[O-])c2ncccc12	ZINC000770286730	580257337	/nfs/dbraw/zinc/25/73/37/580257337.db2.gz	LUOBPVHUBRYVGI-UHFFFAOYSA-N	-1	3	334.313	1.942	20	5		EDBDHM
O=C([N-]C[C@H](O)c1ccncc1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000778392323	580464089	/nfs/dbraw/zinc/46/40/89/580464089.db2.gz	KPZJSBZPVRYDPM-ZDUSSCGKSA-N	-1	3	337.282	1.931	20	5		EDBDHM
CSCCCOC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000796275990	580949792	/nfs/dbraw/zinc/94/97/92/580949792.db2.gz	QTBCXXWHPTZNDP-UHFFFAOYSA-N	-1	3	348.402	1.169	20	5		EDBDHM
COCCCOC1CN(Cc2ccc([O-])c(OC)c2[N+](=O)[O-])C1	ZINC000894824687	591431814	/nfs/dbraw/zinc/43/18/14/591431814.db2.gz	JYFYOSHKTWQDJA-UHFFFAOYSA-N	-1	3	326.349	1.546	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2C[C@@H](C)OC2=O)c1C	ZINC000809383427	593335699	/nfs/dbraw/zinc/33/56/99/593335699.db2.gz	XTWQJZPVYZSEQI-PSASIEDQSA-N	-1	3	328.346	1.194	20	5		EDBDHM
COC(=O)CCCO[N-]C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1	ZINC000811560382	593473755	/nfs/dbraw/zinc/47/37/55/593473755.db2.gz	OGJWANQNULNQLE-UHFFFAOYSA-N	-1	3	326.305	1.147	20	5		EDBDHM
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)[N-]C1=NC[C@@H](C)S1	ZINC000819774940	593768429	/nfs/dbraw/zinc/76/84/29/593768429.db2.gz	WBOZPRJMMAPJCL-APPZFPTMSA-N	-1	3	340.409	1.435	20	5		EDBDHM
CN(CCC1CCOCC1)c1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000821599121	593875554	/nfs/dbraw/zinc/87/55/54/593875554.db2.gz	GNJRNYKSMQFZHX-UHFFFAOYSA-N	-1	3	333.352	1.423	20	5		EDBDHM
CN(CCC1CCOCC1)c1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000821599121	593875557	/nfs/dbraw/zinc/87/55/57/593875557.db2.gz	GNJRNYKSMQFZHX-UHFFFAOYSA-N	-1	3	333.352	1.423	20	5		EDBDHM
Cc1[nH]nc(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1[N+](=O)[O-]	ZINC000822009859	593981416	/nfs/dbraw/zinc/98/14/16/593981416.db2.gz	FKUPEMTYQCLTKI-UHFFFAOYSA-N	-1	3	328.292	1.367	20	5		EDBDHM
Cc1[nH]nc(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1[N+](=O)[O-]	ZINC000822009859	593981418	/nfs/dbraw/zinc/98/14/18/593981418.db2.gz	FKUPEMTYQCLTKI-UHFFFAOYSA-N	-1	3	328.292	1.367	20	5		EDBDHM
O=[N+]([O-])c1c(-c2nnn[n-]2)ccnc1N1CCC[C@@H](n2ccnc2)C1	ZINC000823620834	594222189	/nfs/dbraw/zinc/22/21/89/594222189.db2.gz	QSSRJRLEQYISKK-SNVBAGLBSA-N	-1	3	341.335	1.208	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000823630066	594222938	/nfs/dbraw/zinc/22/29/38/594222938.db2.gz	QNJWUGADDWUODX-MLGOLLRUSA-N	-1	3	344.375	1.906	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000823630066	594222939	/nfs/dbraw/zinc/22/29/39/594222939.db2.gz	QNJWUGADDWUODX-MLGOLLRUSA-N	-1	3	344.375	1.906	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NC[C@@H](CO)c1ccccc1	ZINC000823629722	594223010	/nfs/dbraw/zinc/22/30/10/594223010.db2.gz	FVZXRRCSIHOOEH-ZDUSSCGKSA-N	-1	3	340.343	1.963	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NC[C@@H](CO)c1ccccc1	ZINC000823629722	594223011	/nfs/dbraw/zinc/22/30/11/594223011.db2.gz	FVZXRRCSIHOOEH-ZDUSSCGKSA-N	-1	3	340.343	1.963	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCO[C@H](c3ccco3)C2)c(-c2nnn[n-]2)c1	ZINC000823639926	594223793	/nfs/dbraw/zinc/22/37/93/594223793.db2.gz	MDMYJOQNSCTSRL-AWEZNQCLSA-N	-1	3	342.315	1.946	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCO[C@H](c3ccco3)C2)c(-c2nn[n-]n2)c1	ZINC000823639926	594223794	/nfs/dbraw/zinc/22/37/94/594223794.db2.gz	MDMYJOQNSCTSRL-AWEZNQCLSA-N	-1	3	342.315	1.946	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@H]2c3ccccc3C[C@@H]2O)c(-c2nnn[n-]2)c1	ZINC000823640203	594223869	/nfs/dbraw/zinc/22/38/69/594223869.db2.gz	XBWFCRSWPUUYIK-GJZGRUSLSA-N	-1	3	338.327	1.845	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@H]2c3ccccc3C[C@@H]2O)c(-c2nn[n-]n2)c1	ZINC000823640203	594223870	/nfs/dbraw/zinc/22/38/70/594223870.db2.gz	XBWFCRSWPUUYIK-GJZGRUSLSA-N	-1	3	338.327	1.845	20	5		EDBDHM
COc1ccc(CNc2c([N+](=O)[O-])ncn2C)cc1-c1nnn[n-]1	ZINC000826203575	594377045	/nfs/dbraw/zinc/37/70/45/594377045.db2.gz	WHDLRTPEGXKYCY-UHFFFAOYSA-N	-1	3	330.308	1.129	20	5		EDBDHM
COc1ccc(CNc2c([N+](=O)[O-])ncn2C)cc1-c1nn[n-]n1	ZINC000826203575	594377047	/nfs/dbraw/zinc/37/70/47/594377047.db2.gz	WHDLRTPEGXKYCY-UHFFFAOYSA-N	-1	3	330.308	1.129	20	5		EDBDHM
O=C(c1cccc([N+](=O)[O-])c1)N1CCc2ccc(-c3nnn[n-]3)cc21	ZINC000826474520	594491184	/nfs/dbraw/zinc/49/11/84/594491184.db2.gz	TXDAGBSTDAGJMV-UHFFFAOYSA-N	-1	3	336.311	1.978	20	5		EDBDHM
O=C(c1cccc([N+](=O)[O-])c1)N1CCc2ccc(-c3nn[n-]n3)cc21	ZINC000826474520	594491185	/nfs/dbraw/zinc/49/11/85/594491185.db2.gz	TXDAGBSTDAGJMV-UHFFFAOYSA-N	-1	3	336.311	1.978	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H]([C@@H](CO)C2CC2)C2CC2)cs1	ZINC000832232631	594737055	/nfs/dbraw/zinc/73/70/55/594737055.db2.gz	QFUYHGDDTSGHFL-WCQYABFASA-N	-1	3	346.430	1.732	20	5		EDBDHM
CCOc1cc(C(=O)[N-]OC(C)(C)CO)c([N+](=O)[O-])cc1OC	ZINC000836801110	594999130	/nfs/dbraw/zinc/99/91/30/594999130.db2.gz	FQOUKJTYDYYFIM-UHFFFAOYSA-N	-1	3	328.321	1.434	20	5		EDBDHM
CO[C@@]1(C[N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)CCOC1	ZINC000848587113	595410131	/nfs/dbraw/zinc/41/01/31/595410131.db2.gz	CYLBYYKATPZIIT-CYBMUJFWSA-N	-1	3	346.286	1.488	20	5		EDBDHM
Cc1cc(C[N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)n(C)n1	ZINC000848589234	595411205	/nfs/dbraw/zinc/41/12/05/595411205.db2.gz	CQHJCIHCRLSFIL-UHFFFAOYSA-N	-1	3	340.286	1.925	20	5		EDBDHM
C[C@]1(C[N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)CCC(=O)N1	ZINC000848592703	595412418	/nfs/dbraw/zinc/41/24/18/595412418.db2.gz	YAYNNNFGVJGPMG-CYBMUJFWSA-N	-1	3	343.286	1.351	20	5		EDBDHM
C[C@@H]1CCNC(=O)[C@@H]1[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848592408	595412473	/nfs/dbraw/zinc/41/24/73/595412473.db2.gz	ZHXRJJGTQLWULX-LDYMZIIASA-N	-1	3	343.286	1.207	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1COC2(CCC2)C1	ZINC000849449398	595531536	/nfs/dbraw/zinc/53/15/36/595531536.db2.gz	FALVLYOULFAVFY-SNVBAGLBSA-N	-1	3	342.373	1.593	20	5		EDBDHM
COCc1n[nH]c(C[N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)n1	ZINC000855517501	595744073	/nfs/dbraw/zinc/74/40/73/595744073.db2.gz	BEAZHCXRGKPUBX-UHFFFAOYSA-N	-1	3	341.274	1.268	20	5		EDBDHM
O=[N+]([O-])c1ccnn1Cc1nnc(-c2ccc(-c3nnn[n-]3)cc2)o1	ZINC000738369249	599165922	/nfs/dbraw/zinc/16/59/22/599165922.db2.gz	JQMBEMKQODYXNE-UHFFFAOYSA-N	-1	3	339.275	1.070	20	5		EDBDHM
O=[N+]([O-])c1ccnn1Cc1nnc(-c2ccc(-c3nn[n-]n3)cc2)o1	ZINC000738369249	599165924	/nfs/dbraw/zinc/16/59/24/599165924.db2.gz	JQMBEMKQODYXNE-UHFFFAOYSA-N	-1	3	339.275	1.070	20	5		EDBDHM
CC(=O)N1CC[C@@H]([N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000857249655	596197343	/nfs/dbraw/zinc/19/73/43/596197343.db2.gz	JEHGYCKVDHIQAH-SNVBAGLBSA-N	-1	3	343.286	1.303	20	5		EDBDHM
CN1CCOC[C@@H]1C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000863505418	596604391	/nfs/dbraw/zinc/60/43/91/596604391.db2.gz	NFHSLRXHNOMPKC-NSHDSACASA-N	-1	3	345.302	1.013	20	5		EDBDHM
CCN1CCCC[C@@H]1C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000119748362	596734662	/nfs/dbraw/zinc/73/46/62/596734662.db2.gz	BNTDLAXVCVFQJZ-SNVBAGLBSA-N	-1	3	333.435	1.809	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H]1CC(C)(C)CO1	ZINC000872548888	596960359	/nfs/dbraw/zinc/96/03/59/596960359.db2.gz	IBGIFBBFMJPCJH-NSHDSACASA-N	-1	3	328.390	1.997	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCC[C@H]1Cn1cncn1	ZINC000738357167	598337805	/nfs/dbraw/zinc/33/78/05/598337805.db2.gz	DSFUEHOVJGKTQV-NSHDSACASA-N	-1	3	341.335	1.035	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCC[C@H]1Cn1cncn1	ZINC000738357167	598337806	/nfs/dbraw/zinc/33/78/06/598337806.db2.gz	DSFUEHOVJGKTQV-NSHDSACASA-N	-1	3	341.335	1.035	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2ccccc2CO)c(-c2nnn[n-]2)c1	ZINC000738374320	598500192	/nfs/dbraw/zinc/50/01/92/598500192.db2.gz	NWFDXDOKJMYIFW-UHFFFAOYSA-N	-1	3	327.304	1.274	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2ccccc2CO)c(-c2nn[n-]n2)c1	ZINC000738374320	598500193	/nfs/dbraw/zinc/50/01/93/598500193.db2.gz	NWFDXDOKJMYIFW-UHFFFAOYSA-N	-1	3	327.304	1.274	20	5		EDBDHM
CN(C)C(=O)CC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000056087830	214357829	/nfs/dbraw/zinc/35/78/29/214357829.db2.gz	LPGNPYQQALPQPF-UHFFFAOYSA-N	-1	3	335.769	1.005	20	5		EDBDHM
CS[C@@H]1CN(c2nccc(C(=O)[O-])c2[N+](=O)[O-])C[C@@H]1N(C)C	ZINC000563205194	306323448	/nfs/dbraw/zinc/32/34/48/306323448.db2.gz	RUOULYKZPMZJBY-VHSXEESVSA-N	-1	3	326.378	1.170	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]c2cccn(C)c2=O)cc1C	ZINC000076937572	138250376	/nfs/dbraw/zinc/25/03/76/138250376.db2.gz	BXFIZSZTZWMZTQ-UHFFFAOYSA-N	-1	3	337.357	1.711	20	5		EDBDHM
Cn1ccnc1-c1cc(NC(=O)COc2cccc([N+](=O)[O-])c2)n[n-]1	ZINC000119824730	138314699	/nfs/dbraw/zinc/31/46/99/138314699.db2.gz	CEZSREWOPRTAFW-UHFFFAOYSA-N	-1	3	342.315	1.736	20	5		EDBDHM
Cn1ccnc1-c1cc(NC(=O)COc2cccc([N+](=O)[O-])c2)[n-]n1	ZINC000119824730	138314700	/nfs/dbraw/zinc/31/47/00/138314700.db2.gz	CEZSREWOPRTAFW-UHFFFAOYSA-N	-1	3	342.315	1.736	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H](CO)c2ccccc2)cc1[N+](=O)[O-]	ZINC000124239215	138325107	/nfs/dbraw/zinc/32/51/07/138325107.db2.gz	QQMJSVRIHYPHPI-NSHDSACASA-N	-1	3	342.398	1.977	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CC[C@H](CO)CC1	ZINC000270249463	140067210	/nfs/dbraw/zinc/06/72/10/140067210.db2.gz	MBCIUMDQIJLQPG-XYPYZODXSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CCOC(=O)CC[C@H](C)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000270557601	140123206	/nfs/dbraw/zinc/12/32/06/140123206.db2.gz	OSWLZUCSGBIXPC-JTQLQIEISA-N	-1	3	330.362	1.605	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H]1CCO[C@H](C)C1	ZINC000271238171	140261809	/nfs/dbraw/zinc/26/18/09/140261809.db2.gz	CQTFUNNWWPXLJR-VXGBXAGGSA-N	-1	3	328.390	1.997	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CCn2cncn2)c1	ZINC000272476312	140463748	/nfs/dbraw/zinc/46/37/48/140463748.db2.gz	NUSCMTXLIZMOTH-UHFFFAOYSA-N	-1	3	345.768	1.127	20	5		EDBDHM
Cc1ncc(CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c(=O)[n-]1	ZINC000345129635	143054593	/nfs/dbraw/zinc/05/45/93/143054593.db2.gz	QEKFKJHOMANOOI-UHFFFAOYSA-N	-1	3	343.343	1.903	20	5		EDBDHM
O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCc2c(=O)[n-]cnc2C1	ZINC000345198333	143063493	/nfs/dbraw/zinc/06/34/93/143063493.db2.gz	MPCNKUMLFVYWSL-UHFFFAOYSA-N	-1	3	334.719	1.942	20	5		EDBDHM
CCOC(=O)c1sc([N-]C(=O)c2c([N+](=O)[O-])cnn2C)nc1C	ZINC000347261421	143301335	/nfs/dbraw/zinc/30/13/35/143301335.db2.gz	AJVOSPSITVUTSY-UHFFFAOYSA-N	-1	3	339.333	1.522	20	5		EDBDHM
CCN1CCN([C@H](C)CNC(=O)c2cc([O-])ccc2[N+](=O)[O-])CC1	ZINC000352865346	149195822	/nfs/dbraw/zinc/19/58/22/149195822.db2.gz	YVVMKVUYZPENSK-GFCCVEGCSA-N	-1	3	336.392	1.056	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)[C@@H]1CCCOC1	ZINC000355769450	150393663	/nfs/dbraw/zinc/39/36/63/150393663.db2.gz	YWJURZRLAGIDKV-GHMZBOCLSA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)[N-]c2nc(-c3nccn3C)cs2)n1	ZINC000357945360	151206430	/nfs/dbraw/zinc/20/64/30/151206430.db2.gz	OCQLDPNYVNRGER-UHFFFAOYSA-N	-1	3	333.333	1.438	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CCO)C(C)C)c1C	ZINC000122483478	222097241	/nfs/dbraw/zinc/09/72/41/222097241.db2.gz	YOPUBHVXLBUHAK-GFCCVEGCSA-N	-1	3	330.406	1.897	20	5		EDBDHM
COC[C@H](C)C[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	ZINC000275022773	268266960	/nfs/dbraw/zinc/26/69/60/268266960.db2.gz	BECFHUYIDYHJLK-MRVPVSSYSA-N	-1	3	336.341	1.303	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@@H]2CCCCO2)cc1[N+](=O)[O-]	ZINC000275181888	268292246	/nfs/dbraw/zinc/29/22/46/268292246.db2.gz	KSKDFJWAFHNFTE-VIFPVBQESA-N	-1	3	348.352	1.590	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2C[C@@H](O)C2(C)C)c([N+](=O)[O-])c1	ZINC000275356608	268329137	/nfs/dbraw/zinc/32/91/37/268329137.db2.gz	HWUMUYLRVQNAOE-VXGBXAGGSA-N	-1	3	330.362	1.041	20	5		EDBDHM
C[C@@H]([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1ncn(C)n1	ZINC000275636016	268366447	/nfs/dbraw/zinc/36/64/47/268366447.db2.gz	SRLQHTLHMRQSIU-MRVPVSSYSA-N	-1	3	325.275	1.693	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]Cc2cscn2)cc1[N+](=O)[O-]	ZINC000186813105	272947389	/nfs/dbraw/zinc/94/73/89/272947389.db2.gz	ZADLGIKPLOJTGA-UHFFFAOYSA-N	-1	3	347.349	1.678	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCC2(O)CCC2)c1C	ZINC000284723297	274308331	/nfs/dbraw/zinc/30/83/31/274308331.db2.gz	RORRUDAPXLIHHF-UHFFFAOYSA-N	-1	3	328.390	1.795	20	5		EDBDHM
CC(=O)NCCC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000030008654	278102260	/nfs/dbraw/zinc/10/22/60/278102260.db2.gz	GXVIXHCIERABRF-UHFFFAOYSA-N	-1	3	335.769	1.053	20	5		EDBDHM
CCc1nc(C)c(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)o1	ZINC000291918502	289215128	/nfs/dbraw/zinc/21/51/28/289215128.db2.gz	KWQSZROPLUHKSI-UHFFFAOYSA-N	-1	3	325.346	1.932	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCN(C)[C@H](C)C1	ZINC000360653045	302048642	/nfs/dbraw/zinc/04/86/42/302048642.db2.gz	NTMLZHMLVSKLNV-VXGBXAGGSA-N	-1	3	327.406	1.664	20	5		EDBDHM
O=C([N-]Cc1nnc(C2CC2)[nH]1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000295425009	303217151	/nfs/dbraw/zinc/21/71/51/303217151.db2.gz	MHOBLZLDZLVEER-UHFFFAOYSA-N	-1	3	337.286	1.999	20	5		EDBDHM
O=C([N-]Cc1n[nH]c(C2CC2)n1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000295425009	303217152	/nfs/dbraw/zinc/21/71/52/303217152.db2.gz	MHOBLZLDZLVEER-UHFFFAOYSA-N	-1	3	337.286	1.999	20	5		EDBDHM
CCOC(=O)C(C)(C)O[N-]C(=O)CCn1nc(C)c([N+](=O)[O-])c1C	ZINC000295448481	303220773	/nfs/dbraw/zinc/22/07/73/303220773.db2.gz	ARXJDWBSLQLMEV-UHFFFAOYSA-N	-1	3	342.352	1.188	20	5		EDBDHM
COC1(C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])CCCC1	ZINC000296933960	303348258	/nfs/dbraw/zinc/34/82/58/303348258.db2.gz	GHDUQQZVFIKDKL-UHFFFAOYSA-N	-1	3	328.390	1.973	20	5		EDBDHM
CCOC[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC	ZINC000391388726	303850649	/nfs/dbraw/zinc/85/06/49/303850649.db2.gz	WVLQFLMCGAWGFK-VIFPVBQESA-N	-1	3	346.361	1.085	20	5		EDBDHM
COc1ccncc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000431601359	305080419	/nfs/dbraw/zinc/08/04/19/305080419.db2.gz	SGYNXRSQSINVKG-UHFFFAOYSA-N	-1	3	341.320	1.616	20	5		EDBDHM
Nc1cccc([N+](=O)[O-])c1C(=O)NCCNC(=O)c1ccc([O-])cc1	ZINC000436928771	305169945	/nfs/dbraw/zinc/16/99/45/305169945.db2.gz	WZJMPWLVJOBTEE-UHFFFAOYSA-N	-1	3	344.327	1.042	20	5		EDBDHM
CS[C@@H]1CN(c2ncc(C(=O)[O-])cc2[N+](=O)[O-])C[C@@H]1N(C)C	ZINC000519644721	305772246	/nfs/dbraw/zinc/77/22/46/305772246.db2.gz	DIJZXIYINMDPAI-WDEREUQCSA-N	-1	3	326.378	1.170	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1	ZINC000532664432	305988528	/nfs/dbraw/zinc/98/85/28/305988528.db2.gz	NBXBBOAKQUSBGJ-CYBMUJFWSA-N	-1	3	332.360	1.501	20	5		EDBDHM
NC(=O)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000010044224	441109284	/nfs/dbraw/zinc/10/92/84/441109284.db2.gz	OUJWXZKLXTVVDI-ZDUSSCGKSA-N	-1	3	335.341	1.100	20	5		EDBDHM
CC[C@@H](C)N(C)CC[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000104103834	441190375	/nfs/dbraw/zinc/19/03/75/441190375.db2.gz	RFKJICNXCRBTSZ-SNVBAGLBSA-N	-1	3	333.385	1.743	20	5		EDBDHM
COC(=O)[C@@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(C)C	ZINC000060496839	441247293	/nfs/dbraw/zinc/24/72/93/441247293.db2.gz	VLVXPMHPPZKYPT-ZDUSSCGKSA-N	-1	3	344.389	1.688	20	5		EDBDHM
COCCOCCC[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000060497995	441247452	/nfs/dbraw/zinc/24/74/52/441247452.db2.gz	PUAZEBABUIDHPS-UHFFFAOYSA-N	-1	3	346.405	1.543	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCCOCC2CC2)c([N+](=O)[O-])c1	ZINC000023403091	441295531	/nfs/dbraw/zinc/29/55/31/441295531.db2.gz	XGFOOUXDFALCJG-UHFFFAOYSA-N	-1	3	344.389	1.698	20	5		EDBDHM
CNC(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)c1	ZINC000029161632	441448407	/nfs/dbraw/zinc/44/84/07/441448407.db2.gz	HCCSSRVPHUVISE-UHFFFAOYSA-N	-1	3	331.288	1.287	20	5		EDBDHM
COc1ncccc1C[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1C	ZINC000028041375	441423445	/nfs/dbraw/zinc/42/34/45/441423445.db2.gz	QUGLPXKTRRVMDV-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
O=C(CNC(=O)c1ccc([O-])cc1)NCCc1ccccc1[N+](=O)[O-]	ZINC000075158433	441505496	/nfs/dbraw/zinc/50/54/96/441505496.db2.gz	HTBSJXQIAPQGKD-UHFFFAOYSA-N	-1	3	343.339	1.389	20	5		EDBDHM
C[C@@H](Cn1cccn1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000055220489	441631270	/nfs/dbraw/zinc/63/12/70/441631270.db2.gz	RPTCRWJRNKBIPZ-VIFPVBQESA-N	-1	3	328.325	1.297	20	5		EDBDHM
CCC(=O)N1CC[C@@H]([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C1	ZINC000125598508	442033994	/nfs/dbraw/zinc/03/39/94/442033994.db2.gz	SZTVRYDJMSQJPC-SECBINFHSA-N	-1	3	347.418	1.254	20	5		EDBDHM
O=[N+]([O-])c1ccccc1C[N-]S(=O)(=O)c1cnn(CC(F)F)c1	ZINC000186499720	442545860	/nfs/dbraw/zinc/54/58/60/442545860.db2.gz	FXXKWFRHDLOPLZ-UHFFFAOYSA-N	-1	3	346.315	1.535	20	5		EDBDHM
CC[C@H](O)CC[N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl	ZINC000180155717	442549766	/nfs/dbraw/zinc/54/97/66/442549766.db2.gz	IQFYRWWHUNFZDE-VIFPVBQESA-N	-1	3	336.797	1.996	20	5		EDBDHM
CC1(C)[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H]2CCO[C@H]21	ZINC000246688346	442803669	/nfs/dbraw/zinc/80/36/69/442803669.db2.gz	BKKPXZRBSGXRJQ-ZWKOPEQDSA-N	-1	3	344.364	1.826	20	5		EDBDHM
Cc1nn(C)c(C(=O)[N-]c2ncn(Cc3ccccc3)n2)c1[N+](=O)[O-]	ZINC000196766665	443035689	/nfs/dbraw/zinc/03/56/89/443035689.db2.gz	ZNTAORQJVWKQFS-UHFFFAOYSA-N	-1	3	341.331	1.529	20	5		EDBDHM
O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCN(C(=O)c2ccc([O-])cc2)CC1	ZINC000268675134	443072965	/nfs/dbraw/zinc/07/29/65/443072965.db2.gz	VQJWVMBUQNMGAV-UHFFFAOYSA-N	-1	3	344.327	1.227	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)c2ccn(C)n2)cc1C	ZINC000416556649	319444099	/nfs/dbraw/zinc/44/40/99/319444099.db2.gz	GJEOMAHXHMCKGB-NSHDSACASA-N	-1	3	338.389	1.985	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C1CC1	ZINC000269624357	443369142	/nfs/dbraw/zinc/36/91/42/443369142.db2.gz	CEWNIQQHDPYWSA-LLVKDONJSA-N	-1	3	330.362	1.307	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](CO)CC(C)(C)C	ZINC000269727991	443413566	/nfs/dbraw/zinc/41/35/66/443413566.db2.gz	WZMKXIDBTREXLC-SNVBAGLBSA-N	-1	3	346.405	1.679	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2CCC(=O)N[C@@H]2C)c1[N+](=O)[O-]	ZINC000282727780	443417724	/nfs/dbraw/zinc/41/77/24/443417724.db2.gz	ZOZZMMAQZIFOJU-GHMZBOCLSA-N	-1	3	341.389	1.157	20	5		EDBDHM
COc1cc(CNCc2ccc(NC(C)=O)nc2)c([N+](=O)[O-])cc1[O-]	ZINC000278678279	443399580	/nfs/dbraw/zinc/39/95/80/443399580.db2.gz	OVTAPOYHHQMHJF-UHFFFAOYSA-N	-1	3	346.343	1.952	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCN1CCSCC1	ZINC000264892556	443469308	/nfs/dbraw/zinc/46/93/08/443469308.db2.gz	XJYSFEKRUSHGTE-UHFFFAOYSA-N	-1	3	345.446	1.230	20	5		EDBDHM
O=C(Nc1ccc2c(c1)NC(=O)CC2)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000439952258	320055457	/nfs/dbraw/zinc/05/54/57/320055457.db2.gz	SUZZBXGYOXFDOH-UHFFFAOYSA-N	-1	3	328.284	1.832	20	5		EDBDHM
COC(=O)[C@H](C)C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276791207	443828534	/nfs/dbraw/zinc/82/85/34/443828534.db2.gz	JLYFHLCIYRKZNA-SNVBAGLBSA-N	-1	3	330.362	1.299	20	5		EDBDHM
O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1c[n-]nn1	ZINC000298747682	443857060	/nfs/dbraw/zinc/85/70/60/443857060.db2.gz	IMPAOOVNHNRERL-UHFFFAOYSA-N	-1	3	344.253	1.574	20	5		EDBDHM
O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cnn[n-]1	ZINC000298747682	443857064	/nfs/dbraw/zinc/85/70/64/443857064.db2.gz	IMPAOOVNHNRERL-UHFFFAOYSA-N	-1	3	344.253	1.574	20	5		EDBDHM
O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cn[n-]n1	ZINC000298747682	443857066	/nfs/dbraw/zinc/85/70/66/443857066.db2.gz	IMPAOOVNHNRERL-UHFFFAOYSA-N	-1	3	344.253	1.574	20	5		EDBDHM
Cc1nnc(C[N-]S(=O)(=O)CCc2ccccc2[N+](=O)[O-])s1	ZINC000543728052	320788986	/nfs/dbraw/zinc/78/89/86/320788986.db2.gz	FRUPMJRHGNKNAY-UHFFFAOYSA-N	-1	3	342.402	1.417	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1(CF)CCC1	ZINC000563055931	321091058	/nfs/dbraw/zinc/09/10/58/321091058.db2.gz	ZBWZOHGPNQFDRF-UHFFFAOYSA-N	-1	3	346.336	1.552	20	5		EDBDHM
C[C@@H](CN1CCC(C)CC1)[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000574171052	321473181	/nfs/dbraw/zinc/47/31/81/321473181.db2.gz	SMGHAQYZZRVHPX-LBPRGKRZSA-N	-1	3	342.421	1.389	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](CO)C1CCCC1	ZINC000289720971	444194880	/nfs/dbraw/zinc/19/48/80/444194880.db2.gz	ZDKFWYYWUNYBNA-LBPRGKRZSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCC[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000323727640	444345890	/nfs/dbraw/zinc/34/58/90/444345890.db2.gz	MKASSLQJRHQZBQ-MNOVXSKESA-N	-1	3	344.389	1.433	20	5		EDBDHM
COC(=O)c1cc([N-]S(=O)(=O)N2CCC[C@H]2C)cc([N+](=O)[O-])c1	ZINC000331013547	444359469	/nfs/dbraw/zinc/35/94/69/444359469.db2.gz	TVTFEKPGLUHZJF-SECBINFHSA-N	-1	3	343.361	1.522	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCc3c[nH]nc3C2)cc1[N+](=O)[O-]	ZINC000342510785	444723234	/nfs/dbraw/zinc/72/32/34/444723234.db2.gz	NLNAQTJVSIQBFG-SECBINFHSA-N	-1	3	342.402	1.524	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)C[C@H]1CCCO1	ZINC000338724470	444822023	/nfs/dbraw/zinc/82/20/23/444822023.db2.gz	FDHHIOYDVALTDC-ZYHUDNBSSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1cccc(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)n1	ZINC000359771726	445418594	/nfs/dbraw/zinc/41/85/94/445418594.db2.gz	VAUWURMFDRRWMW-UHFFFAOYSA-N	-1	3	339.348	1.958	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)c2ncc(C)o2)c([N+](=O)[O-])c1	ZINC000352090121	445485698	/nfs/dbraw/zinc/48/56/98/445485698.db2.gz	VUYWBINSOSXWPW-SECBINFHSA-N	-1	3	341.345	1.939	20	5		EDBDHM
C[C@H]1C[C@@H]1N1CCN(c2nccc(C(=O)[O-])c2[N+](=O)[O-])C[C@@H](C)C1	ZINC000583324593	326050913	/nfs/dbraw/zinc/05/09/13/326050913.db2.gz	AUHOANCECZIHQO-GVXVVHGQSA-N	-1	3	334.376	1.855	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2C[C@@H]3OCCC[C@@H]23)c([N+](=O)[O-])c1	ZINC000375368487	446754789	/nfs/dbraw/zinc/75/47/89/446754789.db2.gz	SHHOSXWDBWMUQU-LOWVWBTDSA-N	-1	3	342.373	1.449	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1C(=O)[N-]c1nncn1-c1cccnc1	ZINC000377163081	446961789	/nfs/dbraw/zinc/96/17/89/446961789.db2.gz	XRSMCFRDLXGSMH-UHFFFAOYSA-N	-1	3	340.299	1.831	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1cnc(C)o1	ZINC000416553990	447645363	/nfs/dbraw/zinc/64/53/63/447645363.db2.gz	VOKMESFCFUIWLW-UHFFFAOYSA-N	-1	3	327.318	1.378	20	5		EDBDHM
CCC(=O)C[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000416463746	447609753	/nfs/dbraw/zinc/60/97/53/447609753.db2.gz	DOLUJZZLNMVFEY-UHFFFAOYSA-N	-1	3	340.279	1.871	20	5		EDBDHM
Cc1cc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)nn1CC(F)(F)F	ZINC000420190607	447662931	/nfs/dbraw/zinc/66/29/31/447662931.db2.gz	HAZMNIXRDQHBNQ-UHFFFAOYSA-N	-1	3	345.237	2.015	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCNc2ccccn2)c(F)c1	ZINC000472336749	447818926	/nfs/dbraw/zinc/81/89/26/447818926.db2.gz	HZHKKOAQIZDZNS-UHFFFAOYSA-N	-1	3	340.336	1.519	20	5		EDBDHM
O=C(/C=C/c1cncc([O-])c1)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000492522080	448232002	/nfs/dbraw/zinc/23/20/02/448232002.db2.gz	RYDGXELJIUAWIB-LZCJLJQNSA-N	-1	3	328.328	1.937	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)n[n-]1	ZINC000562467364	448255385	/nfs/dbraw/zinc/25/53/85/448255385.db2.gz	KFFUJEZLJPNNSX-UHFFFAOYSA-N	-1	3	348.315	1.821	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)[n-]n1	ZINC000562467364	448255390	/nfs/dbraw/zinc/25/53/90/448255390.db2.gz	KFFUJEZLJPNNSX-UHFFFAOYSA-N	-1	3	348.315	1.821	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC)[C@H](O)C(C)C	ZINC000591332326	448327098	/nfs/dbraw/zinc/32/70/98/448327098.db2.gz	DUJCFUXDIYBLJW-GXFFZTMASA-N	-1	3	346.405	1.677	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1cc(C)ncc1C	ZINC000533467989	448406585	/nfs/dbraw/zinc/40/65/85/448406585.db2.gz	CTYVGHSVCHBARE-UHFFFAOYSA-N	-1	3	337.357	1.838	20	5		EDBDHM
CCn1cc(S(=O)(=O)[N-]c2cc(C)ncc2C)c([N+](=O)[O-])n1	ZINC000533549079	448414370	/nfs/dbraw/zinc/41/43/70/448414370.db2.gz	NVMYMROVYUDDLX-UHFFFAOYSA-N	-1	3	325.350	1.046	20	5		EDBDHM
CC[C@H]1C[C@@H]([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2OC)CCO1	ZINC000591468230	448374139	/nfs/dbraw/zinc/37/41/39/448374139.db2.gz	XEOONSXJHMLAOL-QWRGUYRKSA-N	-1	3	344.389	1.839	20	5		EDBDHM
COCC1(C(=O)[O-])CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000584639149	448587776	/nfs/dbraw/zinc/58/77/76/448587776.db2.gz	XZINYFNRVYVHQS-UHFFFAOYSA-N	-1	3	338.360	1.787	20	5		EDBDHM
CC[C@@H](C)C[C@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000592084247	448669693	/nfs/dbraw/zinc/66/96/93/448669693.db2.gz	VBHMDCSIGAJIQE-GHMZBOCLSA-N	-1	3	346.405	1.679	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1CCS[C@H]1C	ZINC000592117596	448694118	/nfs/dbraw/zinc/69/41/18/448694118.db2.gz	ZBPQITRKTWEAPY-IUCAKERBSA-N	-1	3	332.403	1.776	20	5		EDBDHM
Cc1cc(N2CCN(C[C@@H](C)O)C[C@@H]2C)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000579235718	448749669	/nfs/dbraw/zinc/74/96/69/448749669.db2.gz	DDKRZHWRHQSSLS-NWDGAFQWSA-N	-1	3	337.376	1.493	20	5		EDBDHM
Cc1cc(N2CCN(C[C@H](C)O)[C@H](C)C2)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000574403367	448865616	/nfs/dbraw/zinc/86/56/16/448865616.db2.gz	DIVGEFGNGPNHAL-NEPJUHHUSA-N	-1	3	337.376	1.493	20	5		EDBDHM
CCS(=O)(=O)[N-]Cc1nc(-c2ccc([N+](=O)[O-])cc2C)no1	ZINC000547103873	448859171	/nfs/dbraw/zinc/85/91/71/448859171.db2.gz	KGSYZGYGIIQPPQ-UHFFFAOYSA-N	-1	3	326.334	1.393	20	5		EDBDHM
O=C(NCCCc1cc(=O)[nH][n-]1)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000588875948	448944089	/nfs/dbraw/zinc/94/40/89/448944089.db2.gz	MNDPDHCGSSFLSE-UHFFFAOYSA-N	-1	3	341.327	1.529	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](CO)C1CCCC1	ZINC000589305434	449005242	/nfs/dbraw/zinc/00/52/42/449005242.db2.gz	IYTDEYQGCKOYLT-LLVKDONJSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CC1CCN(C[C@@H](O)CNc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1	ZINC000569344382	449006488	/nfs/dbraw/zinc/00/64/88/449006488.db2.gz	IKWUZUIZLNMYDN-ZDUSSCGKSA-N	-1	3	337.376	1.798	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H](CO)C2CCCCC2)nc1	ZINC000593603676	449102675	/nfs/dbraw/zinc/10/26/75/449102675.db2.gz	VGNPCFDKJJSSJS-GFCCVEGCSA-N	-1	3	343.405	1.457	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H](C)Cn2cncn2)c(F)cc1[N+](=O)[O-]	ZINC000590591977	449207906	/nfs/dbraw/zinc/20/79/06/449207906.db2.gz	WTWINWVWXBJPHU-VIFPVBQESA-N	-1	3	343.340	1.001	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]3OCC[C@@H]32)nc1	ZINC000593563458	449352414	/nfs/dbraw/zinc/35/24/14/449352414.db2.gz	WHKGMFNLFFPXNI-UTUOFQBUSA-N	-1	3	327.362	1.226	20	5		EDBDHM
CC(C)(C)OC(=O)[C@H]1CN(c2cc[n-]c(=O)c2[N+](=O)[O-])CCO1	ZINC000596151734	449386370	/nfs/dbraw/zinc/38/63/70/449386370.db2.gz	JZOMKXKACZWSEB-SNVBAGLBSA-N	-1	3	325.321	1.242	20	5		EDBDHM
C[C@@]1([N-]S(=O)(=O)c2ccc3ncccc3c2[N+](=O)[O-])CCOC1	ZINC000594765793	449678730	/nfs/dbraw/zinc/67/87/30/449678730.db2.gz	QHPAERLIWAJHTP-CQSZACIVSA-N	-1	3	337.357	1.600	20	5		EDBDHM
O=[N+]([O-])c1cccnc1S(=O)(=O)[N-][C@H]1CCCN2CCCC[C@H]12	ZINC000594793625	449703078	/nfs/dbraw/zinc/70/30/78/449703078.db2.gz	FRZJMFMJSIFUHD-NWDGAFQWSA-N	-1	3	340.405	1.285	20	5		EDBDHM
C[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)c2ncnn21	ZINC000594805220	449717326	/nfs/dbraw/zinc/71/73/26/449717326.db2.gz	BEATXEPPLYSASF-RQJHMYQMSA-N	-1	3	329.363	1.232	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-]CC1=CCOCC1	ZINC000594776781	449689775	/nfs/dbraw/zinc/68/97/75/449689775.db2.gz	GMRLIQWOQBMWDE-UHFFFAOYSA-N	-1	3	349.368	1.768	20	5		EDBDHM
CCN1CCC([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)CC1	ZINC000601304340	449814419	/nfs/dbraw/zinc/81/44/19/449814419.db2.gz	NOSHKZKWWMVCQW-UHFFFAOYSA-N	-1	3	345.396	1.805	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2CC23CCOCC3)c(F)cc1[N+](=O)[O-]	ZINC000601428786	449949099	/nfs/dbraw/zinc/94/90/99/449949099.db2.gz	CYXSCXRHNQMZPU-CYBMUJFWSA-N	-1	3	344.364	1.890	20	5		EDBDHM
COCC1(C[N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)CC1	ZINC000601460404	449983974	/nfs/dbraw/zinc/98/39/74/449983974.db2.gz	UHBRQPMLQIEPBF-UHFFFAOYSA-N	-1	3	332.353	1.747	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1[C@H](C)O[C@@H](C)[C@H]1C	ZINC000599459994	449993585	/nfs/dbraw/zinc/99/35/85/449993585.db2.gz	PDFACLCMONMMSM-YCWTYVPXSA-N	-1	3	344.389	1.694	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2CCN2C2CCCC2)s1	ZINC000599464154	449995454	/nfs/dbraw/zinc/99/54/54/449995454.db2.gz	JKAQUVVAYABVSD-LLVKDONJSA-N	-1	3	345.446	1.952	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CO[C@@H](C2CC2)C1	ZINC000599483207	450010940	/nfs/dbraw/zinc/01/09/40/450010940.db2.gz	SRGQPPNYRQHMEH-ZYHUDNBSSA-N	-1	3	342.373	1.449	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CO[C@H](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000599486164	450014816	/nfs/dbraw/zinc/01/48/16/450014816.db2.gz	ZQKOFYJPGAEZLK-GWCFXTLKSA-N	-1	3	342.373	1.449	20	5		EDBDHM
COC(=O)[C@@](C)([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C1CC1	ZINC000609899968	450114368	/nfs/dbraw/zinc/11/43/68/450114368.db2.gz	YKROAJBLWYNJQZ-AWEZNQCLSA-N	-1	3	342.373	1.523	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]CCOCCF	ZINC000595411265	450123564	/nfs/dbraw/zinc/12/35/64/450123564.db2.gz	ZGIFKXMISASTSK-UHFFFAOYSA-N	-1	3	326.733	1.513	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C)C[C@H]1CCOC1	ZINC000610740007	450317686	/nfs/dbraw/zinc/31/76/86/450317686.db2.gz	ZVGCXKIRKPMGNL-NWDGAFQWSA-N	-1	3	328.390	1.997	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1CCOC[C@@H]1C	ZINC000619499846	450493320	/nfs/dbraw/zinc/49/33/20/450493320.db2.gz	ZIGFLJSEBFEADM-VHSXEESVSA-N	-1	3	330.362	1.307	20	5		EDBDHM
COc1cc(C(=O)[N-]c2ccnnc2OC)c([N+](=O)[O-])cc1OC	ZINC000346483157	536536051	/nfs/dbraw/zinc/53/60/51/536536051.db2.gz	WMZMPUMORDYPBI-UHFFFAOYSA-N	-1	3	334.288	1.663	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)[C@@H]1CCCO1	ZINC000339450321	535807357	/nfs/dbraw/zinc/80/73/57/535807357.db2.gz	ACVIFQBWLRJWHZ-NEPJUHHUSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CCc1nccn1[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])c[n-]c2=O)C1	ZINC000264273563	536171563	/nfs/dbraw/zinc/17/15/63/536171563.db2.gz	BKVLKQHYETVRBO-LLVKDONJSA-N	-1	3	345.359	1.932	20	5		EDBDHM
O=[N+]([O-])c1ccc([O-])c(CN[C@H]2CCCc3c2cnn3CCO)c1	ZINC000725846717	578288670	/nfs/dbraw/zinc/28/86/70/578288670.db2.gz	REJMLOIZBQUQIX-AWEZNQCLSA-N	-1	3	332.360	1.656	20	5		EDBDHM
O=C(CNC(=O)c1ccc([O-])cc1)OCc1csc([N+](=O)[O-])c1	ZINC000727540138	578532299	/nfs/dbraw/zinc/53/22/99/578532299.db2.gz	YHVXQBHBCLDLBB-UHFFFAOYSA-N	-1	3	336.325	1.835	20	5		EDBDHM
O=C(NC1CC1)[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000738022826	578617560	/nfs/dbraw/zinc/61/75/60/578617560.db2.gz	TUFMSJAKRBSLKW-ZDUSSCGKSA-N	-1	3	343.347	1.022	20	5		EDBDHM
O=C(NC1CC1)[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000738022826	578617562	/nfs/dbraw/zinc/61/75/62/578617562.db2.gz	TUFMSJAKRBSLKW-ZDUSSCGKSA-N	-1	3	343.347	1.022	20	5		EDBDHM
CCCCS(=O)(=O)[N-]CC(=O)OCc1csc([N+](=O)[O-])c1	ZINC000760692768	580036568	/nfs/dbraw/zinc/03/65/68/580036568.db2.gz	YTLCYUACAVCGSO-UHFFFAOYSA-N	-1	3	336.391	1.419	20	5		EDBDHM
C[C@@H](CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)Cn1ccnc1	ZINC000736026689	578947736	/nfs/dbraw/zinc/94/77/36/578947736.db2.gz	PXJZTFZDVPMFFZ-JTQLQIEISA-N	-1	3	328.336	1.720	20	5		EDBDHM
C[C@@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)Cn1ccnc1	ZINC000736026689	578947737	/nfs/dbraw/zinc/94/77/37/578947737.db2.gz	PXJZTFZDVPMFFZ-JTQLQIEISA-N	-1	3	328.336	1.720	20	5		EDBDHM
C[C@H]([C@H](C)Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)N1CCOCC1	ZINC000736139726	578956408	/nfs/dbraw/zinc/95/64/08/578956408.db2.gz	QTKOQTQGUPDQLS-WDEREUQCSA-N	-1	3	347.379	1.296	20	5		EDBDHM
C[C@H]([C@H](C)Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)N1CCOCC1	ZINC000736139726	578956409	/nfs/dbraw/zinc/95/64/09/578956409.db2.gz	QTKOQTQGUPDQLS-WDEREUQCSA-N	-1	3	347.379	1.296	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1sccc1-c1nnn[n-]1	ZINC000737498699	579098836	/nfs/dbraw/zinc/09/88/36/579098836.db2.gz	KQEHSCJRTPSXGV-UHFFFAOYSA-N	-1	3	349.332	1.198	20	5		EDBDHM
Nc1nc(Oc2ccc(-c3nnn[n-]3)cc2Cl)ncc1[N+](=O)[O-]	ZINC000737775737	579128873	/nfs/dbraw/zinc/12/88/73/579128873.db2.gz	BFDUSDLWOXBGMA-UHFFFAOYSA-N	-1	3	334.683	1.593	20	5		EDBDHM
Nc1nc(Oc2ccc(-c3nn[n-]n3)cc2Cl)ncc1[N+](=O)[O-]	ZINC000737775737	579128874	/nfs/dbraw/zinc/12/88/74/579128874.db2.gz	BFDUSDLWOXBGMA-UHFFFAOYSA-N	-1	3	334.683	1.593	20	5		EDBDHM
O=C(C=Cc1ccc([N+](=O)[O-])cc1)Nc1ccncc1-c1nnn[n-]1	ZINC000737801747	579130351	/nfs/dbraw/zinc/13/03/51/579130351.db2.gz	TZXJHFKSZVSEAI-UTCJRWHESA-N	-1	3	337.299	1.244	20	5		EDBDHM
O=C(C=Cc1ccc([N+](=O)[O-])cc1)Nc1ccncc1-c1nn[n-]n1	ZINC000737801747	579130352	/nfs/dbraw/zinc/13/03/52/579130352.db2.gz	TZXJHFKSZVSEAI-UTCJRWHESA-N	-1	3	337.299	1.244	20	5		EDBDHM
O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccc(-c2nnn[n-]2)cn1	ZINC000738087311	579158387	/nfs/dbraw/zinc/15/83/87/579158387.db2.gz	BXMPKUORCAGAEV-UHFFFAOYSA-N	-1	3	339.315	1.142	20	5		EDBDHM
O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccc(-c2nn[n-]n2)cn1	ZINC000738087311	579158388	/nfs/dbraw/zinc/15/83/88/579158388.db2.gz	BXMPKUORCAGAEV-UHFFFAOYSA-N	-1	3	339.315	1.142	20	5		EDBDHM
O=C(CC[C@H]1NC(=O)[N-]C1=O)OCc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000746066788	579571244	/nfs/dbraw/zinc/57/12/44/579571244.db2.gz	IIZOINJJAWIZNG-SECBINFHSA-N	-1	3	341.707	1.280	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H]2CCCN(C)C2)c1	ZINC000779878822	580500726	/nfs/dbraw/zinc/50/07/26/580500726.db2.gz	DYLFWPITHLTXOG-JTQLQIEISA-N	-1	3	347.824	1.929	20	5		EDBDHM
CCOC(=O)[C@H](C)[N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1	ZINC000779879857	580500767	/nfs/dbraw/zinc/50/07/67/580500767.db2.gz	QANOQCWMWKNKSG-JTQLQIEISA-N	-1	3	330.362	1.008	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2CCC=CO2)c([N+](=O)[O-])c1	ZINC000780903323	580537196	/nfs/dbraw/zinc/53/71/96/580537196.db2.gz	WHXZCFQHHIRUNA-NSHDSACASA-N	-1	3	328.346	1.574	20	5		EDBDHM
Cc1cc(OCC(=O)OCc2cc(=O)c([O-])co2)ccc1[N+](=O)[O-]	ZINC000797495888	580976594	/nfs/dbraw/zinc/97/65/94/580976594.db2.gz	SYCQLNZLEIDKRL-UHFFFAOYSA-N	-1	3	335.268	1.684	20	5		EDBDHM
O=C([N-]C1=NCCS1)c1cc([N+](=O)[O-])ncc1Br	ZINC000798157333	580989009	/nfs/dbraw/zinc/98/90/09/580989009.db2.gz	ZVAJTORHIPSCML-UHFFFAOYSA-N	-1	3	331.151	1.585	20	5		EDBDHM
CC1(C)CCN(CC[N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1	ZINC000908086718	592295048	/nfs/dbraw/zinc/29/50/48/592295048.db2.gz	XOAHBHVDXBRXTP-UHFFFAOYSA-N	-1	3	345.396	1.744	20	5		EDBDHM
CCN1CC[C@H]2OCCN(c3ccc([N+](=O)[O-])c(C(=O)[O-])c3)[C@H]2C1	ZINC000910385447	592856471	/nfs/dbraw/zinc/85/64/71/592856471.db2.gz	ZYFFEFGIVWVADL-LSDHHAIUSA-N	-1	3	335.360	1.592	20	5		EDBDHM
O=C(Nc1ccc(N2CCOCC2)cc1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000028813014	593067026	/nfs/dbraw/zinc/06/70/26/593067026.db2.gz	SOBFBYYCDFSTSN-UHFFFAOYSA-N	-1	3	344.327	1.372	20	5		EDBDHM
O=c1[n-]c(C2CCN(C[C@H](O)c3ccc([N+](=O)[O-])cc3)CC2)n[nH]1	ZINC000808755029	593286185	/nfs/dbraw/zinc/28/61/85/593286185.db2.gz	AZDZIJOKRUFABJ-ZDUSSCGKSA-N	-1	3	333.348	1.332	20	5		EDBDHM
CCc1nncn1CCNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000821554865	593863067	/nfs/dbraw/zinc/86/30/67/593863067.db2.gz	UPFRUCGQKOMLEV-UHFFFAOYSA-N	-1	3	329.324	1.041	20	5		EDBDHM
CCc1nncn1CCNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000821554865	593863070	/nfs/dbraw/zinc/86/30/70/593863070.db2.gz	UPFRUCGQKOMLEV-UHFFFAOYSA-N	-1	3	329.324	1.041	20	5		EDBDHM
CN(CCc1ccccn1)c1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000821607326	593879400	/nfs/dbraw/zinc/87/94/00/593879400.db2.gz	KBLHDVITOVFNQG-UHFFFAOYSA-N	-1	3	326.320	1.244	20	5		EDBDHM
CN(CCc1ccccn1)c1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000821607326	593879404	/nfs/dbraw/zinc/87/94/04/593879404.db2.gz	KBLHDVITOVFNQG-UHFFFAOYSA-N	-1	3	326.320	1.244	20	5		EDBDHM
COC(=O)C[C@H]1CCCN1c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000821658582	593901032	/nfs/dbraw/zinc/90/10/32/593901032.db2.gz	BDCYQMZIOQMHQE-SNVBAGLBSA-N	-1	3	332.320	1.307	20	5		EDBDHM
COC(=O)C[C@H]1CCCN1c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000821658582	593901033	/nfs/dbraw/zinc/90/10/33/593901033.db2.gz	BDCYQMZIOQMHQE-SNVBAGLBSA-N	-1	3	332.320	1.307	20	5		EDBDHM
COc1ccc(-c2nnn[n-]2)cc1Cn1nc(C)c([N+](=O)[O-])c1C	ZINC000821752644	593929592	/nfs/dbraw/zinc/92/95/92/593929592.db2.gz	OZMMZCHGGXVBQT-UHFFFAOYSA-N	-1	3	329.320	1.645	20	5		EDBDHM
COc1ccc(-c2nn[n-]n2)cc1Cn1nc(C)c([N+](=O)[O-])c1C	ZINC000821752644	593929593	/nfs/dbraw/zinc/92/95/93/593929593.db2.gz	OZMMZCHGGXVBQT-UHFFFAOYSA-N	-1	3	329.320	1.645	20	5		EDBDHM
C[C@H](CN(C)c1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)c1nccs1	ZINC000824413618	594005822	/nfs/dbraw/zinc/00/58/22/594005822.db2.gz	NSFPNAAUWVFCCK-MRVPVSSYSA-N	-1	3	346.376	1.866	20	5		EDBDHM
C[C@H](CN(C)c1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)c1nccs1	ZINC000824413618	594005824	/nfs/dbraw/zinc/00/58/24/594005824.db2.gz	NSFPNAAUWVFCCK-MRVPVSSYSA-N	-1	3	346.376	1.866	20	5		EDBDHM
C[C@@H](NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cccc([N+](=O)[O-])c1	ZINC000824513760	594028513	/nfs/dbraw/zinc/02/85/13/594028513.db2.gz	HXAZYQLDOHQMFA-MRVPVSSYSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@@H](NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cccc([N+](=O)[O-])c1	ZINC000824513760	594028515	/nfs/dbraw/zinc/02/85/15/594028515.db2.gz	HXAZYQLDOHQMFA-MRVPVSSYSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@H]1C[C@@H](CCNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CCO1	ZINC000824883539	594090111	/nfs/dbraw/zinc/09/01/11/594090111.db2.gz	HZQOYTYJRNPMJH-UWVGGRQHSA-N	-1	3	333.352	1.787	20	5		EDBDHM
C[C@H]1C[C@@H](CCNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CCO1	ZINC000824883539	594090112	/nfs/dbraw/zinc/09/01/12/594090112.db2.gz	HZQOYTYJRNPMJH-UWVGGRQHSA-N	-1	3	333.352	1.787	20	5		EDBDHM
CCO[C@H](C)C(=O)Nc1cc(-c2nnn[n-]2)cc([N+](=O)[O-])c1Cl	ZINC000825576682	594202725	/nfs/dbraw/zinc/20/27/25/594202725.db2.gz	NLFLPCJCYLTUKN-ZCFIWIBFSA-N	-1	3	340.727	1.792	20	5		EDBDHM
CCO[C@H](C)C(=O)Nc1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl	ZINC000825576682	594202727	/nfs/dbraw/zinc/20/27/27/594202727.db2.gz	NLFLPCJCYLTUKN-ZCFIWIBFSA-N	-1	3	340.727	1.792	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@@H]2c3ccccc3C[C@H]2O)c(-c2nnn[n-]2)c1	ZINC000823640204	594223991	/nfs/dbraw/zinc/22/39/91/594223991.db2.gz	XBWFCRSWPUUYIK-HUUCEWRRSA-N	-1	3	338.327	1.845	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@@H]2c3ccccc3C[C@H]2O)c(-c2nn[n-]n2)c1	ZINC000823640204	594223992	/nfs/dbraw/zinc/22/39/92/594223992.db2.gz	XBWFCRSWPUUYIK-HUUCEWRRSA-N	-1	3	338.327	1.845	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCc2ccc(Cl)nc2)c(-c2nnn[n-]2)c1	ZINC000823651922	594224904	/nfs/dbraw/zinc/22/49/04/594224904.db2.gz	RQGZULVCKALLBA-UHFFFAOYSA-N	-1	3	346.738	1.873	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCc2ccc(Cl)nc2)c(-c2nn[n-]n2)c1	ZINC000823651922	594224905	/nfs/dbraw/zinc/22/49/05/594224905.db2.gz	RQGZULVCKALLBA-UHFFFAOYSA-N	-1	3	346.738	1.873	20	5		EDBDHM
CCc1nn(C)c(NCc2ccc(-c3nnn[n-]3)cc2F)c1[N+](=O)[O-]	ZINC000825759682	594239655	/nfs/dbraw/zinc/23/96/55/594239655.db2.gz	NKXHGRIQEBRGOY-UHFFFAOYSA-N	-1	3	346.326	1.822	20	5		EDBDHM
CCc1nn(C)c(NCc2ccc(-c3nn[n-]n3)cc2F)c1[N+](=O)[O-]	ZINC000825759682	594239656	/nfs/dbraw/zinc/23/96/56/594239656.db2.gz	NKXHGRIQEBRGOY-UHFFFAOYSA-N	-1	3	346.326	1.822	20	5		EDBDHM
CCN1C[C@@H](C)[C@@H](Nc2c(C(=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000829752861	594255060	/nfs/dbraw/zinc/25/50/60/594255060.db2.gz	LLFDTLWHZILGLV-KCJUWKMLSA-N	-1	3	338.320	1.953	20	5		EDBDHM
Cn1cc(-c2nnn[n-]2)cc1C(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000826357434	594442217	/nfs/dbraw/zinc/44/22/17/594442217.db2.gz	GBGHGTOVHNPTLV-UHFFFAOYSA-N	-1	3	341.331	1.086	20	5		EDBDHM
Cn1cc(-c2nn[n-]n2)cc1C(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000826357434	594442218	/nfs/dbraw/zinc/44/22/18/594442218.db2.gz	GBGHGTOVHNPTLV-UHFFFAOYSA-N	-1	3	341.331	1.086	20	5		EDBDHM
Cn1cnnc1[C@H]1CCCN1c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000826365852	594447135	/nfs/dbraw/zinc/44/71/35/594447135.db2.gz	GREFSYIFFIEXMV-GFCCVEGCSA-N	-1	3	341.335	1.245	20	5		EDBDHM
Cn1cnnc1[C@H]1CCCN1c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000826365852	594447136	/nfs/dbraw/zinc/44/71/36/594447136.db2.gz	GREFSYIFFIEXMV-GFCCVEGCSA-N	-1	3	341.335	1.245	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N[C@@H]1CCO[C@@]2(CCOC2)C1	ZINC000826497866	594502836	/nfs/dbraw/zinc/50/28/36/594502836.db2.gz	XEEOELCNTXANGW-ABAIWWIYSA-N	-1	3	346.347	1.525	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N[C@@H]1CCO[C@@]2(CCOC2)C1	ZINC000826497866	594502838	/nfs/dbraw/zinc/50/28/38/594502838.db2.gz	XEEOELCNTXANGW-ABAIWWIYSA-N	-1	3	346.347	1.525	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl)C(=O)NC	ZINC000832745995	594773628	/nfs/dbraw/zinc/77/36/28/594773628.db2.gz	PGBGODQMCMODCU-SECBINFHSA-N	-1	3	349.796	1.360	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2C(=O)OCC2(C)C)cc1C	ZINC000841536047	594917734	/nfs/dbraw/zinc/91/77/34/594917734.db2.gz	XRKTWELIPSVIGD-GFCCVEGCSA-N	-1	3	342.373	1.442	20	5		EDBDHM
COc1ccc(CN2C[C@H]3COCC[C@]3(C(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000846281578	595196240	/nfs/dbraw/zinc/19/62/40/595196240.db2.gz	FPOFNCBGNQSNQZ-LRDDRELGSA-N	-1	3	336.344	1.527	20	5		EDBDHM
COCCN1CCC[C@@H](Nc2ccc(CC(=O)[O-])cc2[N+](=O)[O-])C1	ZINC000844208885	595302685	/nfs/dbraw/zinc/30/26/85/595302685.db2.gz	QDVWRMMVBPCUKK-CYBMUJFWSA-N	-1	3	337.376	1.745	20	5		EDBDHM
CCNC(=O)[C@H](C)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848580497	595408129	/nfs/dbraw/zinc/40/81/29/595408129.db2.gz	WBAOSCXOWUJKIT-QMMMGPOBSA-N	-1	3	331.275	1.207	20	5		EDBDHM
CC(C)NC(=O)C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848580456	595408201	/nfs/dbraw/zinc/40/82/01/595408201.db2.gz	UHBUTEDUTJALFJ-UHFFFAOYSA-N	-1	3	331.275	1.207	20	5		EDBDHM
O=C([N-][C@H]1CC[C@H](O)CC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848585842	595410162	/nfs/dbraw/zinc/41/01/62/595410162.db2.gz	PFKNXXCQOWZWTF-HOMQSWHASA-N	-1	3	330.287	1.986	20	5		EDBDHM
O=C([N-]C[C@]1(O)CCSC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848588152	595410584	/nfs/dbraw/zinc/41/05/84/595410584.db2.gz	OZZCDEAHXMJCGG-GFCCVEGCSA-N	-1	3	348.327	1.551	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C[C@H]2C[C@@H](O)C2)c1	ZINC000859363502	596067589	/nfs/dbraw/zinc/06/75/89/596067589.db2.gz	MZSGBEZHOZECQI-DTORHVGOSA-N	-1	3	334.781	1.606	20	5		EDBDHM
O=[N+]([O-])c1ccc(-c2noc(-c3ccc(-c4nnn[n-]4)cn3)n2)cc1	ZINC000738359036	598609330	/nfs/dbraw/zinc/60/93/30/598609330.db2.gz	IQESWEINIOHNJQ-UHFFFAOYSA-N	-1	3	336.271	1.887	20	5		EDBDHM
O=[N+]([O-])c1ccc(-c2noc(-c3ccc(-c4nn[n-]n4)cn3)n2)cc1	ZINC000738359036	598609331	/nfs/dbraw/zinc/60/93/31/598609331.db2.gz	IQESWEINIOHNJQ-UHFFFAOYSA-N	-1	3	336.271	1.887	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1Nc1ccc(OCCO)cc1	ZINC000738358024	598679065	/nfs/dbraw/zinc/67/90/65/598679065.db2.gz	JYVUMRPIOFRQJD-UHFFFAOYSA-N	-1	3	342.315	1.890	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1Nc1ccc(OCCO)cc1	ZINC000738358024	598679067	/nfs/dbraw/zinc/67/90/67/598679067.db2.gz	JYVUMRPIOFRQJD-UHFFFAOYSA-N	-1	3	342.315	1.890	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N[C@@H](CO)c1ccccc1	ZINC000738358686	606725406	/nfs/dbraw/zinc/72/54/06/606725406.db2.gz	OCCGXSDXGPTPQS-ZDUSSCGKSA-N	-1	3	326.316	1.920	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N[C@@H](CO)c1ccccc1	ZINC000738358686	606725407	/nfs/dbraw/zinc/72/54/07/606725407.db2.gz	OCCGXSDXGPTPQS-ZDUSSCGKSA-N	-1	3	326.316	1.920	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1COc2ccccc2C1	ZINC000045814838	213758989	/nfs/dbraw/zinc/75/89/89/213758989.db2.gz	RQNOKWQBOQIREG-LBPRGKRZSA-N	-1	3	334.353	1.877	20	5		EDBDHM
O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(-c2nnn[n-]2)cc1	ZINC000123593687	138319553	/nfs/dbraw/zinc/31/95/53/138319553.db2.gz	KMXNSMYUKFMEOW-UHFFFAOYSA-N	-1	3	340.299	1.792	20	5		EDBDHM
O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(-c2nn[n-]n2)cc1	ZINC000123593687	138319554	/nfs/dbraw/zinc/31/95/54/138319554.db2.gz	KMXNSMYUKFMEOW-UHFFFAOYSA-N	-1	3	340.299	1.792	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCN2CCCC2=O)c1[N+](=O)[O-]	ZINC000568640132	306486055	/nfs/dbraw/zinc/48/60/55/306486055.db2.gz	VMKBGNKYQBLMCK-UHFFFAOYSA-N	-1	3	341.389	1.112	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]CCN1CCCC1	ZINC000012141387	211303482	/nfs/dbraw/zinc/30/34/82/211303482.db2.gz	MUINRALYKONYEL-UHFFFAOYSA-N	-1	3	333.797	1.622	20	5		EDBDHM
O=C(C=Cc1ccccc1[N+](=O)[O-])N1CCc2c(=O)[n-]cnc2C1	ZINC000493332877	255204619	/nfs/dbraw/zinc/20/46/19/255204619.db2.gz	HCQAQSLPFUWQRE-AATRIKPKSA-N	-1	3	326.312	1.689	20	5		EDBDHM
COCC[C@@H](C)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000263983932	139373906	/nfs/dbraw/zinc/37/39/06/139373906.db2.gz	HEQOXTFXKGNEHV-SECBINFHSA-N	-1	3	346.361	1.069	20	5		EDBDHM
CNc1ccc(C(=O)N2CCC[C@H]2c2nc(=N)n(C)[n-]2)cc1[N+](=O)[O-]	ZINC000571171629	306559577	/nfs/dbraw/zinc/55/95/77/306559577.db2.gz	QUEGBVUPBVCXRO-NSHDSACASA-N	-1	3	345.363	1.155	20	5		EDBDHM
CC[C@](C)([N-]S(=O)(=O)CCc1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000271133890	140243283	/nfs/dbraw/zinc/24/32/83/140243283.db2.gz	SXXCAAVQPLIURF-AWEZNQCLSA-N	-1	3	344.389	1.398	20	5		EDBDHM
Cc1cc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)[n-]c(=O)n1	ZINC000346313699	143190746	/nfs/dbraw/zinc/19/07/46/143190746.db2.gz	JJRZPJIZQGFKFQ-SNVBAGLBSA-N	-1	3	344.331	1.120	20	5		EDBDHM
O=C(NCc1ncccc1[O-])C(=O)Nc1cc(F)cc([N+](=O)[O-])c1	ZINC000351873322	143616720	/nfs/dbraw/zinc/61/67/20/143616720.db2.gz	BDDLOBZMCQHBDH-UHFFFAOYSA-N	-1	3	334.263	1.089	20	5		EDBDHM
O=C(c1ccc(O)cc1[O-])N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000369684492	155135214	/nfs/dbraw/zinc/13/52/14/155135214.db2.gz	ZBKLNFXNAQCANY-UHFFFAOYSA-N	-1	3	332.316	1.680	20	5		EDBDHM
CCn1ncnc1C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000360365793	152008023	/nfs/dbraw/zinc/00/80/23/152008023.db2.gz	XZNLQILIBQGQCR-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
CN1CCC[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1=O	ZINC000360451280	152049472	/nfs/dbraw/zinc/04/94/72/152049472.db2.gz	DJFIMJDDXMYBFA-SNVBAGLBSA-N	-1	3	347.780	1.147	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CC(S(=O)(=O)[N-]c3ccccc3)C2)nc1	ZINC000374720795	157377276	/nfs/dbraw/zinc/37/72/76/157377276.db2.gz	SURFQADLUZHNGC-UHFFFAOYSA-N	-1	3	334.357	1.620	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCO[C@@H]2C2CC2)c(F)c1	ZINC000378324094	158141526	/nfs/dbraw/zinc/14/15/26/158141526.db2.gz	RHQIUIIZJXNULS-WCQYABFASA-N	-1	3	330.337	1.580	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@@H](O)C(C)C)cc1C	ZINC000122029729	287376901	/nfs/dbraw/zinc/37/69/01/287376901.db2.gz	ADKBMYQXGLFCRZ-CYBMUJFWSA-N	-1	3	330.406	1.897	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1CCO[C@@H](C2CC2)C1	ZINC000162658711	225847239	/nfs/dbraw/zinc/84/72/39/225847239.db2.gz	WPLBAOIUYACVIH-DGCLKSJQSA-N	-1	3	326.374	1.831	20	5		EDBDHM
O=[N+]([O-])c1cccc(CNCC[N-]S(=O)(=O)c2cccs2)c1	ZINC000122266172	222049195	/nfs/dbraw/zinc/04/91/95/222049195.db2.gz	QKFCJTVWTQEDKU-UHFFFAOYSA-N	-1	3	341.414	1.724	20	5		EDBDHM
C[C@@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000123664584	222314053	/nfs/dbraw/zinc/31/40/53/222314053.db2.gz	RAKWNTQGZPLLSV-ZCFIWIBFSA-N	-1	3	328.268	1.273	20	5		EDBDHM
CCC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(=O)OC)CC1	ZINC000273527608	268058738	/nfs/dbraw/zinc/05/87/38/268058738.db2.gz	KDQOIHBCGCQISJ-UHFFFAOYSA-N	-1	3	342.373	1.850	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]C(C)(C)C(C)(C)O)cc1[N+](=O)[O-]	ZINC000274821350	268214352	/nfs/dbraw/zinc/21/43/52/268214352.db2.gz	WLXYMQVXHRDHAR-UHFFFAOYSA-N	-1	3	334.369	1.870	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCC[C@@H]2CCO)c([N+](=O)[O-])c1	ZINC000275029334	268268259	/nfs/dbraw/zinc/26/82/59/268268259.db2.gz	ADVMSGSSVWHGIL-PWSUYJOCSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC[C@@H](C)OC	ZINC000276284273	273157441	/nfs/dbraw/zinc/15/74/41/273157441.db2.gz	YFQCAONIZFFGDS-SECBINFHSA-N	-1	3	346.361	1.085	20	5		EDBDHM
Cc1cnc(N2CCN(C(=O)c3ccc([O-])cc3)CC2)c([N+](=O)[O-])c1	ZINC000268457109	281603675	/nfs/dbraw/zinc/60/36/75/281603675.db2.gz	HAKKONZZXSWXJI-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
Cc1cc(C(=O)N2CCOC[C@H]2[C@H]2CCCO2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000376224535	301107237	/nfs/dbraw/zinc/10/72/37/301107237.db2.gz	BISSQYLGCMNXKI-NWDGAFQWSA-N	-1	3	337.332	1.024	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCCC[C@H]1CO	ZINC000178916578	302048739	/nfs/dbraw/zinc/04/87/39/302048739.db2.gz	SVXRNJICOKUBPT-NWDGAFQWSA-N	-1	3	328.390	1.733	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCCc2c[nH]nc21	ZINC000268778068	302048868	/nfs/dbraw/zinc/04/88/68/302048868.db2.gz	HOGLLSNPUSAIQZ-LLVKDONJSA-N	-1	3	336.373	1.982	20	5		EDBDHM
Cn1cc(C(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])c(=O)[n-]c1=O	ZINC000294210401	303077598	/nfs/dbraw/zinc/07/75/98/303077598.db2.gz	UFRDVQJPJCIENF-UHFFFAOYSA-N	-1	3	332.316	1.059	20	5		EDBDHM
CCCCOCC[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000299311857	303605960	/nfs/dbraw/zinc/60/59/60/303605960.db2.gz	FMPBSNAVZPLQFX-UHFFFAOYSA-N	-1	3	332.378	1.698	20	5		EDBDHM
CO[C@@H]1C[C@H]([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C1(C)C	ZINC000440384330	305205068	/nfs/dbraw/zinc/20/50/68/305205068.db2.gz	VRMKMOSCDZMEKA-NWDGAFQWSA-N	-1	3	328.390	1.995	20	5		EDBDHM
C[C@@H](CO[C@H]1CCOC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000441540864	305222771	/nfs/dbraw/zinc/22/27/71/305222771.db2.gz	CHCVDKLPMQUEKO-ONGXEEELSA-N	-1	3	348.352	1.206	20	5		EDBDHM
NC(=O)c1ccc(F)c([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000442355867	305229150	/nfs/dbraw/zinc/22/91/50/305229150.db2.gz	VUYCPXIPHYTKRS-UHFFFAOYSA-N	-1	3	339.304	1.634	20	5		EDBDHM
COCC(COC)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000451888849	305371910	/nfs/dbraw/zinc/37/19/10/305371910.db2.gz	KIGCQPIWNBCFRQ-UHFFFAOYSA-N	-1	3	332.378	1.151	20	5		EDBDHM
Cc1cc(C(=O)N2CCC[C@@H]2c2nc(=N)n(C)[n-]2)ccc1[N+](=O)[O-]	ZINC000549744461	306148408	/nfs/dbraw/zinc/14/84/08/306148408.db2.gz	VDFPBEARCPXXJL-GFCCVEGCSA-N	-1	3	330.348	1.422	20	5		EDBDHM
CC(C)[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(N)=O	ZINC000107311252	441408344	/nfs/dbraw/zinc/40/83/44/441408344.db2.gz	QTZAOBFNASVZFG-JTQLQIEISA-N	-1	3	335.769	1.036	20	5		EDBDHM
Cc1cc(N2CCN(C(=O)c3ccccc3[O-])CC2)ncc1[N+](=O)[O-]	ZINC000074740329	441461268	/nfs/dbraw/zinc/46/12/68/441461268.db2.gz	UIZKXIQFOROREN-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCCOCC(C)C	ZINC000031073590	441512902	/nfs/dbraw/zinc/51/29/02/441512902.db2.gz	GKCUIHRKNXPANU-UHFFFAOYSA-N	-1	3	346.405	1.944	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCCOCC1CC1	ZINC000031074394	441513366	/nfs/dbraw/zinc/51/33/66/441513366.db2.gz	GVIUETROURFFHI-UHFFFAOYSA-N	-1	3	344.389	1.698	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H](CCO)c1ccccc1	ZINC000121466414	441711348	/nfs/dbraw/zinc/71/13/48/441711348.db2.gz	OCXYYUVHKCRRLA-CYBMUJFWSA-N	-1	3	336.369	1.997	20	5		EDBDHM
CN(CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C1CC1	ZINC000067717802	441672476	/nfs/dbraw/zinc/67/24/76/441672476.db2.gz	MPXKRFBREFZJMM-UHFFFAOYSA-N	-1	3	333.797	1.621	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(=O)n(C)c1	ZINC000057122845	441788115	/nfs/dbraw/zinc/78/81/15/441788115.db2.gz	WJIWQHDTJVXKBK-UHFFFAOYSA-N	-1	3	339.329	1.103	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H](CO)CC(C)(C)C)c([N+](=O)[O-])c1	ZINC000128814629	442289642	/nfs/dbraw/zinc/28/96/42/442289642.db2.gz	FIPNLWNIFJIWOF-LLVKDONJSA-N	-1	3	330.406	1.979	20	5		EDBDHM
CC[C@H](C)CC(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000191875702	442530842	/nfs/dbraw/zinc/53/08/42/442530842.db2.gz	UPJPHBIVDDIOKX-NSHDSACASA-N	-1	3	343.405	1.426	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CC(=O)NC(C)C)c1	ZINC000182519535	442779630	/nfs/dbraw/zinc/77/96/30/442779630.db2.gz	JQDMCBMUMUQUBR-UHFFFAOYSA-N	-1	3	349.796	1.360	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCCOC(F)F)c(F)c1	ZINC000193961582	442819929	/nfs/dbraw/zinc/81/99/29/442819929.db2.gz	QIFAXIAYHQUSLS-UHFFFAOYSA-N	-1	3	328.268	1.642	20	5		EDBDHM
CCNC(=O)[C@H](C)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000268913041	443145885	/nfs/dbraw/zinc/14/58/85/443145885.db2.gz	ZGWPCWCYSJFDTA-JTQLQIEISA-N	-1	3	329.378	1.015	20	5		EDBDHM
CCOc1cc(-c2noc(Cn3cnc([N+](=O)[O-])n3)n2)ccc1[O-]	ZINC000350787817	319069855	/nfs/dbraw/zinc/06/98/55/319069855.db2.gz	QBIHXJWZIAGUCJ-UHFFFAOYSA-N	-1	3	332.276	1.389	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]CCC[C@@H](C)O)cc1[N+](=O)[O-]	ZINC000278582037	443368756	/nfs/dbraw/zinc/36/87/56/443368756.db2.gz	APWXLXJRERSJCM-SECBINFHSA-N	-1	3	336.797	1.996	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](CO)CC(C)(C)C)c([N+](=O)[O-])c1	ZINC000269731343	443415599	/nfs/dbraw/zinc/41/55/99/443415599.db2.gz	YICSXKIRWQIRSM-SNVBAGLBSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CC[C@@H](NC(=O)c1cn(C)c(=O)[n-]c1=O)c1cccc([N+](=O)[O-])c1	ZINC000267317921	443416608	/nfs/dbraw/zinc/41/66/08/443416608.db2.gz	VIALPYRGWMCESE-GFCCVEGCSA-N	-1	3	332.316	1.275	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)[C@H](O)C(F)F	ZINC000451717804	320238710	/nfs/dbraw/zinc/23/87/10/320238710.db2.gz	TWSHDLGHCVSCCI-MNOVXSKESA-N	-1	3	338.332	1.419	20	5		EDBDHM
CCC(=O)c1ccc(N2CCC[C@]3(C2)NC(=O)[N-]C3=O)c([N+](=O)[O-])c1	ZINC000281377837	443893572	/nfs/dbraw/zinc/89/35/72/443893572.db2.gz	FFXXPLZORJUPPP-MRXNPFEDSA-N	-1	3	346.343	1.366	20	5		EDBDHM
Cc1nc([C@H](C)[N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])n[nH]1	ZINC000285317561	443940391	/nfs/dbraw/zinc/94/03/91/443940391.db2.gz	IPKNRNDYYUXRMS-VIFPVBQESA-N	-1	3	339.377	1.678	20	5		EDBDHM
Cc1nnc([C@H](C)[N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])[nH]1	ZINC000285317561	443940396	/nfs/dbraw/zinc/94/03/96/443940396.db2.gz	IPKNRNDYYUXRMS-VIFPVBQESA-N	-1	3	339.377	1.678	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)Cn2ccnc2)c([N+](=O)[O-])c1	ZINC000299074143	443946874	/nfs/dbraw/zinc/94/68/74/443946874.db2.gz	PNLQDNFJCSLSHG-JTQLQIEISA-N	-1	3	340.361	1.167	20	5		EDBDHM
Cc1nc([C@@H](C)[N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)n[nH]1	ZINC000285380927	443962843	/nfs/dbraw/zinc/96/28/43/443962843.db2.gz	NHGZNCFHCGKFKL-MRVPVSSYSA-N	-1	3	325.350	1.369	20	5		EDBDHM
Cc1sc(C(=O)N2CCC[C@@H]2c2nc(=N)n(C)[n-]2)cc1[N+](=O)[O-]	ZINC000555545058	320969847	/nfs/dbraw/zinc/96/98/47/320969847.db2.gz	XZIOTKRWLFYUMF-MRVPVSSYSA-N	-1	3	336.377	1.483	20	5		EDBDHM
Cn1ncc2ccc(C[N-]S(=O)(=O)c3ccccc3[N+](=O)[O-])cc21	ZINC000577155796	321627200	/nfs/dbraw/zinc/62/72/00/321627200.db2.gz	IFHZZXSKRWICNT-UHFFFAOYSA-N	-1	3	346.368	1.960	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](C)c2nncn2C)c([N+](=O)[O-])c1	ZINC000337681921	444350224	/nfs/dbraw/zinc/35/02/24/444350224.db2.gz	NPTITYSVEZMSGH-SECBINFHSA-N	-1	3	325.350	1.071	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-][C@H]2CCO[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000331041881	444371325	/nfs/dbraw/zinc/37/13/25/444371325.db2.gz	DVKGXPYNGLVTSY-WPRPVWTQSA-N	-1	3	332.353	1.888	20	5		EDBDHM
O=C1C[C@@H]([N-]c2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]2CCCCN12	ZINC000337801961	444414784	/nfs/dbraw/zinc/41/47/84/444414784.db2.gz	IUSVVFVDNIXCTM-CHWSQXEVSA-N	-1	3	343.343	2.210	20	5		EDBDHM
Cc1noc(C)c1C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000337933887	444464314	/nfs/dbraw/zinc/46/43/14/444464314.db2.gz	BESQIIGWXYTDRJ-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
CCC(CC)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)OC	ZINC000337959798	444472092	/nfs/dbraw/zinc/47/20/92/444472092.db2.gz	SHAJXKOVQMYBDF-UHFFFAOYSA-N	-1	3	348.352	1.744	20	5		EDBDHM
Cc1cc(S(=O)(=O)NCc2cnc(C)[n-]c2=O)ccc1[N+](=O)[O-]	ZINC000343960895	444696382	/nfs/dbraw/zinc/69/63/82/444696382.db2.gz	KVWSWPVXLYWLST-UHFFFAOYSA-N	-1	3	338.345	1.186	20	5		EDBDHM
C[C@@H]1[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCCN1C	ZINC000344060786	444757720	/nfs/dbraw/zinc/75/77/20/444757720.db2.gz	LSUNYZSGFOBRTP-BXKDBHETSA-N	-1	3	331.369	1.495	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@](C)(O)C1CC1	ZINC000336863698	444809463	/nfs/dbraw/zinc/80/94/63/444809463.db2.gz	BWEQZUIGSUHHNF-ZDUSSCGKSA-N	-1	3	330.362	1.043	20	5		EDBDHM
CCOC(=O)c1nc(CC)oc1[N-]C(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000342810820	444875962	/nfs/dbraw/zinc/87/59/62/444875962.db2.gz	WZMIHXHOIDTYFA-UHFFFAOYSA-N	-1	3	337.292	1.157	20	5		EDBDHM
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)C(=O)[N-]c1cnns1	ZINC000338895905	444918392	/nfs/dbraw/zinc/91/83/92/444918392.db2.gz	YZDLYHVPLDQDOQ-UHFFFAOYSA-N	-1	3	335.345	1.086	20	5		EDBDHM
C[C@@](O)(C[N-]c1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(F)(F)F	ZINC000346203176	445207915	/nfs/dbraw/zinc/20/79/15/445207915.db2.gz	DUFMKVJSLYDAED-LLVKDONJSA-N	-1	3	332.238	2.370	20	5		EDBDHM
Cn1c2cc([O-])c(NC(=O)c3cccc([N+](=O)[O-])c3)cc2n(C)c1=O	ZINC000359775780	445421930	/nfs/dbraw/zinc/42/19/30/445421930.db2.gz	SYZILGQEFCTFIT-UHFFFAOYSA-N	-1	3	342.311	1.743	20	5		EDBDHM
COC(=O)CCCC[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000360233646	445645855	/nfs/dbraw/zinc/64/58/55/445645855.db2.gz	IWPRPRDJHKBHTA-UHFFFAOYSA-N	-1	3	344.389	1.833	20	5		EDBDHM
NC(=O)NCc1ccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)cc1	ZINC000361699768	445883725	/nfs/dbraw/zinc/88/37/25/445883725.db2.gz	RSDPKVRJYLJMFQ-UHFFFAOYSA-N	-1	3	331.288	1.116	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H]2CC[C@@H](O)C2)c1[N+](=O)[O-]	ZINC000190187247	533708043	/nfs/dbraw/zinc/70/80/43/533708043.db2.gz	CLTVAEKQJVROAC-NWDGAFQWSA-N	-1	3	328.390	1.651	20	5		EDBDHM
Cc1cc(C(=O)N[C@H]2COc3ccccc3[C@H]2O)c([N+](=O)[O-])c(=O)[n-]1	ZINC000366521775	446247622	/nfs/dbraw/zinc/24/76/22/446247622.db2.gz	PUQCEAVNONCYKS-SMDDNHRTSA-N	-1	3	345.311	1.228	20	5		EDBDHM
Cc1nnc2n1CCC[C@@H]2[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000365859759	446375092	/nfs/dbraw/zinc/37/50/92/446375092.db2.gz	GZVOTHWWZDNTHA-JTQLQIEISA-N	-1	3	337.361	1.308	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCCC1(O)CCC1	ZINC000420721370	446770726	/nfs/dbraw/zinc/77/07/26/446770726.db2.gz	UQRGZXFCVSVTKR-UHFFFAOYSA-N	-1	3	344.389	1.577	20	5		EDBDHM
O=C(c1ccc2n[n-]nc2c1)N1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368412099	446846136	/nfs/dbraw/zinc/84/61/36/446846136.db2.gz	KPNHJYSDVJQUIG-NSHDSACASA-N	-1	3	341.331	1.540	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1C[C@H]2C[C@H]2C1	ZINC000425230747	447073404	/nfs/dbraw/zinc/07/34/04/447073404.db2.gz	CZHQYZFRQAUIJZ-ILWJIGKKSA-N	-1	3	340.357	1.458	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F	ZINC000427143339	447553343	/nfs/dbraw/zinc/55/33/43/447553343.db2.gz	IORJPBNZQMBJOL-LURJTMIESA-N	-1	3	336.279	1.986	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000431272986	447795720	/nfs/dbraw/zinc/79/57/20/447795720.db2.gz	CHEJIMBFPIKNFD-LBPRGKRZSA-N	-1	3	340.401	1.998	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)c2nnc(C)o2)c([N+](=O)[O-])c1	ZINC000531839635	448157821	/nfs/dbraw/zinc/15/78/21/448157821.db2.gz	WNLFLGOADKITMM-SSDOTTSWSA-N	-1	3	342.333	1.334	20	5		EDBDHM
CN(C)[C@]1(CNc2nc(C(=O)[O-])ccc2[N+](=O)[O-])CCSC1	ZINC000571526583	448166516	/nfs/dbraw/zinc/16/65/16/448166516.db2.gz	VQEDMZWMVVKVRT-ZDUSSCGKSA-N	-1	3	326.378	1.537	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-]	ZINC000577463433	448300655	/nfs/dbraw/zinc/30/06/55/448300655.db2.gz	PPHKLDNJOBDNGG-JTQLQIEISA-N	-1	3	338.751	1.798	20	5		EDBDHM
CCC[C@@H](C)[C@@H](CO)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000572488677	448392090	/nfs/dbraw/zinc/39/20/90/448392090.db2.gz	QDESCJXVFVYUKV-ZYHUDNBSSA-N	-1	3	330.406	1.979	20	5		EDBDHM
COc1cc(S(=O)(=O)[N-]c2cc(C)ncc2C)ccc1[N+](=O)[O-]	ZINC000533468601	448407025	/nfs/dbraw/zinc/40/70/25/448407025.db2.gz	STLTYANHYVXYAS-UHFFFAOYSA-N	-1	3	337.357	1.838	20	5		EDBDHM
CN1CC=C(CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2[O-])CC1	ZINC000516068879	448375726	/nfs/dbraw/zinc/37/57/26/448375726.db2.gz	QMXGKDZPFAUFQT-UHFFFAOYSA-N	-1	3	325.752	1.946	20	5		EDBDHM
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC[C@@H]2CCCCN2C2CC2)n1	ZINC000566621545	448523183	/nfs/dbraw/zinc/52/31/83/448523183.db2.gz	GDOSTHONTZTCOS-LBPRGKRZSA-N	-1	3	334.376	2.425	20	5		EDBDHM
CC(C)N(CCc1cn(CC(=O)[O-])nn1)Cc1ccc([N+](=O)[O-])cc1	ZINC000573379502	448612208	/nfs/dbraw/zinc/61/22/08/448612208.db2.gz	KCUIYGRSFKVHJY-UHFFFAOYSA-N	-1	3	347.375	1.724	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCS[C@@H]1C	ZINC000592111191	448691050	/nfs/dbraw/zinc/69/10/50/448691050.db2.gz	IUDGNGYJTUGHEX-PSASIEDQSA-N	-1	3	332.403	1.776	20	5		EDBDHM
Cc1cc(N2CCN(C[C@H](C)O)[C@@H](C)C2)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000574403378	448866504	/nfs/dbraw/zinc/86/65/04/448866504.db2.gz	DIVGEFGNGPNHAL-RYUDHWBXSA-N	-1	3	337.376	1.493	20	5		EDBDHM
CC(C)O[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1(C)C	ZINC000593578436	449086217	/nfs/dbraw/zinc/08/62/17/449086217.db2.gz	SJDNTVOOCNLGNP-RYUDHWBXSA-N	-1	3	343.405	1.860	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCO[C@H](C3CC3)C2)nc1	ZINC000593578275	449086525	/nfs/dbraw/zinc/08/65/25/449086525.db2.gz	RDPSUZABYWXOBW-PWSUYJOCSA-N	-1	3	327.362	1.226	20	5		EDBDHM
CC(C)N1CCC[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000593578552	449086659	/nfs/dbraw/zinc/08/66/59/449086659.db2.gz	NGCKFMMFTXBGNX-NSHDSACASA-N	-1	3	328.394	1.141	20	5		EDBDHM
C[C@@H](CN1CCC[C@@H](C)C1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593583150	449089375	/nfs/dbraw/zinc/08/93/75/449089375.db2.gz	ZLPZJXRJFDJNFM-NEPJUHHUSA-N	-1	3	342.421	1.389	20	5		EDBDHM
CC1(C)CCCN(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000593588903	449093187	/nfs/dbraw/zinc/09/31/87/449093187.db2.gz	PXDJCJFZLGILOK-UHFFFAOYSA-N	-1	3	342.421	1.390	20	5		EDBDHM
CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000590401648	449148576	/nfs/dbraw/zinc/14/85/76/449148576.db2.gz	MYQGYSYGFRJDDC-UONOGXRCSA-N	-1	3	335.360	1.236	20	5		EDBDHM
CCN1CCC[C@@H]1C[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F	ZINC000590589728	449204464	/nfs/dbraw/zinc/20/44/64/449204464.db2.gz	NCPWMDKOABUFPY-LLVKDONJSA-N	-1	3	345.396	1.805	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](C)[C@H](OC)C1CC1	ZINC000590764082	449284921	/nfs/dbraw/zinc/28/49/21/449284921.db2.gz	HSZZVYRFVTVPTK-RNCFNFMXSA-N	-1	3	344.389	1.695	20	5		EDBDHM
CC1(C)[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)[C@H]2CCO[C@@H]21	ZINC000593550678	449341582	/nfs/dbraw/zinc/34/15/82/449341582.db2.gz	GSZCJRIPMGBDOD-JLLWLGSASA-N	-1	3	327.362	1.082	20	5		EDBDHM
CCO[C@H](CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(C)C	ZINC000593554799	449345560	/nfs/dbraw/zinc/34/55/60/449345560.db2.gz	CILPFRSZXZXVEK-GFCCVEGCSA-N	-1	3	331.394	1.719	20	5		EDBDHM
Cc1nc(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)sc1C	ZINC000593564779	449353776	/nfs/dbraw/zinc/35/37/76/449353776.db2.gz	BYDBYQHQOMJFAW-UHFFFAOYSA-N	-1	3	342.402	1.584	20	5		EDBDHM
C[C@H](Cc1cccs1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593532872	449329358	/nfs/dbraw/zinc/32/93/58/449329358.db2.gz	ZXXMFAKCSWDYKV-SECBINFHSA-N	-1	3	327.387	1.961	20	5		EDBDHM
CC(C)(C)OC(=O)[C@@H]1CN(c2cc[n-]c(=O)c2[N+](=O)[O-])CCO1	ZINC000596151733	449386827	/nfs/dbraw/zinc/38/68/27/449386827.db2.gz	JZOMKXKACZWSEB-JTQLQIEISA-N	-1	3	325.321	1.242	20	5		EDBDHM
Cn1nc(C2CCOCC2)cc1NC(=O)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000600838032	449571085	/nfs/dbraw/zinc/57/10/85/449571085.db2.gz	JSAWCUABXRFIHJ-UHFFFAOYSA-N	-1	3	347.331	1.575	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-][C@@H]1CCSC1	ZINC000594759510	449674601	/nfs/dbraw/zinc/67/46/01/449674601.db2.gz	ORPLQMSWSJCYEU-SECBINFHSA-N	-1	3	339.398	1.927	20	5		EDBDHM
CN1CCCC(C)(C)[C@H]1C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594773143	449686028	/nfs/dbraw/zinc/68/60/28/449686028.db2.gz	UXZVXEKAEVLVPQ-GFCCVEGCSA-N	-1	3	342.421	1.389	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]C[C@H](CO)CC1CC1	ZINC000594864041	449777078	/nfs/dbraw/zinc/77/70/78/449777078.db2.gz	JYPKFNLSBYSAAK-SNVBAGLBSA-N	-1	3	348.808	1.935	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@H](CO)CC2CC2)cc1[N+](=O)[O-]	ZINC000594865939	449780222	/nfs/dbraw/zinc/78/02/22/449780222.db2.gz	TULVLHIEHLHDDP-SNVBAGLBSA-N	-1	3	334.419	1.652	20	5		EDBDHM
COC(=O)[C@](C)(CCF)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000594863774	449775599	/nfs/dbraw/zinc/77/55/99/449775599.db2.gz	RYPGAPAWCQKIQP-LBPRGKRZSA-N	-1	3	334.325	1.164	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCCN2CCCC2)c(F)cc1[N+](=O)[O-]	ZINC000601292505	449803424	/nfs/dbraw/zinc/80/34/24/449803424.db2.gz	OTNGILVYTVJRJP-UHFFFAOYSA-N	-1	3	345.396	1.807	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@]2(C)CCOC2)c(F)cc1[N+](=O)[O-]	ZINC000601344769	449855190	/nfs/dbraw/zinc/85/51/90/449855190.db2.gz	DPIKSLZYZFAICE-ZDUSSCGKSA-N	-1	3	332.353	1.747	20	5		EDBDHM
CCOc1ccc(C(=O)NCCc2c(C)[n-][nH]c2=O)cc1[N+](=O)[O-]	ZINC000609619403	450071233	/nfs/dbraw/zinc/07/12/33/450071233.db2.gz	HXRWUXQAJOKJEO-NSHDSACASA-N	-1	3	334.332	1.235	20	5		EDBDHM
CO[C@H]1C[C@@H](C[N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C1	ZINC000599517924	450037859	/nfs/dbraw/zinc/03/78/59/450037859.db2.gz	LAVGJMJECKKPFD-TXEJJXNPSA-N	-1	3	328.390	1.915	20	5		EDBDHM
CCn1nccc1C[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000595416955	450128402	/nfs/dbraw/zinc/12/84/02/450128402.db2.gz	UYNHIYLENZWVGC-UHFFFAOYSA-N	-1	3	340.361	1.298	20	5		EDBDHM
O=[N+]([O-])c1ccc(OCC[N-]S(=O)(=O)Cc2ccon2)cc1	ZINC000610263514	450173701	/nfs/dbraw/zinc/17/37/01/450173701.db2.gz	XMFALOANSDFQSD-UHFFFAOYSA-N	-1	3	327.318	1.081	20	5		EDBDHM
CC[C@H]1CCCCN1CC[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000610263704	450174867	/nfs/dbraw/zinc/17/48/67/450174867.db2.gz	BFMZIDYPDWDPSY-LBPRGKRZSA-N	-1	3	342.421	1.533	20	5		EDBDHM
CC[C@]1([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2OC)CCOC1	ZINC000619499429	450492869	/nfs/dbraw/zinc/49/28/69/450492869.db2.gz	RGTKDGUBTXKCIT-ZDUSSCGKSA-N	-1	3	330.362	1.451	20	5		EDBDHM
C[C@H](CN(C)c1ccc([N+](=O)[O-])c(OC(F)F)c1)c1nnn[n-]1	ZINC000129856202	534031911	/nfs/dbraw/zinc/03/19/11/534031911.db2.gz	XDMQUXOQOMGYNP-SSDOTTSWSA-N	-1	3	328.279	1.949	20	5		EDBDHM
C[C@H](CN(C)c1ccc([N+](=O)[O-])c(OC(F)F)c1)c1nn[n-]n1	ZINC000129856202	534031925	/nfs/dbraw/zinc/03/19/25/534031925.db2.gz	XDMQUXOQOMGYNP-SSDOTTSWSA-N	-1	3	328.279	1.949	20	5		EDBDHM
CCO[C@@H]1COCC[C@H]1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000352977583	535760237	/nfs/dbraw/zinc/76/02/37/535760237.db2.gz	PGXUOHXWSJQXTG-ZYHUDNBSSA-N	-1	3	330.362	1.067	20	5		EDBDHM
CCc1nc([C@H](C)[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2C)n[nH]1	ZINC000270596654	536153721	/nfs/dbraw/zinc/15/37/21/536153721.db2.gz	UVDVVWNDPCQGSF-VIFPVBQESA-N	-1	3	339.377	1.623	20	5		EDBDHM
COc1cc(C(=O)[N-]c2n[nH]c(C)n2)c([N+](=O)[O-])cc1OC(F)F	ZINC000264174822	536537670	/nfs/dbraw/zinc/53/76/70/536537670.db2.gz	KPYUQAFKWYMEKE-UHFFFAOYSA-N	-1	3	343.246	1.884	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CC[C@H](CO)CC1	ZINC000270303407	536956970	/nfs/dbraw/zinc/95/69/70/536956970.db2.gz	XEPUWFFKLOVQTM-XYPYZODXSA-N	-1	3	344.389	1.433	20	5		EDBDHM
Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(-c2nnn[n-]2)cn1	ZINC000737284016	579065741	/nfs/dbraw/zinc/06/57/41/579065741.db2.gz	XBDUJBPKZCAIAP-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(-c2nn[n-]n2)cn1	ZINC000737284016	579065742	/nfs/dbraw/zinc/06/57/42/579065742.db2.gz	XBDUJBPKZCAIAP-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2(C)OCCCO2)cc1C	ZINC000752826013	579866506	/nfs/dbraw/zinc/86/65/06/579866506.db2.gz	GSRMNIUDXUZUDW-UHFFFAOYSA-N	-1	3	344.389	1.643	20	5		EDBDHM
Nc1c(=O)[n-]c(=O)[nH]c1C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000753637141	579883973	/nfs/dbraw/zinc/88/39/73/579883973.db2.gz	UDXAWXVLUFDDTG-UHFFFAOYSA-N	-1	3	342.271	1.179	20	5		EDBDHM
O=C(CNc1ccccc1[N+](=O)[O-])[N-]N1C(=O)c2ccccc2C1=O	ZINC000763228558	580095644	/nfs/dbraw/zinc/09/56/44/580095644.db2.gz	FKAUURDYBNDKPJ-UHFFFAOYSA-N	-1	3	340.295	1.334	20	5		EDBDHM
CC1(C)[C@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@@H]2CCO[C@H]21	ZINC000768840736	580221970	/nfs/dbraw/zinc/22/19/70/580221970.db2.gz	BYNMXDUANUCWFR-JMJZKYOTSA-N	-1	3	332.403	1.748	20	5		EDBDHM
COc1c([O-])ccc(CN2C[C@H](C)S(=O)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000893989200	591160845	/nfs/dbraw/zinc/16/08/45/591160845.db2.gz	KWHGGBWYOQLYMD-UWVGGRQHSA-N	-1	3	328.390	1.650	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2COC[C@@H]2C2CC2)c(F)cc1[N+](=O)[O-]	ZINC000908411610	592485831	/nfs/dbraw/zinc/48/58/31/592485831.db2.gz	SUYVDAYQARGHOF-ZYHUDNBSSA-N	-1	3	344.364	1.746	20	5		EDBDHM
CCS(=O)(=O)C[C@@H](C)Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000736655281	593023381	/nfs/dbraw/zinc/02/33/81/593023381.db2.gz	AKFYEIQYMHVBLS-MRVPVSSYSA-N	-1	3	340.365	1.010	20	5		EDBDHM
CCS(=O)(=O)C[C@@H](C)Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000736655281	593023383	/nfs/dbraw/zinc/02/33/83/593023383.db2.gz	AKFYEIQYMHVBLS-MRVPVSSYSA-N	-1	3	340.365	1.010	20	5		EDBDHM
CC(C)(CN1CCOCC1)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000841558773	593367186	/nfs/dbraw/zinc/36/71/86/593367186.db2.gz	DJMMUIWXOWFHTN-UHFFFAOYSA-N	-1	3	349.434	1.045	20	5		EDBDHM
CCN1CCN(C(=O)C[N-]c2c([N+](=O)[O-])cccc2[N+](=O)[O-])CC1	ZINC000804430430	593413755	/nfs/dbraw/zinc/41/37/55/593413755.db2.gz	PADZVRWHDGWESS-UHFFFAOYSA-N	-1	3	337.336	1.079	20	5		EDBDHM
Nc1ccc([N-]S(=O)(=O)CCOCC(F)(F)F)cc1[N+](=O)[O-]	ZINC000811680453	593476038	/nfs/dbraw/zinc/47/60/38/593476038.db2.gz	LOTWGJICLPOWRX-UHFFFAOYSA-N	-1	3	343.283	1.498	20	5		EDBDHM
C[C@H]1CC[C@@H](OC(=O)C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000815244189	593621965	/nfs/dbraw/zinc/62/19/65/593621965.db2.gz	VANIIUJOMGSYIJ-WDEREUQCSA-N	-1	3	342.373	1.605	20	5		EDBDHM
CCn1nc(C)c(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)n1	ZINC000819886694	593773912	/nfs/dbraw/zinc/77/39/12/593773912.db2.gz	AUBTVSIWINPMTO-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
O=C([O-])C[C@H]1CCCN(C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000821517137	593852100	/nfs/dbraw/zinc/85/21/00/593852100.db2.gz	XNUDJPGFHNRWHG-OLZOCXBDSA-N	-1	3	338.360	1.521	20	5		EDBDHM
Cc1c(NC(=O)c2ccc([N+](=O)[O-])cn2)cccc1-c1nnn[n-]1	ZINC000822109299	593995074	/nfs/dbraw/zinc/99/50/74/593995074.db2.gz	PUJAAFONYGXPLB-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cc1c(NC(=O)c2ccc([N+](=O)[O-])cn2)cccc1-c1nn[n-]n1	ZINC000822109299	593995076	/nfs/dbraw/zinc/99/50/76/593995076.db2.gz	PUJAAFONYGXPLB-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cn1cc(CN2CC[C@H](C(=O)[O-])C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000821287506	594007500	/nfs/dbraw/zinc/00/75/00/594007500.db2.gz	OQLCXXDHHJERLZ-LBPRGKRZSA-N	-1	3	330.344	1.902	20	5		EDBDHM
Cc1cnc(NCCOc2ccc(-c3nnn[n-]3)cc2)c([N+](=O)[O-])c1	ZINC000822395262	594042805	/nfs/dbraw/zinc/04/28/05/594042805.db2.gz	ZAAKXXFCKMUZJF-UHFFFAOYSA-N	-1	3	341.331	1.969	20	5		EDBDHM
Cc1cnc(NCCOc2ccc(-c3nn[n-]n3)cc2)c([N+](=O)[O-])c1	ZINC000822395262	594042807	/nfs/dbraw/zinc/04/28/07/594042807.db2.gz	ZAAKXXFCKMUZJF-UHFFFAOYSA-N	-1	3	341.331	1.969	20	5		EDBDHM
Cn1c(C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)ccc1[N+](=O)[O-]	ZINC000822596511	594071359	/nfs/dbraw/zinc/07/13/59/594071359.db2.gz	NFADMROTPNOZNC-UHFFFAOYSA-N	-1	3	331.267	1.505	20	5		EDBDHM
Cn1c(C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)ccc1[N+](=O)[O-]	ZINC000822596511	594071361	/nfs/dbraw/zinc/07/13/61/594071361.db2.gz	NFADMROTPNOZNC-UHFFFAOYSA-N	-1	3	331.267	1.505	20	5		EDBDHM
CC[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)[C@H](O)C(F)(F)F	ZINC000825146321	594136142	/nfs/dbraw/zinc/13/61/42/594136142.db2.gz	CFKPQMBJNIVGJE-WPRPVWTQSA-N	-1	3	346.269	1.889	20	5		EDBDHM
CC[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)[C@H](O)C(F)(F)F	ZINC000825146321	594136144	/nfs/dbraw/zinc/13/61/44/594136144.db2.gz	CFKPQMBJNIVGJE-WPRPVWTQSA-N	-1	3	346.269	1.889	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@@H]2CCCn3ncnc32)c(-c2nnn[n-]2)c1	ZINC000823639423	594223923	/nfs/dbraw/zinc/22/39/23/594223923.db2.gz	ACUNRLHJWPZNJZ-LLVKDONJSA-N	-1	3	327.308	1.313	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@@H]2CCCn3ncnc32)c(-c2nn[n-]n2)c1	ZINC000823639423	594223924	/nfs/dbraw/zinc/22/39/24/594223924.db2.gz	ACUNRLHJWPZNJZ-LLVKDONJSA-N	-1	3	327.308	1.313	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCCOC2CCOCC2)c(-c2nnn[n-]2)c1	ZINC000823639661	594223959	/nfs/dbraw/zinc/22/39/59/594223959.db2.gz	FGJLOFZQYVRDHZ-UHFFFAOYSA-N	-1	3	348.363	1.773	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCCOC2CCOCC2)c(-c2nn[n-]n2)c1	ZINC000823639661	594223960	/nfs/dbraw/zinc/22/39/60/594223960.db2.gz	FGJLOFZQYVRDHZ-UHFFFAOYSA-N	-1	3	348.363	1.773	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N3CC[C@H](CO)C3)cc(-c3nnn[n-]3)c2c1	ZINC000823645097	594224368	/nfs/dbraw/zinc/22/43/68/594224368.db2.gz	NRISIHJHPBADHW-VIFPVBQESA-N	-1	3	341.331	1.142	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N3CC[C@H](CO)C3)cc(-c3nn[n-]n3)c2c1	ZINC000823645097	594224369	/nfs/dbraw/zinc/22/43/69/594224369.db2.gz	NRISIHJHPBADHW-VIFPVBQESA-N	-1	3	341.331	1.142	20	5		EDBDHM
CCN1C[C@@H](C)[C@H](Nc2c(C(=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000829752867	594255206	/nfs/dbraw/zinc/25/52/06/594255206.db2.gz	LLFDTLWHZILGLV-LDYMZIIASA-N	-1	3	338.320	1.953	20	5		EDBDHM
CN(C[C@H]1CCCC[C@@H]1O)c1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825908850	594275178	/nfs/dbraw/zinc/27/51/78/594275178.db2.gz	NCZWUXNQYMTPOO-SKDRFNHKSA-N	-1	3	333.352	1.157	20	5		EDBDHM
CN(C[C@H]1CCCC[C@@H]1O)c1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825908850	594275180	/nfs/dbraw/zinc/27/51/80/594275180.db2.gz	NCZWUXNQYMTPOO-SKDRFNHKSA-N	-1	3	333.352	1.157	20	5		EDBDHM
Cc1nn(CN(C)c2ccc(-c3nnn[n-]3)cc2F)c(C)c1[N+](=O)[O-]	ZINC000826334605	594430829	/nfs/dbraw/zinc/43/08/29/594430829.db2.gz	BJGWGJJYSOOVKP-UHFFFAOYSA-N	-1	3	346.326	1.821	20	5		EDBDHM
Cc1nn(CN(C)c2ccc(-c3nn[n-]n3)cc2F)c(C)c1[N+](=O)[O-]	ZINC000826334605	594430830	/nfs/dbraw/zinc/43/08/30/594430830.db2.gz	BJGWGJJYSOOVKP-UHFFFAOYSA-N	-1	3	346.326	1.821	20	5		EDBDHM
Cc1noc(C)c1[C@H](C)CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000826338880	594432914	/nfs/dbraw/zinc/43/29/14/594432914.db2.gz	KVMOOHAYHNCUSF-SSDOTTSWSA-N	-1	3	344.335	1.990	20	5		EDBDHM
Cc1noc(C)c1[C@H](C)CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000826338880	594432917	/nfs/dbraw/zinc/43/29/17/594432917.db2.gz	KVMOOHAYHNCUSF-SSDOTTSWSA-N	-1	3	344.335	1.990	20	5		EDBDHM
Cn1ncc([N+](=O)[O-])c1C(=O)OCc1cc(-c2nnn[n-]2)ccc1F	ZINC000826366630	594447818	/nfs/dbraw/zinc/44/78/18/594447818.db2.gz	QXXRAXYSEACOBY-UHFFFAOYSA-N	-1	3	347.266	1.005	20	5		EDBDHM
Cn1ncc([N+](=O)[O-])c1C(=O)OCc1cc(-c2nn[n-]n2)ccc1F	ZINC000826366630	594447821	/nfs/dbraw/zinc/44/78/21/594447821.db2.gz	QXXRAXYSEACOBY-UHFFFAOYSA-N	-1	3	347.266	1.005	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC[C@H]([C@@H]3CCOC3)C2)c(-c2nnn[n-]2)c1	ZINC000826500677	594503381	/nfs/dbraw/zinc/50/33/81/594503381.db2.gz	HWPUFDJAXLBRGU-VHSXEESVSA-N	-1	3	331.336	1.033	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC[C@H]([C@@H]3CCOC3)C2)c(-c2nn[n-]n2)c1	ZINC000826500677	594503382	/nfs/dbraw/zinc/50/33/82/594503382.db2.gz	HWPUFDJAXLBRGU-VHSXEESVSA-N	-1	3	331.336	1.033	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)co1	ZINC000832472945	594752844	/nfs/dbraw/zinc/75/28/44/594752844.db2.gz	IEVGTJHPTKGXQC-UHFFFAOYSA-N	-1	3	325.346	1.932	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H]2C[C@@](C)(O)C2)c1	ZINC000841572893	594925432	/nfs/dbraw/zinc/92/54/32/594925432.db2.gz	HYJONPMVOXUHSD-LYWQIFSTSA-N	-1	3	334.781	1.748	20	5		EDBDHM
C[C@@H](NC(=O)[O-])[C@H]1CCCN(CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000833814096	594936232	/nfs/dbraw/zinc/93/62/32/594936232.db2.gz	RHXGADHQBOYWSB-NEPJUHHUSA-N	-1	3	338.364	1.125	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCN2CC=CCC2)cc1F	ZINC000867213679	595039007	/nfs/dbraw/zinc/03/90/07/595039007.db2.gz	AZECVKOPGDZGPM-UHFFFAOYSA-N	-1	3	343.380	1.583	20	5		EDBDHM
O=C([N-]C[C@H]1COCCO1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848580838	595408184	/nfs/dbraw/zinc/40/81/84/595408184.db2.gz	GDNMJSOSUHYNDA-NSHDSACASA-N	-1	3	332.259	1.098	20	5		EDBDHM
O=C([N-][C@@H]1CCN(C2CC2)C1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848583113	595409263	/nfs/dbraw/zinc/40/92/63/595409263.db2.gz	VYNKIKYVXMSWCQ-SNVBAGLBSA-N	-1	3	341.314	1.919	20	5		EDBDHM
COC[C@H](C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)OC	ZINC000848586055	595410229	/nfs/dbraw/zinc/41/02/29/595410229.db2.gz	GWZTZSMCPBRGEX-NSHDSACASA-N	-1	3	334.275	1.344	20	5		EDBDHM
CCN(C)C(=O)C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848588264	595410803	/nfs/dbraw/zinc/41/08/03/595410803.db2.gz	QJAZIWPQJFVHPK-UHFFFAOYSA-N	-1	3	331.275	1.161	20	5		EDBDHM
COCC[C@H](CO)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848592081	595412142	/nfs/dbraw/zinc/41/21/42/595412142.db2.gz	WPZYQMFLSULWFM-SECBINFHSA-N	-1	3	334.275	1.080	20	5		EDBDHM
C[C@@H]1CN(CC[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@H](C)CO1	ZINC000849429384	595525077	/nfs/dbraw/zinc/52/50/77/595525077.db2.gz	PCVKAPONPDUYDO-NXEZZACHSA-N	-1	3	349.434	1.044	20	5		EDBDHM
O=C([N-]OCCN1CCCC1=O)c1cc([N+](=O)[O-])ccc1Cl	ZINC000856035679	595879516	/nfs/dbraw/zinc/87/95/16/595879516.db2.gz	KXNGDUREUUUOBQ-UHFFFAOYSA-N	-1	3	327.724	1.532	20	5		EDBDHM
CC(C)(CO)O[N-]C(=O)c1cccc([N+](=O)[O-])c1Br	ZINC000857284806	596205274	/nfs/dbraw/zinc/20/52/74/596205274.db2.gz	RXFMRZAKDLNEDR-UHFFFAOYSA-N	-1	3	333.138	1.790	20	5		EDBDHM
CC(C)[C@@](C)(CNC(=O)[O-])NCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000738771284	603080175	/nfs/dbraw/zinc/08/01/75/603080175.db2.gz	LPSNFHFJAPCYNY-OAHLLOKOSA-N	-1	3	338.364	1.805	20	5		EDBDHM
CC[C@@H](C)N(C)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000067118849	138183824	/nfs/dbraw/zinc/18/38/24/138183824.db2.gz	UMYRKSJPBHAOED-SNVBAGLBSA-N	-1	3	333.385	1.743	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCOCC(F)(F)F)c(F)c1	ZINC000096996937	138296266	/nfs/dbraw/zinc/29/62/66/138296266.db2.gz	YXPJNNSGVFOPRI-UHFFFAOYSA-N	-1	3	346.258	1.591	20	5		EDBDHM
CC(C)NC(=O)[C@@H](C)[N-]c1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000413578769	304067750	/nfs/dbraw/zinc/06/77/50/304067750.db2.gz	YGQIPDNLVRDSFB-SSDOTTSWSA-N	-1	3	335.407	1.385	20	5		EDBDHM
CCn1nc(C)c([N+](=O)[O-])c1NCCNC(=O)c1ccc([O-])cc1	ZINC000192503846	138945741	/nfs/dbraw/zinc/94/57/41/138945741.db2.gz	GHLKPYCSPSBJBT-UHFFFAOYSA-N	-1	3	333.348	1.667	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])[C@@H](O)C(C)C	ZINC000416614082	251083973	/nfs/dbraw/zinc/08/39/73/251083973.db2.gz	FNFBKNSEONNTGN-FZMZJTMJSA-N	-1	3	330.406	1.977	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CC[C@H](C(N)=O)C2)cc1C	ZINC000452071750	254748847	/nfs/dbraw/zinc/74/88/47/254748847.db2.gz	RUSKFQLWEYGYPX-WDEREUQCSA-N	-1	3	341.389	1.144	20	5		EDBDHM
COCC(C)(C)[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	ZINC000490425381	255087332	/nfs/dbraw/zinc/08/73/32/255087332.db2.gz	LIYVBJXBGXDAOW-UHFFFAOYSA-N	-1	3	336.341	1.446	20	5		EDBDHM
COC(=O)Cc1n[n-]c(NC(=O)C=Cc2cccc([N+](=O)[O-])c2)n1	ZINC000491857941	255152631	/nfs/dbraw/zinc/15/26/31/255152631.db2.gz	DIUNPZZPVNFEQV-AATRIKPKSA-N	-1	3	331.288	1.080	20	5		EDBDHM
COC(=O)Cc1nnc(NC(=O)C=Cc2cccc([N+](=O)[O-])c2)[n-]1	ZINC000491857941	255152632	/nfs/dbraw/zinc/15/26/32/255152632.db2.gz	DIUNPZZPVNFEQV-AATRIKPKSA-N	-1	3	331.288	1.080	20	5		EDBDHM
COC(=O)Cc1nc(NC(=O)C=Cc2cccc([N+](=O)[O-])c2)n[n-]1	ZINC000491857941	255152633	/nfs/dbraw/zinc/15/26/33/255152633.db2.gz	DIUNPZZPVNFEQV-AATRIKPKSA-N	-1	3	331.288	1.080	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)nc1=N	ZINC000493314986	255203405	/nfs/dbraw/zinc/20/34/05/255203405.db2.gz	FAGDUIRZTGWAFL-PPGNKHEKSA-N	-1	3	342.359	1.513	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCC[C@@H](C)CO	ZINC000270220538	140062305	/nfs/dbraw/zinc/06/23/05/140062305.db2.gz	HIPDVLCEPLTGPV-SNVBAGLBSA-N	-1	3	332.378	1.290	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)CCc1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000271111494	140238601	/nfs/dbraw/zinc/23/86/01/140238601.db2.gz	NOFOQTVSMCBVDG-LLVKDONJSA-N	-1	3	330.362	1.008	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCCOCC1	ZINC000271875374	140364847	/nfs/dbraw/zinc/36/48/47/140364847.db2.gz	HHBDTCPNYPMHGL-SNVBAGLBSA-N	-1	3	330.362	1.451	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cnc(C)[n-]c1=O	ZINC000344906144	143025653	/nfs/dbraw/zinc/02/56/53/143025653.db2.gz	ACSYCZGAYUJLJH-UHFFFAOYSA-N	-1	3	333.304	1.729	20	5		EDBDHM
CCn1cc(S(=O)(=O)[N-]CCc2ccccc2[N+](=O)[O-])nc1C	ZINC000347964886	143384475	/nfs/dbraw/zinc/38/44/75/143384475.db2.gz	PRPJRTSLODTELY-UHFFFAOYSA-N	-1	3	338.389	1.641	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H]1C[C@H](C)O[C@H]1C	ZINC000416608436	304337232	/nfs/dbraw/zinc/33/72/32/304337232.db2.gz	RRDHNZZSUFYLEJ-SRVKXCTJSA-N	-1	3	328.390	1.995	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H](CCO)c1ccccc1	ZINC000352862399	149193754	/nfs/dbraw/zinc/19/37/54/149193754.db2.gz	OCXYYUVHKCRRLA-ZDUSSCGKSA-N	-1	3	336.369	1.997	20	5		EDBDHM
CCOC[C@H](C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC	ZINC000345307302	286161883	/nfs/dbraw/zinc/16/18/83/286161883.db2.gz	MZOUOFRRKOSYGA-VIFPVBQESA-N	-1	3	346.361	1.085	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@@]2(C1)NC(=O)[N-]C2=O	ZINC000248673277	292294979	/nfs/dbraw/zinc/29/49/79/292294979.db2.gz	GWPXDSWTZVEYJT-BZNIZROVSA-N	-1	3	332.360	1.638	20	5		EDBDHM
CC(C)[C@@H](C)C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000352486075	162206978	/nfs/dbraw/zinc/20/69/78/162206978.db2.gz	MBCIWMUHQOZTMJ-JTQLQIEISA-N	-1	3	344.389	1.936	20	5		EDBDHM
CN(C)CCn1cc(NC(=O)c2ccc([O-])c([N+](=O)[O-])c2)ccc1=O	ZINC000273351327	268033017	/nfs/dbraw/zinc/03/30/17/268033017.db2.gz	TVMJCGFZRISWHA-UHFFFAOYSA-N	-1	3	346.343	1.276	20	5		EDBDHM
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)[C@H]1OC	ZINC000273905016	268091704	/nfs/dbraw/zinc/09/17/04/268091704.db2.gz	ABRLHXHBSKWKQA-MGPQQGTHSA-N	-1	3	344.389	1.207	20	5		EDBDHM
CCC(CC)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC	ZINC000273167050	273031145	/nfs/dbraw/zinc/03/11/45/273031145.db2.gz	OKRZBMIBVXNKEA-UHFFFAOYSA-N	-1	3	330.362	1.848	20	5		EDBDHM
COCC1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)CCC1	ZINC000283897447	274002403	/nfs/dbraw/zinc/00/24/03/274002403.db2.gz	JWTSUUDPEWDNJZ-UHFFFAOYSA-N	-1	3	330.362	1.451	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-])N(C)C1CC1	ZINC000263919733	279348033	/nfs/dbraw/zinc/34/80/33/279348033.db2.gz	CAVIRGOMRLAMBS-SECBINFHSA-N	-1	3	331.369	1.495	20	5		EDBDHM
CC[C@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000292066460	289253187	/nfs/dbraw/zinc/25/31/87/289253187.db2.gz	PIGALFOQFWGHBR-QMMMGPOBSA-N	-1	3	342.295	1.663	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](C(N)=O)C(C)(C)C)c1[N+](=O)[O-]	ZINC000189953012	301555844	/nfs/dbraw/zinc/55/58/44/301555844.db2.gz	IJYTWGYAHDTWCA-LBPRGKRZSA-N	-1	3	343.405	1.390	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C1CCS(=O)CC1	ZINC000330630557	302047429	/nfs/dbraw/zinc/04/74/29/302047429.db2.gz	OOPXIYRCWWDXPQ-UHFFFAOYSA-N	-1	3	332.403	1.093	20	5		EDBDHM
CCC[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)OC	ZINC000295147017	303180063	/nfs/dbraw/zinc/18/00/63/303180063.db2.gz	AMIYSLJPHWWPLR-LLVKDONJSA-N	-1	3	332.378	1.697	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CCOC1(C)C	ZINC000295386862	303212212	/nfs/dbraw/zinc/21/22/12/303212212.db2.gz	UKFVHIRTRHYPEJ-LBPRGKRZSA-N	-1	3	330.362	1.449	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)n[nH]1	ZINC000296898473	303344548	/nfs/dbraw/zinc/34/45/48/303344548.db2.gz	DPYYRJJVMIWBGL-UHFFFAOYSA-N	-1	3	339.377	1.371	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000427134615	304985817	/nfs/dbraw/zinc/98/58/17/304985817.db2.gz	ZRVODAYTQIIBON-UHFFFAOYSA-N	-1	3	329.272	1.838	20	5		EDBDHM
COc1ccc(NC(=O)CNC(=O)c2cccc([O-])c2)cc1[N+](=O)[O-]	ZINC000427894905	305000700	/nfs/dbraw/zinc/00/07/00/305000700.db2.gz	JWZNHMDHFPLSMO-UHFFFAOYSA-N	-1	3	345.311	1.678	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2C[C@H]3OCCC[C@H]23)cc1[N+](=O)[O-]	ZINC000439091608	305193728	/nfs/dbraw/zinc/19/37/28/305193728.db2.gz	NHSSLUIGLKRPJK-FXPVBKGRSA-N	-1	3	332.403	1.811	20	5		EDBDHM
COCCc1cc(O)ccc1NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000444608119	305251421	/nfs/dbraw/zinc/25/14/21/305251421.db2.gz	KIPLEFLAXDNGPN-UHFFFAOYSA-N	-1	3	333.300	1.842	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CC[C@H](CO)CC2)c([N+](=O)[O-])c1	ZINC000535332889	306012862	/nfs/dbraw/zinc/01/28/62/306012862.db2.gz	STNDGYCYWMYDEL-XYPYZODXSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CN(C)S(=O)(=O)c1cccc([N-]C(=O)c2ccc([N+](=O)[O-])o2)c1	ZINC000014907157	441191430	/nfs/dbraw/zinc/19/14/30/441191430.db2.gz	WKMGORRWFNJCFX-UHFFFAOYSA-N	-1	3	339.329	1.690	20	5		EDBDHM
Cc1ccc(C(=O)NCCNC(=O)c2ccc([O-])cc2)cc1[N+](=O)[O-]	ZINC000047552877	441203975	/nfs/dbraw/zinc/20/39/75/441203975.db2.gz	ORBQTXMODDUKIO-UHFFFAOYSA-N	-1	3	343.339	1.769	20	5		EDBDHM
O=C(NCCN1CCc2ccccc2C1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000031338989	441522769	/nfs/dbraw/zinc/52/27/69/441522769.db2.gz	PDLBDTAGRCOTES-UHFFFAOYSA-N	-1	3	342.355	1.071	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCCn1cccn1	ZINC000032433449	441556267	/nfs/dbraw/zinc/55/62/67/441556267.db2.gz	PCMRRISETSQHRV-UHFFFAOYSA-N	-1	3	340.361	1.169	20	5		EDBDHM
CCOCCCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000055264247	441635592	/nfs/dbraw/zinc/63/55/92/441635592.db2.gz	NMRUYCJSWYCCNE-UHFFFAOYSA-N	-1	3	332.378	1.698	20	5		EDBDHM
CCC(C)(C)C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000116651535	441835734	/nfs/dbraw/zinc/83/57/34/441835734.db2.gz	RJKMPUUUIKSHBW-UHFFFAOYSA-N	-1	3	343.405	1.426	20	5		EDBDHM
O=C(CN1CCCC1)N1CCN(Cc2cc([O-])ccc2[N+](=O)[O-])CC1	ZINC000093046418	441853095	/nfs/dbraw/zinc/85/30/95/441853095.db2.gz	ZEWRVLZSJBLZDF-UHFFFAOYSA-N	-1	3	348.403	1.040	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCN(CC3CC3)C2)cc1[N+](=O)[O-]	ZINC000123876710	441902321	/nfs/dbraw/zinc/90/23/21/441902321.db2.gz	STGIVXVEWSTNOU-LLVKDONJSA-N	-1	3	345.446	1.727	20	5		EDBDHM
C[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CN1C1CC1	ZINC000126189832	442087381	/nfs/dbraw/zinc/08/73/81/442087381.db2.gz	ZMOGCSPOHRXACE-MNOVXSKESA-N	-1	3	325.390	1.498	20	5		EDBDHM
Cn1cnnc1[N-]C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-]	ZINC000157028734	442542766	/nfs/dbraw/zinc/54/27/66/442542766.db2.gz	ZZUPJIYQFDVOLC-UHFFFAOYSA-N	-1	3	345.237	1.917	20	5		EDBDHM
C[C@H](CN1CCCCC1)[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000180880151	442666615	/nfs/dbraw/zinc/66/66/15/442666615.db2.gz	MBNKOIFVDSLVDW-LLVKDONJSA-N	-1	3	345.396	1.887	20	5		EDBDHM
C[C@H](CNC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)N(C)Cc1ccccc1	ZINC000193573144	442754807	/nfs/dbraw/zinc/75/48/07/442754807.db2.gz	YSSGJNWWRWDKBE-GFCCVEGCSA-N	-1	3	344.371	1.946	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1nccs1	ZINC000193905513	442809427	/nfs/dbraw/zinc/80/94/27/442809427.db2.gz	LMIUEJMBFZNHKS-UHFFFAOYSA-N	-1	3	329.359	1.538	20	5		EDBDHM
COCc1nc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C)n[n-]1	ZINC000268483925	443005459	/nfs/dbraw/zinc/00/54/59/443005459.db2.gz	LZGNBKCMPZNCSS-UHFFFAOYSA-N	-1	3	337.361	1.899	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](C)CCCO)c1C	ZINC000295321606	318642834	/nfs/dbraw/zinc/64/28/34/318642834.db2.gz	PQAZNARPCFRONF-JTQLQIEISA-N	-1	3	330.406	1.899	20	5		EDBDHM
C[C@H](CCO)[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000416463171	319426692	/nfs/dbraw/zinc/42/66/92/319426692.db2.gz	UJUXGNXMFOBDPC-SSDOTTSWSA-N	-1	3	342.295	1.663	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@]2(C)CCC(=O)N2)c1[N+](=O)[O-]	ZINC000416502127	319435807	/nfs/dbraw/zinc/43/58/07/319435807.db2.gz	OLELWRRILCUPRC-CQSZACIVSA-N	-1	3	341.389	1.159	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)[N-]c2ncc3c(n2)CCC(C)(C)C3)n1	ZINC000278531769	443355411	/nfs/dbraw/zinc/35/54/11/443355411.db2.gz	QRCBLEOYUOKYDI-UHFFFAOYSA-N	-1	3	330.348	1.886	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](CCO)C(C)(C)C	ZINC000269705367	443403479	/nfs/dbraw/zinc/40/34/79/443403479.db2.gz	MBBOUWVUPSEOFD-CYBMUJFWSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CC[C@@H](C)[C@H](O)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000269719979	443410447	/nfs/dbraw/zinc/41/04/47/443410447.db2.gz	AZZSIXBUONFDJH-MWLCHTKSSA-N	-1	3	332.378	1.289	20	5		EDBDHM
O=C1[N-]C(=O)[C@]2(CCCN(c3ccc([N+](=O)[O-])c4cnccc43)C2)N1	ZINC000279031700	443495246	/nfs/dbraw/zinc/49/52/46/443495246.db2.gz	INQXALMNSVGVGY-MRXNPFEDSA-N	-1	3	341.327	1.321	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC1=CCN(C)CC1	ZINC000272282193	443578420	/nfs/dbraw/zinc/57/84/20/443578420.db2.gz	UFQIOJNYMNWMGS-UHFFFAOYSA-N	-1	3	325.390	1.443	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC[C@H]2CCCCO2)c([N+](=O)[O-])c1	ZINC000272385103	443609607	/nfs/dbraw/zinc/60/96/07/443609607.db2.gz	HJGCRMHSUHAMMT-LLVKDONJSA-N	-1	3	344.389	1.841	20	5		EDBDHM
C[C@H]1CN(CCCNC(=O)c2ccc([N+](=O)[O-])cc2[O-])CCCO1	ZINC000436949722	320027900	/nfs/dbraw/zinc/02/79/00/320027900.db2.gz	ARKUWRGBJFYINB-LBPRGKRZSA-N	-1	3	337.376	1.531	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1cccn1C	ZINC000439227105	320042060	/nfs/dbraw/zinc/04/20/60/320042060.db2.gz	WDKZKRCLQHTMRP-UHFFFAOYSA-N	-1	3	325.346	1.420	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCOCC(F)F	ZINC000276263191	443678125	/nfs/dbraw/zinc/67/81/25/443678125.db2.gz	SYHUPPPAIVQMPJ-UHFFFAOYSA-N	-1	3	340.304	1.163	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCC[C@H](C)CO)c1[N+](=O)[O-]	ZINC000276651211	443778486	/nfs/dbraw/zinc/77/84/86/443778486.db2.gz	CZQQZCXEFQJEDR-JTQLQIEISA-N	-1	3	330.406	1.899	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)C(F)(F)F)cc1[N+](=O)[O-]	ZINC000288620475	443936295	/nfs/dbraw/zinc/93/62/95/443936295.db2.gz	MIPAQNHEAGMHAV-ZCFIWIBFSA-N	-1	3	328.268	1.833	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@](C)(C(N)=O)C(C)C)c1[N+](=O)[O-]	ZINC000285452110	443989138	/nfs/dbraw/zinc/98/91/38/443989138.db2.gz	YNCCDFCJYVQFNP-CQSZACIVSA-N	-1	3	343.405	1.390	20	5		EDBDHM
O=C([O-])C[C@@H]1CSCCN1CCOc1ccc([N+](=O)[O-])cc1	ZINC000565105328	321169428	/nfs/dbraw/zinc/16/94/28/321169428.db2.gz	VJLGBECLVQGHKY-GFCCVEGCSA-N	-1	3	326.374	1.866	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(Sc3nnnn3C3CCOCC3)[n-]c2c1	ZINC000296960474	444265258	/nfs/dbraw/zinc/26/52/58/444265258.db2.gz	CPJJMMSPVSUECO-UHFFFAOYSA-N	-1	3	347.360	1.960	20	5		EDBDHM
O=[N+]([O-])c1ccc2[n-]c(Sc3nnnn3C3CCOCC3)nc2c1	ZINC000296960474	444265260	/nfs/dbraw/zinc/26/52/60/444265260.db2.gz	CPJJMMSPVSUECO-UHFFFAOYSA-N	-1	3	347.360	1.960	20	5		EDBDHM
CCc1[nH]nc(C(=O)[N-]c2ncc(C(C)(C)O)s2)c1[N+](=O)[O-]	ZINC000290619765	444302546	/nfs/dbraw/zinc/30/25/46/444302546.db2.gz	UCICIEWHINQARW-UHFFFAOYSA-N	-1	3	325.350	1.817	20	5		EDBDHM
CNC(=O)c1nn[n-]c1NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1	ZINC000297808492	444337120	/nfs/dbraw/zinc/33/71/20/444337120.db2.gz	TTYZCFPNHSJWMP-UHFFFAOYSA-N	-1	3	332.320	1.448	20	5		EDBDHM
CNC(=O)c1[n-]nnc1NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1	ZINC000297808492	444337122	/nfs/dbraw/zinc/33/71/22/444337122.db2.gz	TTYZCFPNHSJWMP-UHFFFAOYSA-N	-1	3	332.320	1.448	20	5		EDBDHM
CNC(=O)c1n[n-]nc1NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1	ZINC000297808492	444337123	/nfs/dbraw/zinc/33/71/23/444337123.db2.gz	TTYZCFPNHSJWMP-UHFFFAOYSA-N	-1	3	332.320	1.448	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1ccc(O)cc1	ZINC000322920688	444341360	/nfs/dbraw/zinc/34/13/60/444341360.db2.gz	HVXJHUBKZYPFID-UHFFFAOYSA-N	-1	3	338.341	1.788	20	5		EDBDHM
CCC[C@](C)([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C(=O)OC	ZINC000337835034	444430542	/nfs/dbraw/zinc/43/05/42/444430542.db2.gz	HZOHROPTJCOACS-AWEZNQCLSA-N	-1	3	344.389	1.913	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])n(C)n1	ZINC000341036249	444645454	/nfs/dbraw/zinc/64/54/54/444645454.db2.gz	FJXZLEVULWLLIH-UHFFFAOYSA-N	-1	3	344.780	1.769	20	5		EDBDHM
C[C@@H]1CCC[C@@]1(O)C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000336886077	444833823	/nfs/dbraw/zinc/83/38/23/444833823.db2.gz	BLEDADXQEOJDCB-BXUZGUMPSA-N	-1	3	328.390	1.565	20	5		EDBDHM
CCC1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)CCOCC1	ZINC000330539303	445024483	/nfs/dbraw/zinc/02/44/83/445024483.db2.gz	QSKAILFGWNDGFK-UHFFFAOYSA-N	-1	3	344.389	1.841	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@]2(O)CCC[C@@H]2C)cc1[N+](=O)[O-]	ZINC000339093199	445029453	/nfs/dbraw/zinc/02/94/53/445029453.db2.gz	BCRINOOSZXVKPB-QPUJVOFHSA-N	-1	3	334.419	1.794	20	5		EDBDHM
CC(C)(CF)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000351776284	445317660	/nfs/dbraw/zinc/31/76/60/445317660.db2.gz	SJKPGWIWOJBFIO-UHFFFAOYSA-N	-1	3	334.325	1.392	20	5		EDBDHM
Cc1[nH]nc(C(=O)[N-]c2cc3c(cc2F)CCC(=O)N3)c1[N+](=O)[O-]	ZINC000354556584	445293113	/nfs/dbraw/zinc/29/31/13/445293113.db2.gz	AKAYGRMDNLRPRO-UHFFFAOYSA-N	-1	3	333.279	1.902	20	5		EDBDHM
O=C(CNC(=O)c1cccc([O-])c1)NCc1ccccc1[N+](=O)[O-]	ZINC000348964863	445458338	/nfs/dbraw/zinc/45/83/38/445458338.db2.gz	JMTXFJLSANCTGF-UHFFFAOYSA-N	-1	3	329.312	1.347	20	5		EDBDHM
O=C(Nc1ccc2c(c1)NC(=O)CC2)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000361984783	446128671	/nfs/dbraw/zinc/12/86/71/446128671.db2.gz	VDNGCJSYMWIZKG-UHFFFAOYSA-N	-1	3	328.284	1.832	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](CO)c1ccsc1	ZINC000351569374	446167021	/nfs/dbraw/zinc/16/70/21/446167021.db2.gz	UCNMSMZJQGSUBO-NSHDSACASA-N	-1	3	342.398	1.977	20	5		EDBDHM
Cn1c(=O)[nH]c2ccc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)cc21	ZINC000443386591	447046199	/nfs/dbraw/zinc/04/61/99/447046199.db2.gz	MGZIZMOKBYSEDO-UHFFFAOYSA-N	-1	3	329.272	1.540	20	5		EDBDHM
Cn1ccnc1-c1nnc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)s1	ZINC000372204869	447025791	/nfs/dbraw/zinc/02/57/91/447025791.db2.gz	QNGGGAAPPBGZPX-UHFFFAOYSA-N	-1	3	347.316	1.200	20	5		EDBDHM
Cn1ccc([N-]C(=O)c2sc(Br)cc2[N+](=O)[O-])n1	ZINC000444839212	447141518	/nfs/dbraw/zinc/14/15/18/447141518.db2.gz	YHVGEGCWPYRQAT-UHFFFAOYSA-N	-1	3	331.151	2.405	20	5		EDBDHM
CCn1cc([C@@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)cn1	ZINC000452006739	447801082	/nfs/dbraw/zinc/80/10/82/447801082.db2.gz	PAZSOHRFADPUJJ-MRVPVSSYSA-N	-1	3	330.391	1.912	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCCC1CC1	ZINC000530328275	447860825	/nfs/dbraw/zinc/86/08/25/447860825.db2.gz	GRJSULLDSMTQBO-UHFFFAOYSA-N	-1	3	342.373	1.850	20	5		EDBDHM
C[C@H]1CCCCN1CC[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000525699703	448013357	/nfs/dbraw/zinc/01/33/57/448013357.db2.gz	NWFJWCOTNXZMEM-NSHDSACASA-N	-1	3	328.394	1.143	20	5		EDBDHM
CCc1nncn1CC[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000576995107	448188785	/nfs/dbraw/zinc/18/87/85/448188785.db2.gz	MTCVGGIYUCILEJ-UHFFFAOYSA-N	-1	3	339.377	1.036	20	5		EDBDHM
COC(=O)c1cccc2nc(NC(=O)c3ccc([N+](=O)[O-])cn3)[n-]c21	ZINC000534281536	448437690	/nfs/dbraw/zinc/43/76/90/448437690.db2.gz	ZCDDWIYROLKVPY-UHFFFAOYSA-N	-1	3	341.283	1.905	20	5		EDBDHM
COC(=O)c1cccc2[n-]c(NC(=O)c3ccc([N+](=O)[O-])cn3)nc21	ZINC000534281536	448437691	/nfs/dbraw/zinc/43/76/91/448437691.db2.gz	ZCDDWIYROLKVPY-UHFFFAOYSA-N	-1	3	341.283	1.905	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCOc2ccc([N+](=O)[O-])cc2)o1	ZINC000536896896	448546699	/nfs/dbraw/zinc/54/66/99/448546699.db2.gz	MTJSNMKVCFOHTI-UHFFFAOYSA-N	-1	3	326.330	1.854	20	5		EDBDHM
C[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)[C@H](C)C(=O)Nc1ncccc1[O-]	ZINC000588860806	448941901	/nfs/dbraw/zinc/94/19/01/448941901.db2.gz	AQBHNTFFRKSTJC-IUCAKERBSA-N	-1	3	348.315	1.682	20	5		EDBDHM
CN1Cc2ccccc2[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000593566561	449075954	/nfs/dbraw/zinc/07/59/54/449075954.db2.gz	KJBKNXBRVAEFLE-AWEZNQCLSA-N	-1	3	348.384	1.455	20	5		EDBDHM
CC(C)C[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCO1	ZINC000593572871	449081114	/nfs/dbraw/zinc/08/11/14/449081114.db2.gz	MVADGWOCMBYIQD-DGCLKSJQSA-N	-1	3	343.405	1.862	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCCc2nccs2)nc1	ZINC000593596038	449096938	/nfs/dbraw/zinc/09/69/38/449096938.db2.gz	LZSMYTWGTZTUTH-UHFFFAOYSA-N	-1	3	328.375	1.357	20	5		EDBDHM
CC(C)[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C1(CO)CCC1	ZINC000593597393	449098327	/nfs/dbraw/zinc/09/83/27/449098327.db2.gz	HTESHVBRWXWEFC-ZDUSSCGKSA-N	-1	3	343.405	1.455	20	5		EDBDHM
COC(=O)[C@@H](CCF)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000593633748	449119631	/nfs/dbraw/zinc/11/96/31/449119631.db2.gz	PVRZSVSTBOMZQC-SNVBAGLBSA-N	-1	3	348.352	1.391	20	5		EDBDHM
O=C(c1cc([O-])cc([N+](=O)[O-])c1)N1CCC(N2CCCOCC2)CC1	ZINC000600007698	449145976	/nfs/dbraw/zinc/14/59/76/449145976.db2.gz	XQECHEKXGPCNLR-UHFFFAOYSA-N	-1	3	349.387	1.627	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H](C)Cn2cccn2)c(F)cc1[N+](=O)[O-]	ZINC000590588932	449203463	/nfs/dbraw/zinc/20/34/63/449203463.db2.gz	NYFRYIBKWTZPPL-SNVBAGLBSA-N	-1	3	342.352	1.606	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCc3ccccc3C2)nc1	ZINC000593525153	449324409	/nfs/dbraw/zinc/32/44/09/449324409.db2.gz	KCRCOEMNZZTMHS-ZDUSSCGKSA-N	-1	3	333.369	1.826	20	5		EDBDHM
CC1(C)[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)[C@H]2CCO[C@H]21	ZINC000593550681	449342417	/nfs/dbraw/zinc/34/24/17/449342417.db2.gz	GSZCJRIPMGBDOD-YUSALJHKSA-N	-1	3	327.362	1.082	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C1CCOCC1	ZINC000593559717	449350435	/nfs/dbraw/zinc/35/04/35/449350435.db2.gz	YKOMRKPBNFBRPG-LBPRGKRZSA-N	-1	3	329.378	1.473	20	5		EDBDHM
CCc1nc(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)cs1	ZINC000593540233	449334437	/nfs/dbraw/zinc/33/44/37/449334437.db2.gz	OZUKMHGMKYAPGU-UHFFFAOYSA-N	-1	3	342.402	1.530	20	5		EDBDHM
CC(C)(C)N1CC[C@@H]([N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000594800629	449712238	/nfs/dbraw/zinc/71/22/38/449712238.db2.gz	HVPPWFQNGNZBTN-SNVBAGLBSA-N	-1	3	345.396	1.885	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2C[C@@H](O)C23CCC3)c(F)c1	ZINC000594865274	449779164	/nfs/dbraw/zinc/77/91/64/449779164.db2.gz	NWFRLTNBCQELEZ-NWDGAFQWSA-N	-1	3	330.337	1.316	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@@H]1C[C@H](O)C12CCC2	ZINC000594865924	449780553	/nfs/dbraw/zinc/78/05/53/449780553.db2.gz	TTYBJPYBMQGWDF-NEPJUHHUSA-N	-1	3	346.792	1.830	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](CO)CC(C)C	ZINC000594840666	449749093	/nfs/dbraw/zinc/74/90/93/449749093.db2.gz	MBBHFWDWXFDSEF-SNVBAGLBSA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN2CCCC2)c(F)cc1[N+](=O)[O-]	ZINC000601291801	449802759	/nfs/dbraw/zinc/80/27/59/449802759.db2.gz	IJOMULXHFFZEPQ-UHFFFAOYSA-N	-1	3	331.369	1.416	20	5		EDBDHM
CCOC(=O)c1nnc(CNC(=O)c2ccc([N+](=O)[O-])cc2C)[n-]1	ZINC000615920108	450272691	/nfs/dbraw/zinc/27/26/91/450272691.db2.gz	QJQAEOCKELFVDX-UHFFFAOYSA-N	-1	3	333.304	1.128	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](C)c1cnn(C)c1	ZINC000619486588	450487594	/nfs/dbraw/zinc/48/75/94/450487594.db2.gz	HAZHDMYKIFESNA-VIFPVBQESA-N	-1	3	340.361	1.376	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1CCC[C@H]1CCO	ZINC000619498148	450492703	/nfs/dbraw/zinc/49/27/03/450492703.db2.gz	DFZJGRINSPLMEK-WDEREUQCSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CCC(=O)N1CC[C@@H]([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C1	ZINC000133171838	528355933	/nfs/dbraw/zinc/35/59/33/528355933.db2.gz	KYPPZHGWJSHREK-LLVKDONJSA-N	-1	3	341.389	1.192	20	5		EDBDHM
CCN1CCN(CCCNC(=O)c2cc([O-])ccc2[N+](=O)[O-])CC1	ZINC000346133557	535697294	/nfs/dbraw/zinc/69/72/94/535697294.db2.gz	DVPLKDIAKPOBSX-UHFFFAOYSA-N	-1	3	336.392	1.058	20	5		EDBDHM
COC(=O)CC(C)(C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000741258836	579405758	/nfs/dbraw/zinc/40/57/58/579405758.db2.gz	YVENRBOMDCYPHN-UHFFFAOYSA-N	-1	3	334.325	1.354	20	5		EDBDHM
O=C(NCc1nnc(-c2ccccc2)[nH]1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000726798851	578362180	/nfs/dbraw/zinc/36/21/80/578362180.db2.gz	NAVUVUJACYRAEX-UHFFFAOYSA-N	-1	3	340.299	1.411	20	5		EDBDHM
O=C(CNC(=O)c1ccc([O-])cc1)OCc1c(F)cccc1[N+](=O)[O-]	ZINC000728998416	578555787	/nfs/dbraw/zinc/55/57/87/578555787.db2.gz	IFDTUHFPZPZVSE-UHFFFAOYSA-N	-1	3	348.286	1.913	20	5		EDBDHM
CCCCS(=O)(=O)[N-]CC(=O)OCc1cccc([N+](=O)[O-])c1	ZINC000760690872	580036353	/nfs/dbraw/zinc/03/63/53/580036353.db2.gz	SVIZBYKEDCINIB-UHFFFAOYSA-N	-1	3	330.362	1.358	20	5		EDBDHM
C[C@](O)(CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)c1ccsc1	ZINC000736142892	578957012	/nfs/dbraw/zinc/95/70/12/578957012.db2.gz	PUIBVHPJOYAWDE-ZDUSSCGKSA-N	-1	3	347.360	1.551	20	5		EDBDHM
C[C@](O)(CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)c1ccsc1	ZINC000736142892	578957013	/nfs/dbraw/zinc/95/70/13/578957013.db2.gz	PUIBVHPJOYAWDE-ZDUSSCGKSA-N	-1	3	347.360	1.551	20	5		EDBDHM
CC1(C)COCCN1CCNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000736214317	578965409	/nfs/dbraw/zinc/96/54/09/578965409.db2.gz	MQFWCZHVUREZDR-UHFFFAOYSA-N	-1	3	347.379	1.298	20	5		EDBDHM
CC1(C)COCCN1CCNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000736214317	578965410	/nfs/dbraw/zinc/96/54/10/578965410.db2.gz	MQFWCZHVUREZDR-UHFFFAOYSA-N	-1	3	347.379	1.298	20	5		EDBDHM
CN1CCC[C@@H]1[C@H]1CCCN1C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000737519128	579103504	/nfs/dbraw/zinc/10/35/04/579103504.db2.gz	GZIMIYOPWJJUDD-HUUCEWRRSA-N	-1	3	347.371	1.992	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]Cc2ccon2)cc1[N+](=O)[O-]	ZINC000777986612	580454332	/nfs/dbraw/zinc/45/43/32/580454332.db2.gz	OCFGREXSEWNRGY-UHFFFAOYSA-N	-1	3	331.281	1.209	20	5		EDBDHM
COC(=O)C[C@@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C1CC1	ZINC000754240803	579899129	/nfs/dbraw/zinc/89/91/29/579899129.db2.gz	YKBYEAVDBCKXHO-LLVKDONJSA-N	-1	3	342.373	1.523	20	5		EDBDHM
O=[N+]([O-])c1ccccc1C[N-]S(=O)(=O)c1cccc2nonc21	ZINC000765167154	580136473	/nfs/dbraw/zinc/13/64/73/580136473.db2.gz	LHPBIVLFZONHJJ-UHFFFAOYSA-N	-1	3	334.313	1.610	20	5		EDBDHM
COC(=O)CCCCC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768792810	580220492	/nfs/dbraw/zinc/22/04/92/580220492.db2.gz	GOVZAWXAPZVFOC-UHFFFAOYSA-N	-1	3	336.391	1.668	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)[C@H](O)C(F)(F)F	ZINC000768881854	580223353	/nfs/dbraw/zinc/22/33/53/580223353.db2.gz	LIMVPMMLPYJSKA-SVRRBLITSA-N	-1	3	348.324	1.636	20	5		EDBDHM
O=C(Nc1ccn(Cc2ccccn2)n1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000770328967	580258199	/nfs/dbraw/zinc/25/81/99/580258199.db2.gz	RQUGSPNGSIUYAS-UHFFFAOYSA-N	-1	3	340.299	1.588	20	5		EDBDHM
NC(=O)c1ccc(COC(=O)c2c([O-])cccc2F)c([N+](=O)[O-])c1	ZINC000772581764	580316180	/nfs/dbraw/zinc/31/61/80/580316180.db2.gz	SQQAOPFZLDTDAG-UHFFFAOYSA-N	-1	3	334.259	1.895	20	5		EDBDHM
O=C(CC[C@H]1NC(=O)[N-]C1=O)OCc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000782486657	580575846	/nfs/dbraw/zinc/57/58/46/580575846.db2.gz	YOHMVIZNWYTVHQ-SECBINFHSA-N	-1	3	341.707	1.280	20	5		EDBDHM
COC(=O)COc1ccc(C=Cc2nccc(=O)[n-]2)cc1[N+](=O)[O-]	ZINC000788730441	580728787	/nfs/dbraw/zinc/72/87/87/580728787.db2.gz	CLHSKJLHAQOTHV-HWKANZROSA-N	-1	3	331.284	1.813	20	5		EDBDHM
Cn1ncc([N+](=O)[O-])c1C(=O)[N-]c1cc(-c2nc[nH]n2)ccc1F	ZINC000791278008	580788197	/nfs/dbraw/zinc/78/81/97/580788197.db2.gz	MKFAOIQIDOCUQQ-UHFFFAOYSA-N	-1	3	331.267	1.505	20	5		EDBDHM
CC(=O)N1CCC[C@@H](C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000795263587	580916983	/nfs/dbraw/zinc/91/69/83/580916983.db2.gz	IARBREAPVIUBAF-JTQLQIEISA-N	-1	3	347.418	1.193	20	5		EDBDHM
COc1ccc([N-]S(=O)(=O)C[C@@H]2CCCOC2)cc1[N+](=O)[O-]	ZINC000795347431	580919650	/nfs/dbraw/zinc/91/96/50/580919650.db2.gz	IMCDERIMUYONAT-SNVBAGLBSA-N	-1	3	330.362	1.772	20	5		EDBDHM
O=C(CNC(=O)c1ccc([O-])cc1)OCc1cc(F)ccc1[N+](=O)[O-]	ZINC000727539753	591759301	/nfs/dbraw/zinc/75/93/01/591759301.db2.gz	TZJZMERKZLQUCS-UHFFFAOYSA-N	-1	3	348.286	1.913	20	5		EDBDHM
O=C1[C@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C[C@@H]2CCCCN12	ZINC000841532475	593206672	/nfs/dbraw/zinc/20/66/72/593206672.db2.gz	TUQUKBCIHTVKEG-WCBMZHEXSA-N	-1	3	345.402	1.088	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@H](CO)Cc2ccco2)cs1	ZINC000768847513	593442694	/nfs/dbraw/zinc/44/26/94/593442694.db2.gz	NARLALXELAOFRL-SECBINFHSA-N	-1	3	346.386	1.379	20	5		EDBDHM
COC(=O)CCCO[N-]C(=O)c1cccc(SC)c1[N+](=O)[O-]	ZINC000811562755	593473915	/nfs/dbraw/zinc/47/39/15/593473915.db2.gz	WAZOPENWTZQRBB-UHFFFAOYSA-N	-1	3	328.346	1.931	20	5		EDBDHM
COC(=O)c1cc(C(=O)OCCOc2cccc([N+](=O)[O-])c2)c[n-]1	ZINC000814531221	593592168	/nfs/dbraw/zinc/59/21/68/593592168.db2.gz	BZMNPZYGHWJVGX-UHFFFAOYSA-N	-1	3	334.284	1.945	20	5		EDBDHM
COCCOC[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000821692258	593917399	/nfs/dbraw/zinc/91/73/99/593917399.db2.gz	SJFNVCMYZFPMGX-LLVKDONJSA-N	-1	3	348.363	1.264	20	5		EDBDHM
COCCOC[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1	ZINC000821692258	593917400	/nfs/dbraw/zinc/91/74/00/593917400.db2.gz	SJFNVCMYZFPMGX-LLVKDONJSA-N	-1	3	348.363	1.264	20	5		EDBDHM
COc1ccc(CNCc2ccc(-c3nnn[n-]3)o2)cc1[N+](=O)[O-]	ZINC000821817969	593947859	/nfs/dbraw/zinc/94/78/59/593947859.db2.gz	DYDKYSDAOBLCRH-UHFFFAOYSA-N	-1	3	330.304	1.666	20	5		EDBDHM
COc1ccc(CNCc2ccc(-c3nn[n-]n3)o2)cc1[N+](=O)[O-]	ZINC000821817969	593947860	/nfs/dbraw/zinc/94/78/60/593947860.db2.gz	DYDKYSDAOBLCRH-UHFFFAOYSA-N	-1	3	330.304	1.666	20	5		EDBDHM
CC(C)[C@@H](O)C1(CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1	ZINC000824199012	593953781	/nfs/dbraw/zinc/95/37/81/593953781.db2.gz	GBMDGHTWEHSCJI-CYBMUJFWSA-N	-1	3	332.364	1.984	20	5		EDBDHM
CC(C)[C@@H](O)C1(CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1	ZINC000824199012	593953783	/nfs/dbraw/zinc/95/37/83/593953783.db2.gz	GBMDGHTWEHSCJI-CYBMUJFWSA-N	-1	3	332.364	1.984	20	5		EDBDHM
CCN(CC)C(=S)Sc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000821175593	593983517	/nfs/dbraw/zinc/98/35/17/593983517.db2.gz	PCGYXRYAKHBYPS-UHFFFAOYSA-N	-1	3	339.406	1.889	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N3CCC[C@H]3CO)cc(-c3nnn[n-]3)c2c1	ZINC000823645163	594224298	/nfs/dbraw/zinc/22/42/98/594224298.db2.gz	OWADUBXXZPLCEL-JTQLQIEISA-N	-1	3	341.331	1.284	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N3CCC[C@H]3CO)cc(-c3nn[n-]n3)c2c1	ZINC000823645163	594224299	/nfs/dbraw/zinc/22/42/99/594224299.db2.gz	OWADUBXXZPLCEL-JTQLQIEISA-N	-1	3	341.331	1.284	20	5		EDBDHM
CN(CCNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)c1ccccc1	ZINC000825941602	594286854	/nfs/dbraw/zinc/28/68/54/594286854.db2.gz	LEDJVYQHFUFTSI-UHFFFAOYSA-N	-1	3	340.347	1.718	20	5		EDBDHM
CN(CCNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)c1ccccc1	ZINC000825941602	594286855	/nfs/dbraw/zinc/28/68/55/594286855.db2.gz	LEDJVYQHFUFTSI-UHFFFAOYSA-N	-1	3	340.347	1.718	20	5		EDBDHM
COc1ccc(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cc1[N+](=O)[O-]	ZINC000826201036	594376028	/nfs/dbraw/zinc/37/60/28/594376028.db2.gz	VCJHUZBSDLAHHM-UHFFFAOYSA-N	-1	3	343.303	1.042	20	5		EDBDHM
COc1ccc(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cc1[N+](=O)[O-]	ZINC000826201036	594376030	/nfs/dbraw/zinc/37/60/30/594376030.db2.gz	VCJHUZBSDLAHHM-UHFFFAOYSA-N	-1	3	343.303	1.042	20	5		EDBDHM
Cc1nccn1CCCN(C)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000826330816	594428977	/nfs/dbraw/zinc/42/89/77/594428977.db2.gz	JAHCXNLCGVVKIL-UHFFFAOYSA-N	-1	3	342.363	1.806	20	5		EDBDHM
Cc1nccn1CCCN(C)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000826330816	594428978	/nfs/dbraw/zinc/42/89/78/594428978.db2.gz	JAHCXNLCGVVKIL-UHFFFAOYSA-N	-1	3	342.363	1.806	20	5		EDBDHM
Cc1nnc(CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])n1C1CC1	ZINC000826335217	594431740	/nfs/dbraw/zinc/43/17/40/594431740.db2.gz	DCMTTYAPQXGNFZ-UHFFFAOYSA-N	-1	3	341.335	1.622	20	5		EDBDHM
Cc1nnc(CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])n1C1CC1	ZINC000826335217	594431741	/nfs/dbraw/zinc/43/17/41/594431741.db2.gz	DCMTTYAPQXGNFZ-UHFFFAOYSA-N	-1	3	341.335	1.622	20	5		EDBDHM
CC[C@@](C)(CC(=O)[O-])NCC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000828658499	594474299	/nfs/dbraw/zinc/47/42/99/594474299.db2.gz	VYHKTUZNKZBKEU-HNNXBMFYSA-N	-1	3	339.348	1.775	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CC[C@H]([C@H]3CCOC3)C2)c(-c2nnn[n-]2)c1	ZINC000826498491	594503001	/nfs/dbraw/zinc/50/30/01/594503001.db2.gz	XDAPGHBHQJGRJZ-QWRGUYRKSA-N	-1	3	330.348	1.638	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CC[C@H]([C@H]3CCOC3)C2)c(-c2nn[n-]n2)c1	ZINC000826498491	594503002	/nfs/dbraw/zinc/50/30/02/594503002.db2.gz	XDAPGHBHQJGRJZ-QWRGUYRKSA-N	-1	3	330.348	1.638	20	5		EDBDHM
CNC(=O)C[C@H](C)[N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl	ZINC000832484217	594753623	/nfs/dbraw/zinc/75/36/23/594753623.db2.gz	QTEKUDUWZZXWFC-QMMMGPOBSA-N	-1	3	349.796	1.360	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@H]2CCCC(F)(F)[C@@H]2O)cs1	ZINC000841567900	594924190	/nfs/dbraw/zinc/92/41/90/594924190.db2.gz	WZDCRYPBLQBVCG-IONNQARKSA-N	-1	3	342.345	1.483	20	5		EDBDHM
O=C([O-])[C@@H](O)C1CCN(CCCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000833770966	594926122	/nfs/dbraw/zinc/92/61/22/594926122.db2.gz	RZIUUGJWVBMFIF-HNNXBMFYSA-N	-1	3	338.360	1.521	20	5		EDBDHM
C[C@@H](C(=O)[N-]OC1CCN(C)CC1)c1ccc([N+](=O)[O-])cc1F	ZINC000846650049	595293236	/nfs/dbraw/zinc/29/32/36/595293236.db2.gz	MJVLYLKMSSZZOL-SNVBAGLBSA-N	-1	3	325.340	1.979	20	5		EDBDHM
Cc1cc(NC[C@@H]2CN3CCC[C@H]3CO2)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000844208143	595302643	/nfs/dbraw/zinc/30/26/43/595302643.db2.gz	ICPSYOHHLOUCPD-NWDGAFQWSA-N	-1	3	335.360	1.877	20	5		EDBDHM
O=C([N-][C@H]1CCNC(=O)CC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848590105	595411422	/nfs/dbraw/zinc/41/14/22/595411422.db2.gz	BBPGWMBOBPFMGG-SECBINFHSA-N	-1	3	343.286	1.351	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H]2c3ccccc3C[C@@H]2O)cs1	ZINC000120045585	596239819	/nfs/dbraw/zinc/23/98/19/596239819.db2.gz	UELYMLAEHVLCAR-WCQYABFASA-N	-1	3	340.382	1.593	20	5		EDBDHM
CCn1nncc1C[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000862361998	596310369	/nfs/dbraw/zinc/31/03/69/596310369.db2.gz	PVUZYXXZYGUOCS-UHFFFAOYSA-N	-1	3	325.275	1.614	20	5		EDBDHM
COCC1CC([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)C1	ZINC000867839524	596580569	/nfs/dbraw/zinc/58/05/69/596580569.db2.gz	DSCFUCYNDVUEAH-UHFFFAOYSA-N	-1	3	332.353	1.746	20	5		EDBDHM
C[C@](O)(C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)c1ccccc1	ZINC000119821128	596745335	/nfs/dbraw/zinc/74/53/35/596745335.db2.gz	BMQONKGJGGOWGD-ZDUSSCGKSA-N	-1	3	342.398	1.842	20	5		EDBDHM
C[C@@H]1CCCN(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000066333476	215035096	/nfs/dbraw/zinc/03/50/96/215035096.db2.gz	OSAGVNJFMSVYST-SNVBAGLBSA-N	-1	3	333.435	1.667	20	5		EDBDHM
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000184069198	235297865	/nfs/dbraw/zinc/29/78/65/235297865.db2.gz	UMQXOAYKRAPTFV-LBPRGKRZSA-N	-1	3	336.392	1.056	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H](C)c2cnn(C)c2)cc1[N+](=O)[O-]	ZINC000124543656	138327620	/nfs/dbraw/zinc/32/76/20/138327620.db2.gz	KFRQFNXVHABJAL-SSDOTTSWSA-N	-1	3	330.391	1.738	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@@H](C)[S@](C)=O)c1C	ZINC000124004530	138323032	/nfs/dbraw/zinc/32/30/32/138323032.db2.gz	GAKVOMZFTZPQEQ-LADRHHBVSA-N	-1	3	348.446	1.647	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCC[S@](C)=O)cc1[N+](=O)[O-]	ZINC000124088919	138323708	/nfs/dbraw/zinc/32/37/08/138323708.db2.gz	KLUYLEWBHUAFJA-GOSISDBHSA-N	-1	3	326.421	1.012	20	5		EDBDHM
Nc1c(C(=O)Nc2cccc(-c3nnn[n-]3)c2)cc(F)cc1[N+](=O)[O-]	ZINC000125657715	138335379	/nfs/dbraw/zinc/33/53/79/138335379.db2.gz	LLLCHKBZNCTOKM-UHFFFAOYSA-N	-1	3	343.278	1.749	20	5		EDBDHM
Nc1c(C(=O)Nc2cccc(-c3nn[n-]n3)c2)cc(F)cc1[N+](=O)[O-]	ZINC000125657715	138335380	/nfs/dbraw/zinc/33/53/80/138335380.db2.gz	LLLCHKBZNCTOKM-UHFFFAOYSA-N	-1	3	343.278	1.749	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CC[C@@H](C)[S@](C)=O)cc1[N+](=O)[O-]	ZINC000125658915	138335384	/nfs/dbraw/zinc/33/53/84/138335384.db2.gz	PKVZNJKEUHESIX-QOLSBQFWSA-N	-1	3	340.448	1.400	20	5		EDBDHM
CCO[N-]C(=O)c1cc([N+](=O)[O-])ccc1I	ZINC000033226732	212908176	/nfs/dbraw/zinc/90/81/76/212908176.db2.gz	QUBFYKLMAHZHNY-UHFFFAOYSA-N	-1	3	336.085	1.881	20	5		EDBDHM
COCCN1CCC(Nc2nc(C)cc(C(=O)[O-])c2[N+](=O)[O-])CC1	ZINC000568399677	306481051	/nfs/dbraw/zinc/48/10/51/306481051.db2.gz	XOIQMOAHFZINBG-UHFFFAOYSA-N	-1	3	338.364	1.519	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1ncoc1C	ZINC000090446672	217930629	/nfs/dbraw/zinc/93/06/29/217930629.db2.gz	WMAPDUYIWMGDHN-UHFFFAOYSA-N	-1	3	327.318	1.378	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H]1NCCc2ccccc21	ZINC000261725642	139220803	/nfs/dbraw/zinc/22/08/03/139220803.db2.gz	RECCURCBFKNORK-AWEZNQCLSA-N	-1	3	347.396	1.760	20	5		EDBDHM
NC(=O)c1ccc(CN2CCCC[C@@H]2CCC(=O)[O-])c([N+](=O)[O-])c1	ZINC000261798445	139226981	/nfs/dbraw/zinc/22/69/81/139226981.db2.gz	ZSJVPWKQRVTSCC-CYBMUJFWSA-N	-1	3	335.360	1.913	20	5		EDBDHM
O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)[N-]C[C@@H]1C[C@H](F)CN1	ZINC000368639488	285155046	/nfs/dbraw/zinc/15/50/46/285155046.db2.gz	VPYDZZPEKJYMJA-YUMQZZPRSA-N	-1	3	337.760	1.227	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC(=O)OCC1CC1	ZINC000263692803	139353276	/nfs/dbraw/zinc/35/32/76/139353276.db2.gz	RTDFTTOVGWHAQK-UHFFFAOYSA-N	-1	3	328.346	1.135	20	5		EDBDHM
CS(=O)(=O)c1cc([N-]C(=O)c2n[nH]cc2[N+](=O)[O-])ccc1Cl	ZINC000487280151	255028743	/nfs/dbraw/zinc/02/87/43/255028743.db2.gz	PZVVQBAIRIBKDV-UHFFFAOYSA-N	-1	3	344.736	1.627	20	5		EDBDHM
Cn1[n-]c([C@H]2CCCN2C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)nc1=N	ZINC000493314985	255203570	/nfs/dbraw/zinc/20/35/70/255203570.db2.gz	FAGDUIRZTGWAFL-OYVUYXNMSA-N	-1	3	342.359	1.513	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCC[C@H](C)CO)cc1C	ZINC000270245914	140066629	/nfs/dbraw/zinc/06/66/29/140066629.db2.gz	MHPYGSKVMWNLQW-JTQLQIEISA-N	-1	3	330.406	1.899	20	5		EDBDHM
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)Nc1ccccc1[O-]	ZINC000340116415	142270584	/nfs/dbraw/zinc/27/05/84/142270584.db2.gz	ADMWMURHHXMVKP-UHFFFAOYSA-N	-1	3	341.279	1.535	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H](CO)C(C)C)c([N+](=O)[O-])c1	ZINC000344807424	143014031	/nfs/dbraw/zinc/01/40/31/143014031.db2.gz	JERRFYMTKZRMRX-JTQLQIEISA-N	-1	3	332.378	1.146	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1ccoc1	ZINC000345282154	143073086	/nfs/dbraw/zinc/07/30/86/143073086.db2.gz	ZAKLFMNKMUFNIT-UHFFFAOYSA-N	-1	3	340.313	1.453	20	5		EDBDHM
NS(=O)(=O)c1ccc(C(=O)[N-]c2cc(F)cc([N+](=O)[O-])c2)nc1	ZINC000345710086	143124131	/nfs/dbraw/zinc/12/41/31/143124131.db2.gz	RRMKGGLZHPLBMX-UHFFFAOYSA-N	-1	3	340.292	1.029	20	5		EDBDHM
Cc1ccc([O-])c(NC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)n1	ZINC000345986724	143154234	/nfs/dbraw/zinc/15/42/34/143154234.db2.gz	OEZYZCGJTYCBHE-UHFFFAOYSA-N	-1	3	330.300	1.372	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCc2cscn2)c([N+](=O)[O-])c1	ZINC000357674606	151111809	/nfs/dbraw/zinc/11/18/09/151111809.db2.gz	LKBPNPOHCKNZBQ-UHFFFAOYSA-N	-1	3	327.387	1.881	20	5		EDBDHM
COc1ccc([N-]C(=O)c2cn([C@@H]3CCOC3)nn2)c([N+](=O)[O-])c1	ZINC000357787094	151152040	/nfs/dbraw/zinc/15/20/40/151152040.db2.gz	JKZXVDNQAYXSMY-SECBINFHSA-N	-1	3	333.304	1.409	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCc2ncccc2[O-])cc1C	ZINC000360011264	151885305	/nfs/dbraw/zinc/88/53/05/151885305.db2.gz	MWPRKARSVCVYBS-UHFFFAOYSA-N	-1	3	337.357	1.791	20	5		EDBDHM
Cn1nnnc1-c1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000364425899	153233989	/nfs/dbraw/zinc/23/39/89/153233989.db2.gz	PLCPAOIAYXQBLB-UHFFFAOYSA-N	-1	3	341.287	1.138	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)c2ncn(C)n2)cc1C	ZINC000275645540	268368250	/nfs/dbraw/zinc/36/82/50/268368250.db2.gz	LABYRFFCIUMRGS-JTQLQIEISA-N	-1	3	339.377	1.380	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CC=CCC1	ZINC000276249091	273155127	/nfs/dbraw/zinc/15/51/27/273155127.db2.gz	RRXLTTKFIFYSNL-SNVBAGLBSA-N	-1	3	340.357	1.768	20	5		EDBDHM
CO[C@H]1C[C@@H](CN2CCCC2)N(C(=O)c2cccc([O-])c2[N+](=O)[O-])C1	ZINC000286581781	288039343	/nfs/dbraw/zinc/03/93/43/288039343.db2.gz	ZKZOLFRLQGAVKF-STQMWFEESA-N	-1	3	349.387	1.626	20	5		EDBDHM
C[C@@]1(C[C@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2)NC(=O)[N-]C1=O	ZINC000287739684	288310761	/nfs/dbraw/zinc/31/07/61/288310761.db2.gz	GFCBMTJNLSPCLP-WBMJQRKESA-N	-1	3	346.343	1.188	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2snnc2C)c([N+](=O)[O-])c1	ZINC000291613418	289125908	/nfs/dbraw/zinc/12/59/08/289125908.db2.gz	BMMWIJAJFWZIRS-UHFFFAOYSA-N	-1	3	344.374	1.242	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CN(C2CC2)C[C@H]1C	ZINC000331586704	302049263	/nfs/dbraw/zinc/04/92/63/302049263.db2.gz	XFRBLNQDWAQRCE-DGCLKSJQSA-N	-1	3	339.417	1.664	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]CC1=CCOCC1	ZINC000451677595	305361604	/nfs/dbraw/zinc/36/16/04/305361604.db2.gz	VBQSTBBNPNWFFY-UHFFFAOYSA-N	-1	3	332.765	1.873	20	5		EDBDHM
O=C(NCCNc1ccccc1[N+](=O)[O-])c1ccc2n[n-]nc2c1	ZINC000045621446	441009463	/nfs/dbraw/zinc/00/94/63/441009463.db2.gz	BSNFBXBBXRODJI-UHFFFAOYSA-N	-1	3	326.316	1.708	20	5		EDBDHM
CCC[C@](C)([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000046800011	441124984	/nfs/dbraw/zinc/12/49/84/441124984.db2.gz	HPXLQCWBXSGEPM-ZDUSSCGKSA-N	-1	3	330.362	1.605	20	5		EDBDHM
O=C(Nc1ccc(N2CCCC2)cn1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000025663996	441352816	/nfs/dbraw/zinc/35/28/16/441352816.db2.gz	UMIXRWVUNLLZEI-UHFFFAOYSA-N	-1	3	329.316	1.531	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCCOC(C)C	ZINC000030494726	441493839	/nfs/dbraw/zinc/49/38/39/441493839.db2.gz	WGYRKTHSIAYJFE-UHFFFAOYSA-N	-1	3	332.378	1.697	20	5		EDBDHM
CS(=O)(=O)[N-]c1ccc(C(=O)NCc2ccccc2[N+](=O)[O-])cc1	ZINC000053866944	441546186	/nfs/dbraw/zinc/54/61/86/441546186.db2.gz	PRXHHNDHRIQPBB-UHFFFAOYSA-N	-1	3	349.368	1.896	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1C[C@H](C)N(C2CC2)C1	ZINC000126301742	442096840	/nfs/dbraw/zinc/09/68/40/442096840.db2.gz	NOYPBYGVDCMLBF-NWDGAFQWSA-N	-1	3	339.417	1.807	20	5		EDBDHM
Cc1cnccc1CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000167681522	442222457	/nfs/dbraw/zinc/22/24/57/442222457.db2.gz	XJONZLJGEYKKKX-UHFFFAOYSA-N	-1	3	339.348	1.958	20	5		EDBDHM
COCCN(C)CC[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000155537603	442406193	/nfs/dbraw/zinc/40/61/93/442406193.db2.gz	DWKKUCPIYHXWME-UHFFFAOYSA-N	-1	3	345.421	1.068	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C(C)(C)CC(N)=O)cc1C	ZINC000186707020	442596838	/nfs/dbraw/zinc/59/68/38/442596838.db2.gz	RRLOQENKLNPWPL-UHFFFAOYSA-N	-1	3	329.378	1.144	20	5		EDBDHM
O=C(c1ccc(O)cc1[O-])N1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000192828080	442690626	/nfs/dbraw/zinc/69/06/26/442690626.db2.gz	ZLTSDQUVXQGQAC-UHFFFAOYSA-N	-1	3	343.339	1.968	20	5		EDBDHM
C[C@@H]1CCCCN1CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000193880627	442804441	/nfs/dbraw/zinc/80/44/41/442804441.db2.gz	BJZHEJYFLKZQQR-LLVKDONJSA-N	-1	3	345.396	1.887	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)n[n-]1	ZINC000183281250	442915922	/nfs/dbraw/zinc/91/59/22/442915922.db2.gz	AMJANEHBRPNDLJ-UHFFFAOYSA-N	-1	3	332.316	1.984	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)[n-]n1	ZINC000183281250	442915927	/nfs/dbraw/zinc/91/59/27/442915927.db2.gz	AMJANEHBRPNDLJ-UHFFFAOYSA-N	-1	3	332.316	1.984	20	5		EDBDHM
CC[C@H](C)[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)OC	ZINC000295179365	318635473	/nfs/dbraw/zinc/63/54/73/318635473.db2.gz	BMZHGWZSISIKSX-GWCFXTLKSA-N	-1	3	346.405	1.943	20	5		EDBDHM
CC(C)(CO)CC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000386276093	319129429	/nfs/dbraw/zinc/12/94/29/319129429.db2.gz	NCIAFMOOXZBDHO-UHFFFAOYSA-N	-1	3	336.797	1.935	20	5		EDBDHM
CO[C@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C12CCC2	ZINC000416564862	319445305	/nfs/dbraw/zinc/44/53/05/319445305.db2.gz	SACHXIYDZSOAKT-OLZOCXBDSA-N	-1	3	344.364	1.970	20	5		EDBDHM
CCN(C)C(=O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000185995165	443296144	/nfs/dbraw/zinc/29/61/44/443296144.db2.gz	BIFKBDMYLIWIRC-UHFFFAOYSA-N	-1	3	335.769	1.005	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCO1	ZINC000278627828	443383600	/nfs/dbraw/zinc/38/36/00/443383600.db2.gz	DZKOVYMVNAKNDB-NEPJUHHUSA-N	-1	3	348.352	1.206	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2(CC(N)=O)CC2)cc1C	ZINC000420704914	319637995	/nfs/dbraw/zinc/63/79/95/319637995.db2.gz	NDSDLZMWMNMLSJ-UHFFFAOYSA-N	-1	3	341.389	1.146	20	5		EDBDHM
CC[C@@H](O)C[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000420751031	319645425	/nfs/dbraw/zinc/64/54/25/319645425.db2.gz	VRGIWLDBBGGEQU-MRVPVSSYSA-N	-1	3	342.295	1.663	20	5		EDBDHM
Cc1cc([C@H]2CCCN(C(=O)c3cc([N+](=O)[O-])c[n-]c3=O)C2)n[nH]1	ZINC000282829894	443445002	/nfs/dbraw/zinc/44/50/02/443445002.db2.gz	QHYFQDXKIQHBHF-JTQLQIEISA-N	-1	3	331.332	1.747	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)[C@H](O)C(F)F	ZINC000451717805	320238694	/nfs/dbraw/zinc/23/86/94/320238694.db2.gz	TWSHDLGHCVSCCI-QWRGUYRKSA-N	-1	3	338.332	1.419	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCN2CC=CCC2)c1[N+](=O)[O-]	ZINC000280271968	443688023	/nfs/dbraw/zinc/68/80/23/443688023.db2.gz	OVPLSUHFLAQYBI-UHFFFAOYSA-N	-1	3	339.417	1.752	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ncnn1C	ZINC000276745315	443810519	/nfs/dbraw/zinc/81/05/19/443810519.db2.gz	SFUGVWSFYBRPJO-ZETCQYMHSA-N	-1	3	345.768	1.416	20	5		EDBDHM
CC(C)N1CCC[C@H]([N-]S(=O)(=O)c2cccnc2[N+](=O)[O-])C1	ZINC000562432769	321058035	/nfs/dbraw/zinc/05/80/35/321058035.db2.gz	UYHWVBPSAHBDOP-NSHDSACASA-N	-1	3	328.394	1.141	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C2CCSCC2)c([N+](=O)[O-])c1	ZINC000299615240	444095297	/nfs/dbraw/zinc/09/52/97/444095297.db2.gz	VPPMNUYMZAPBMH-UHFFFAOYSA-N	-1	3	332.403	1.777	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2CCCN(C)C2)c1[N+](=O)[O-]	ZINC000616411618	450413240	/nfs/dbraw/zinc/41/32/40/450413240.db2.gz	DMIDPHOBTBZGMF-LBPRGKRZSA-N	-1	3	327.406	1.584	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CC[C@H](OC)C2)c([N+](=O)[O-])c1	ZINC000331014141	444359388	/nfs/dbraw/zinc/35/93/88/444359388.db2.gz	UBQXBSMOXNJMJI-ZJUUUORDSA-N	-1	3	330.362	1.449	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCC[C@]1(C)CO	ZINC000331164959	444426722	/nfs/dbraw/zinc/42/67/22/444426722.db2.gz	HLDLQPKDJSVRNB-ZIAGYGMSSA-N	-1	3	344.389	1.433	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC(=O)Nc2ccccc2)c([N+](=O)[O-])c1	ZINC000337915001	444458410	/nfs/dbraw/zinc/45/84/10/444458410.db2.gz	OAUGXOXMMUWUNR-UHFFFAOYSA-N	-1	3	349.368	1.820	20	5		EDBDHM
CCC[C@H](C)[C@H](CO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000581256214	322156299	/nfs/dbraw/zinc/15/62/99/322156299.db2.gz	WCGPUICXQHODPI-JQWIXIFHSA-N	-1	3	346.405	1.679	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CCC[C@H]1OC	ZINC000341207285	444728890	/nfs/dbraw/zinc/72/88/90/444728890.db2.gz	XNNZKSAWVMZPEQ-ZYHUDNBSSA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2C[C@H](O)C2(C)C)c1[N+](=O)[O-]	ZINC000190169044	533706311	/nfs/dbraw/zinc/70/63/11/533706311.db2.gz	HKFAHRNANUIVRF-MNOVXSKESA-N	-1	3	328.390	1.649	20	5		EDBDHM
CCOC(=O)[C@@H](C)[C@@H](C)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000344194248	444833181	/nfs/dbraw/zinc/83/31/81/444833181.db2.gz	ZVMKETAMVFOKFI-WDEREUQCSA-N	-1	3	344.389	1.769	20	5		EDBDHM
O=[N+]([O-])c1ccc(CC[N-]S(=O)(=O)c2cncc(F)c2)cc1	ZINC000339172181	445072120	/nfs/dbraw/zinc/07/21/20/445072120.db2.gz	NQTQBCVIXLTVHV-UHFFFAOYSA-N	-1	3	325.321	1.650	20	5		EDBDHM
NC(=O)[C@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000343271366	445171251	/nfs/dbraw/zinc/17/12/51/445171251.db2.gz	GXVLNHSBRILHIA-CYBMUJFWSA-N	-1	3	335.341	1.100	20	5		EDBDHM
CC[C@@](C)([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(=O)OC	ZINC000354623399	445318649	/nfs/dbraw/zinc/31/86/49/445318649.db2.gz	OQCQYCMLEJHCST-CYBMUJFWSA-N	-1	3	346.361	1.223	20	5		EDBDHM
CC(C)(C)n1cnc([N-]C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)n1	ZINC000355906394	445526068	/nfs/dbraw/zinc/52/60/68/445526068.db2.gz	BHKNTBGFEYTKMQ-UHFFFAOYSA-N	-1	3	329.320	2.070	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]c2ccc(=O)[nH]c2)cc1[N+](=O)[O-]	ZINC000357331533	445552202	/nfs/dbraw/zinc/55/22/02/445552202.db2.gz	RZZBTDAKVLWVIS-UHFFFAOYSA-N	-1	3	343.292	1.644	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2CC[C@@H](OC)C2)cc1[N+](=O)[O-]	ZINC000349971528	445738815	/nfs/dbraw/zinc/73/88/15/445738815.db2.gz	UWGLCFDZIPBYDC-DTWKUNHWSA-N	-1	3	348.352	1.588	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCSCCCO)c([N+](=O)[O-])c1	ZINC000443303899	447028658	/nfs/dbraw/zinc/02/86/58/447028658.db2.gz	IFVCIOPRIWYOAG-UHFFFAOYSA-N	-1	3	334.419	1.297	20	5		EDBDHM
Cn1c(=O)oc2c1cccc2NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000445146786	447174459	/nfs/dbraw/zinc/17/44/59/447174459.db2.gz	QKDVMOOAHZFCTD-UHFFFAOYSA-N	-1	3	330.256	1.393	20	5		EDBDHM
COC(=O)[C@H](CC1CC1)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000416596887	447657791	/nfs/dbraw/zinc/65/77/91/447657791.db2.gz	YIBPLWHOAZVIOJ-NSHDSACASA-N	-1	3	342.373	1.523	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000523694391	447901401	/nfs/dbraw/zinc/90/14/01/447901401.db2.gz	ONXWIJGOKLSZRT-SNVBAGLBSA-N	-1	3	329.316	1.318	20	5		EDBDHM
CN(C)[C@@]1(CNc2ncc(C(=O)[O-])cc2[N+](=O)[O-])CCSC1	ZINC000566917076	448585363	/nfs/dbraw/zinc/58/53/63/448585363.db2.gz	GKFRQZDWBOOZHI-CYBMUJFWSA-N	-1	3	326.378	1.537	20	5		EDBDHM
CC[C@H](C)C[C@@H](CO)[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000592085362	448672239	/nfs/dbraw/zinc/67/22/39/448672239.db2.gz	YXYOTPQVCMCZFC-QWRGUYRKSA-N	-1	3	346.405	1.679	20	5		EDBDHM
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCC[C@H]3CN(C)CC[C@H]32)n1	ZINC000521252716	448967217	/nfs/dbraw/zinc/96/72/17/448967217.db2.gz	MSIAYWBNCPKZFU-WCQYABFASA-N	-1	3	334.376	1.917	20	5		EDBDHM
CSc1ccc([N+](=O)[O-])c(C(=O)NCCCc2cc(=O)[nH][n-]2)c1	ZINC000588875927	448944615	/nfs/dbraw/zinc/94/46/15/448944615.db2.gz	MHZZRIIKTZXXNL-UHFFFAOYSA-N	-1	3	336.373	1.703	20	5		EDBDHM
CC(C)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)c1cccnc1	ZINC000593607367	449104813	/nfs/dbraw/zinc/10/48/13/449104813.db2.gz	FEORAPZSKWSRIS-UHFFFAOYSA-N	-1	3	336.373	1.641	20	5		EDBDHM
COC(=O)[C@@H](CCF)[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000593633374	449119694	/nfs/dbraw/zinc/11/96/94/449119694.db2.gz	OGURQPQCFDGVSZ-SSDOTTSWSA-N	-1	3	340.354	1.144	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H](CO)CC2CC2)c(Cl)c1	ZINC000611109762	449171805	/nfs/dbraw/zinc/17/18/05/449171805.db2.gz	FWESPGKFQPMVQO-VIFPVBQESA-N	-1	3	334.781	1.688	20	5		EDBDHM
CC(C)c1[nH]nc(C(=O)[N-]c2ncc(CCO)s2)c1[N+](=O)[O-]	ZINC000590372152	449139245	/nfs/dbraw/zinc/13/92/45/449139245.db2.gz	UIMGWIDEWRNYMY-UHFFFAOYSA-N	-1	3	325.350	1.685	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCN(C3CC3)C2)c(F)c1	ZINC000611107082	449170936	/nfs/dbraw/zinc/17/09/36/449170936.db2.gz	ZIPSOMDATVRXEZ-SECBINFHSA-N	-1	3	329.353	1.249	20	5		EDBDHM
CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000590399809	449147871	/nfs/dbraw/zinc/14/78/71/449147871.db2.gz	PCVPQYALXAGDMU-OCCSQVGLSA-N	-1	3	335.360	1.236	20	5		EDBDHM
O=C(c1cc(F)c[n-]c1=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000598659349	449523528	/nfs/dbraw/zinc/52/35/28/449523528.db2.gz	BVTYMLCLDJZYRQ-UHFFFAOYSA-N	-1	3	346.318	1.797	20	5		EDBDHM
CC[C@@H](CO)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594763120	449676941	/nfs/dbraw/zinc/67/69/41/449676941.db2.gz	VZQKXZZZGOGWGN-VIFPVBQESA-N	-1	3	325.346	1.192	20	5		EDBDHM
CN1CCC[C@H](CC[N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])C1	ZINC000594783863	449694123	/nfs/dbraw/zinc/69/41/23/449694123.db2.gz	PAYKVPXGNZGRNA-LLVKDONJSA-N	-1	3	328.394	1.000	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1C[C@H](O)C12CCC2	ZINC000594866248	449780097	/nfs/dbraw/zinc/78/00/97/449780097.db2.gz	UIKNHVSMYDPJCY-NEPJUHHUSA-N	-1	3	326.374	1.485	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1CCC[C@@H](C)O1	ZINC000594850667	449758488	/nfs/dbraw/zinc/75/84/88/449758488.db2.gz	FAAXZRIGUBFRFL-PWSUYJOCSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CN(C(C)C)C[C@H]2C)c([N+](=O)[O-])s1	ZINC000601359232	449873257	/nfs/dbraw/zinc/87/32/57/449873257.db2.gz	SCZRWBFQCIALJP-KOLCDFICSA-N	-1	3	347.462	1.972	20	5		EDBDHM
CCn1nccc1C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000595416011	450127587	/nfs/dbraw/zinc/12/75/87/450127587.db2.gz	PHTSLHXCNIQBQL-UHFFFAOYSA-N	-1	3	330.391	1.660	20	5		EDBDHM
CN(C)CCN(CC(=O)[O-])C(=O)c1cc2cc([N+](=O)[O-])ccc2o1	ZINC000610890976	450370151	/nfs/dbraw/zinc/37/01/51/450370151.db2.gz	GGKFSQKJWRRGPV-UHFFFAOYSA-N	-1	3	335.316	1.429	20	5		EDBDHM
C[C@@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2[O-])C(=O)N1c1cnn(C)c1	ZINC000742392220	579450634	/nfs/dbraw/zinc/45/06/34/579450634.db2.gz	NRISBITWMZAOML-YGRLFVJLSA-N	-1	3	345.359	1.318	20	5		EDBDHM
CCCCS(=O)(=O)[N-]CC(=O)OCc1c(F)cccc1[N+](=O)[O-]	ZINC000760689234	580036300	/nfs/dbraw/zinc/03/63/00/580036300.db2.gz	BYPQERVCMJVEQY-UHFFFAOYSA-N	-1	3	348.352	1.497	20	5		EDBDHM
C[C@@H](Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@H](C)N1CCOCC1	ZINC000736136769	578956194	/nfs/dbraw/zinc/95/61/94/578956194.db2.gz	HJZNTAURFDCUDL-MNOVXSKESA-N	-1	3	347.379	1.296	20	5		EDBDHM
C[C@@H](Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])[C@H](C)N1CCOCC1	ZINC000736136769	578956195	/nfs/dbraw/zinc/95/61/95/578956195.db2.gz	HJZNTAURFDCUDL-MNOVXSKESA-N	-1	3	347.379	1.296	20	5		EDBDHM
O=C(OCc1cc(=O)c([O-])co1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000736786893	579020136	/nfs/dbraw/zinc/02/01/36/579020136.db2.gz	KEAGMWSLRHVFJR-UHFFFAOYSA-N	-1	3	336.212	1.519	20	5		EDBDHM
Cc1cccc(C(=O)Nc2ccc(-c3nnn[n-]3)cn2)c1[N+](=O)[O-]	ZINC000737384946	579082218	/nfs/dbraw/zinc/08/22/18/579082218.db2.gz	NTXGCZBGZUHOBA-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cc1cccc(C(=O)Nc2ccc(-c3nn[n-]n3)cn2)c1[N+](=O)[O-]	ZINC000737384946	579082220	/nfs/dbraw/zinc/08/22/20/579082220.db2.gz	NTXGCZBGZUHOBA-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)OCc1ccccc1-c1nnn[n-]1	ZINC000737500734	579099168	/nfs/dbraw/zinc/09/91/68/579099168.db2.gz	PCZBTCVURFRMCH-UHFFFAOYSA-N	-1	3	340.299	1.835	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)OCc1ccccc1-c1nn[n-]n1	ZINC000737500734	579099169	/nfs/dbraw/zinc/09/91/69/579099169.db2.gz	PCZBTCVURFRMCH-UHFFFAOYSA-N	-1	3	340.299	1.835	20	5		EDBDHM
Cc1noc(C)c1C[C@H](C)Nc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000737536328	579106894	/nfs/dbraw/zinc/10/68/94/579106894.db2.gz	GBVJMHBPKHHBIS-ZETCQYMHSA-N	-1	3	344.335	1.818	20	5		EDBDHM
Cc1noc(C)c1C[C@H](C)Nc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000737536328	579106896	/nfs/dbraw/zinc/10/68/96/579106896.db2.gz	GBVJMHBPKHHBIS-ZETCQYMHSA-N	-1	3	344.335	1.818	20	5		EDBDHM
Cn1cc([C@H]2CCN(c3ccc(-c4nnn[n-]4)cc3[N+](=O)[O-])C2)cn1	ZINC000737602825	579118182	/nfs/dbraw/zinc/11/81/82/579118182.db2.gz	IROVIXGDEJSLNA-NSHDSACASA-N	-1	3	340.347	1.502	20	5		EDBDHM
Cn1cc([C@H]2CCN(c3ccc(-c4nn[n-]n4)cc3[N+](=O)[O-])C2)cn1	ZINC000737602825	579118183	/nfs/dbraw/zinc/11/81/83/579118183.db2.gz	IROVIXGDEJSLNA-NSHDSACASA-N	-1	3	340.347	1.502	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@H](O)c2ccccn2)cc1[N+](=O)[O-]	ZINC000767845911	580201890	/nfs/dbraw/zinc/20/18/90/580201890.db2.gz	ZLLXNELLKYXVOG-NSHDSACASA-N	-1	3	343.386	1.372	20	5		EDBDHM
CCOC(=O)N1CC[C@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000770282926	580257243	/nfs/dbraw/zinc/25/72/43/580257243.db2.gz	KCHMJPKIJNRYBE-QMMMGPOBSA-N	-1	3	349.390	1.165	20	5		EDBDHM
O=[N+]([O-])c1ccc[n-]c1=NNS(=O)(=O)c1cnc2ccccc2c1	ZINC000800838048	581059252	/nfs/dbraw/zinc/05/92/52/581059252.db2.gz	NVBKYLIDNCMGOD-UHFFFAOYSA-N	-1	3	345.340	1.843	20	5		EDBDHM
COc1c([O-])ccc(CN[C@@H](C)[C@H]2CN(C)CCO2)c1[N+](=O)[O-]	ZINC000893142404	590680089	/nfs/dbraw/zinc/68/00/89/590680089.db2.gz	AONPVTNQTOGIOP-GXFFZTMASA-N	-1	3	325.365	1.118	20	5		EDBDHM
COCCO[C@@H]1CCN(Cc2ccc([O-])c(OC)c2[N+](=O)[O-])C1	ZINC000893873380	591123706	/nfs/dbraw/zinc/12/37/06/591123706.db2.gz	HDRVJMCFABGHKO-GFCCVEGCSA-N	-1	3	326.349	1.546	20	5		EDBDHM
COCC[C@@H]1COCCN1Cc1ccc([O-])c(OC)c1[N+](=O)[O-]	ZINC000894571345	591348199	/nfs/dbraw/zinc/34/81/99/591348199.db2.gz	PPOJYWNHUKHDAQ-GFCCVEGCSA-N	-1	3	326.349	1.546	20	5		EDBDHM
CCC[C@@H](O)[C@@H](CO)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000839815377	593174606	/nfs/dbraw/zinc/17/46/06/593174606.db2.gz	AATSLAXETMLNSC-VXGBXAGGSA-N	-1	3	332.303	1.325	20	5		EDBDHM
Cc1cc(F)cc(C(=O)Nc2ccc(-c3nnn[n-]3)cn2)c1[N+](=O)[O-]	ZINC000822203381	594009474	/nfs/dbraw/zinc/00/94/74/594009474.db2.gz	QMVSSPQYIXCXSE-UHFFFAOYSA-N	-1	3	343.278	1.870	20	5		EDBDHM
Cc1cc(F)cc(C(=O)Nc2ccc(-c3nn[n-]n3)cn2)c1[N+](=O)[O-]	ZINC000822203381	594009476	/nfs/dbraw/zinc/00/94/76/594009476.db2.gz	QMVSSPQYIXCXSE-UHFFFAOYSA-N	-1	3	343.278	1.870	20	5		EDBDHM
Cc1nc(C)c(-c2nnn[n-]2)c(SCCn2ccc([N+](=O)[O-])n2)n1	ZINC000822428097	594047486	/nfs/dbraw/zinc/04/74/86/594047486.db2.gz	ZKARYOSGXUSPIZ-UHFFFAOYSA-N	-1	3	347.364	1.171	20	5		EDBDHM
Cc1nc(C)c(-c2nn[n-]n2)c(SCCn2ccc([N+](=O)[O-])n2)n1	ZINC000822428097	594047487	/nfs/dbraw/zinc/04/74/87/594047487.db2.gz	ZKARYOSGXUSPIZ-UHFFFAOYSA-N	-1	3	347.364	1.171	20	5		EDBDHM
Cc1nc(NC(=O)c2ccc(-c3nnn[n-]3)cn2)ccc1[N+](=O)[O-]	ZINC000822449984	594050660	/nfs/dbraw/zinc/05/06/60/594050660.db2.gz	XULBJDGOIBESPB-UHFFFAOYSA-N	-1	3	326.276	1.126	20	5		EDBDHM
Cc1nc(NC(=O)c2ccc(-c3nn[n-]n3)cn2)ccc1[N+](=O)[O-]	ZINC000822449984	594050662	/nfs/dbraw/zinc/05/06/62/594050662.db2.gz	XULBJDGOIBESPB-UHFFFAOYSA-N	-1	3	326.276	1.126	20	5		EDBDHM
C[C@@H](O)C[C@H](C)Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000824699466	594058164	/nfs/dbraw/zinc/05/81/64/594058164.db2.gz	SWPRCPCYRFIOMD-DTWKUNHWSA-N	-1	3	343.347	1.894	20	5		EDBDHM
C[C@@H](O)C[C@H](C)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000824699466	594058167	/nfs/dbraw/zinc/05/81/67/594058167.db2.gz	SWPRCPCYRFIOMD-DTWKUNHWSA-N	-1	3	343.347	1.894	20	5		EDBDHM
Cn1cc(-c2nnn[n-]2)cc1C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000822650585	594079604	/nfs/dbraw/zinc/07/96/04/594079604.db2.gz	VLYBDEJMZCIARO-UHFFFAOYSA-N	-1	3	331.267	1.505	20	5		EDBDHM
Cn1cc(-c2nn[n-]n2)cc1C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000822650585	594079605	/nfs/dbraw/zinc/07/96/05/594079605.db2.gz	VLYBDEJMZCIARO-UHFFFAOYSA-N	-1	3	331.267	1.505	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CC[C@]3(O)CCCC[C@H]3C2)c(-c2nnn[n-]2)c1	ZINC000823639741	594223787	/nfs/dbraw/zinc/22/37/87/594223787.db2.gz	GSVKYYCAWAPJBS-MEDUHNTESA-N	-1	3	344.375	1.906	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CC[C@]3(O)CCCC[C@H]3C2)c(-c2nn[n-]n2)c1	ZINC000823639741	594223788	/nfs/dbraw/zinc/22/37/88/594223788.db2.gz	GSVKYYCAWAPJBS-MEDUHNTESA-N	-1	3	344.375	1.906	20	5		EDBDHM
O=[N+]([O-])c1cnc(Sc2nnc3ccccn32)c(-c2nnn[n-]2)c1	ZINC000823650899	594224727	/nfs/dbraw/zinc/22/47/27/594224727.db2.gz	CZAILZKYUCPGPX-UHFFFAOYSA-N	-1	3	341.316	1.364	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCO[C@@H](c3ccco3)C2)c(-c2nnn[n-]2)c1	ZINC000823651805	594224867	/nfs/dbraw/zinc/22/48/67/594224867.db2.gz	RDQVDXQBNRILQL-GFCCVEGCSA-N	-1	3	343.303	1.341	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCO[C@@H](c3ccco3)C2)c(-c2nn[n-]n2)c1	ZINC000823651805	594224868	/nfs/dbraw/zinc/22/48/68/594224868.db2.gz	RDQVDXQBNRILQL-GFCCVEGCSA-N	-1	3	343.303	1.341	20	5		EDBDHM
CCOCCO[N-]C(=O)c1cc([N+](=O)[O-])ncc1Br	ZINC000828822302	594510494	/nfs/dbraw/zinc/51/04/94/594510494.db2.gz	HJZAYCMEPXWOAI-UHFFFAOYSA-N	-1	3	334.126	1.450	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCOC(=O)C1CC1	ZINC000841536640	594917693	/nfs/dbraw/zinc/91/76/93/594917693.db2.gz	BVAWLSAMDAGJDU-UHFFFAOYSA-N	-1	3	328.346	1.135	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CC[C@@](O)(C(F)(F)F)C1	ZINC000738360545	599118613	/nfs/dbraw/zinc/11/86/13/599118613.db2.gz	XWZMRLHDXLLZDN-NSHDSACASA-N	-1	3	344.253	1.278	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CC[C@@](O)(C(F)(F)F)C1	ZINC000738360545	599118616	/nfs/dbraw/zinc/11/86/16/599118616.db2.gz	XWZMRLHDXLLZDN-NSHDSACASA-N	-1	3	344.253	1.278	20	5		EDBDHM
O=C(Cc1ccc(F)cc1[N+](=O)[O-])NCc1nnc(C(F)(F)F)[n-]1	ZINC000845957204	595104727	/nfs/dbraw/zinc/10/47/27/595104727.db2.gz	MUQUVGQLLWHFLA-UHFFFAOYSA-N	-1	3	347.228	1.730	20	5		EDBDHM
O=C(Cc1ccc(F)cc1[N+](=O)[O-])NCc1n[n-]c(C(F)(F)F)n1	ZINC000845957204	595104731	/nfs/dbraw/zinc/10/47/31/595104731.db2.gz	MUQUVGQLLWHFLA-UHFFFAOYSA-N	-1	3	347.228	1.730	20	5		EDBDHM
O=C(Cc1ccc(F)cc1[N+](=O)[O-])NCc1nc(C(F)(F)F)n[n-]1	ZINC000845957204	595104736	/nfs/dbraw/zinc/10/47/36/595104736.db2.gz	MUQUVGQLLWHFLA-UHFFFAOYSA-N	-1	3	347.228	1.730	20	5		EDBDHM
Cc1cc(NC[C@H]2CN3CCC[C@H]3CO2)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000844209868	595303119	/nfs/dbraw/zinc/30/31/19/595303119.db2.gz	YCQFLMJQFSMZQB-STQMWFEESA-N	-1	3	335.360	1.877	20	5		EDBDHM
C[C@@H](Cn1cncn1)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848582424	595408954	/nfs/dbraw/zinc/40/89/54/595408954.db2.gz	KVDKXQDFBRQOIM-VIFPVBQESA-N	-1	3	341.274	1.363	20	5		EDBDHM
Cc1nccn1CC[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848583297	595409157	/nfs/dbraw/zinc/40/91/57/595409157.db2.gz	WPCXBAULPLWOPO-UHFFFAOYSA-N	-1	3	340.286	1.888	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@@H](n3cncn3)C2)c(-c2nnn[n-]2)c1	ZINC000738370823	598340155	/nfs/dbraw/zinc/34/01/55/598340155.db2.gz	QPYZWLYEQOESIK-LLVKDONJSA-N	-1	3	341.335	1.208	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@@H](n3cncn3)C2)c(-c2nn[n-]n2)c1	ZINC000738370823	598340157	/nfs/dbraw/zinc/34/01/57/598340157.db2.gz	QPYZWLYEQOESIK-LLVKDONJSA-N	-1	3	341.335	1.208	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCc2ccccc2O)c(-c2nnn[n-]2)c1	ZINC000738373317	598500084	/nfs/dbraw/zinc/50/00/84/598500084.db2.gz	ADQTZIOFLLWMQF-UHFFFAOYSA-N	-1	3	327.304	1.530	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCc2ccccc2O)c(-c2nn[n-]n2)c1	ZINC000738373317	598500086	/nfs/dbraw/zinc/50/00/86/598500086.db2.gz	ADQTZIOFLLWMQF-UHFFFAOYSA-N	-1	3	327.304	1.530	20	5		EDBDHM
O=C1NCCCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000056046802	214354895	/nfs/dbraw/zinc/35/48/95/214354895.db2.gz	NCVONHGCPXQEQJ-JTQLQIEISA-N	-1	3	347.780	1.195	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)nc1=N	ZINC000559259350	306252254	/nfs/dbraw/zinc/25/22/54/306252254.db2.gz	WAOFAOUJYYKIAT-NSHDSACASA-N	-1	3	334.311	1.252	20	5		EDBDHM
CS[C@H]1CN(c2nccc(C(=O)[O-])c2[N+](=O)[O-])C[C@@H]1N(C)C	ZINC000563205192	306323395	/nfs/dbraw/zinc/32/33/95/306323395.db2.gz	RUOULYKZPMZJBY-UWVGGRQHSA-N	-1	3	326.378	1.170	20	5		EDBDHM
Cc1ncc(CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)c(=O)[n-]1	ZINC000487023527	255023375	/nfs/dbraw/zinc/02/33/75/255023375.db2.gz	SMFOJLMAYBGYSI-UHFFFAOYSA-N	-1	3	338.270	1.536	20	5		EDBDHM
Cc1ccc(NC(=O)[C@@H]([N-]S(C)(=O)=O)C(C)(C)C)cc1[N+](=O)[O-]	ZINC000154188056	224216520	/nfs/dbraw/zinc/21/65/20/224216520.db2.gz	CTFCKVLTYXWVOH-GFCCVEGCSA-N	-1	3	343.405	1.806	20	5		EDBDHM
Cc1nnsc1C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000490414374	255087133	/nfs/dbraw/zinc/08/71/33/255087133.db2.gz	IDENDDOVQBTVLB-UHFFFAOYSA-N	-1	3	328.375	1.542	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@]2(O)CCSC2)c([N+](=O)[O-])c1	ZINC000331289456	141004077	/nfs/dbraw/zinc/00/40/77/141004077.db2.gz	OAIJBZIJTPGLQY-GFCCVEGCSA-N	-1	3	332.403	1.050	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCc2cnc(C)[n-]c2=O)c1	ZINC000345017753	143039839	/nfs/dbraw/zinc/03/98/39/143039839.db2.gz	VASLEPMIYGUILS-UHFFFAOYSA-N	-1	3	346.343	1.793	20	5		EDBDHM
COC(=O)CC1([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCC1	ZINC000352868956	149196522	/nfs/dbraw/zinc/19/65/22/149196522.db2.gz	FJSYMEWPFJNMON-UHFFFAOYSA-N	-1	3	328.346	1.359	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCc1ccco1	ZINC000355074234	150104964	/nfs/dbraw/zinc/10/49/64/150104964.db2.gz	BYLAWHZUHOFKDC-UHFFFAOYSA-N	-1	3	326.330	1.717	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000355327547	150219254	/nfs/dbraw/zinc/21/92/54/150219254.db2.gz	RCLIWWRJHNCHMW-BDAKNGLRSA-N	-1	3	334.781	1.952	20	5		EDBDHM
CCN1CC[C@H]2OCCN(C(=O)c3cccc([O-])c3[N+](=O)[O-])[C@@H]2C1	ZINC000355328893	150220006	/nfs/dbraw/zinc/22/00/06/150220006.db2.gz	YUNBBVJJVPSVGD-TZMCWYRMSA-N	-1	3	335.360	1.236	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2ncccc2C)c([N+](=O)[O-])c1	ZINC000355389659	150249466	/nfs/dbraw/zinc/24/94/66/150249466.db2.gz	JIDKIRRSDPIVRA-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@]2(C)CCCOC2)c([N+](=O)[O-])c1	ZINC000357416668	151026064	/nfs/dbraw/zinc/02/60/64/151026064.db2.gz	AFRVQOSDUIIYNT-ZDUSSCGKSA-N	-1	3	330.362	1.451	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CC[N-]S(=O)(=O)c1cncc(F)c1	ZINC000360893822	152243462	/nfs/dbraw/zinc/24/34/62/152243462.db2.gz	OPGPUMAQOKMSAD-UHFFFAOYSA-N	-1	3	325.321	1.650	20	5		EDBDHM
CN(C)CCN1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC1	ZINC000364391573	153225149	/nfs/dbraw/zinc/22/51/49/153225149.db2.gz	DDEOTPOBTURFNL-UHFFFAOYSA-N	-1	3	336.392	1.010	20	5		EDBDHM
C[C@@H](O)C[C@@H](C)C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000120790003	287365014	/nfs/dbraw/zinc/36/50/14/287365014.db2.gz	OFJWPOOJFORTID-RKDXNWHRSA-N	-1	3	336.797	1.934	20	5		EDBDHM
COCCCN1CCC(NC(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC1	ZINC000164491560	226077335	/nfs/dbraw/zinc/07/73/35/226077335.db2.gz	JJZDSTAAZABEML-UHFFFAOYSA-N	-1	3	337.376	1.531	20	5		EDBDHM
O=c1ccn(Cc2nc3c4ccccc4oc3c(=O)[n-]2)cc1[N+](=O)[O-]	ZINC000131080685	287505096	/nfs/dbraw/zinc/50/50/96/287505096.db2.gz	UYAXLEHFOKWGPZ-UHFFFAOYSA-N	-1	3	338.279	1.788	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CC2(O)CCCC2)cc1[N+](=O)[O-]	ZINC000275089965	268278951	/nfs/dbraw/zinc/27/89/51/268278951.db2.gz	QKVQPTSGMPRQKM-UHFFFAOYSA-N	-1	3	348.352	1.326	20	5		EDBDHM
COc1ccc([N-]C(=O)c2cn(CC3(C)COC3)nn2)c([N+](=O)[O-])c1	ZINC000273534779	273042137	/nfs/dbraw/zinc/04/21/37/273042137.db2.gz	ZUWVTAXPYWIQJG-UHFFFAOYSA-N	-1	3	347.331	1.484	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2CCOC[C@H]2C)c1[N+](=O)[O-]	ZINC000277747598	273222650	/nfs/dbraw/zinc/22/26/50/273222650.db2.gz	KNHQQHIFDRDXLR-VXGBXAGGSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)n(C)n1	ZINC000284579314	274251612	/nfs/dbraw/zinc/25/16/12/274251612.db2.gz	HAKADSZUSBRJGM-UHFFFAOYSA-N	-1	3	344.780	1.769	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1CCOC[C@@H]1C	ZINC000285742390	274635352	/nfs/dbraw/zinc/63/53/52/274635352.db2.gz	VZLKTDOXJQPJOA-QWRGUYRKSA-N	-1	3	344.389	1.554	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C)CO[C@H]1CCOC1	ZINC000267895340	302049370	/nfs/dbraw/zinc/04/93/70/302049370.db2.gz	UGTCWBLLIZTSNM-NEPJUHHUSA-N	-1	3	344.389	1.376	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@]1(O)CCC[C@@H]1C	ZINC000294367445	303097739	/nfs/dbraw/zinc/09/77/39/303097739.db2.gz	AXVJSEHUZPMVBO-SMDDNHRTSA-N	-1	3	328.390	1.733	20	5		EDBDHM
C[C@@H](CCCO)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000295456716	303222158	/nfs/dbraw/zinc/22/21/58/303222158.db2.gz	ZKAYGSPRKRTGRD-VIFPVBQESA-N	-1	3	336.797	1.935	20	5		EDBDHM
Cn1cnnc1[N-]C(=O)COc1ccc([N+](=O)[O-])c2cccnc12	ZINC000429473979	305030626	/nfs/dbraw/zinc/03/06/26/305030626.db2.gz	WLPAMPLNZIMTHM-UHFFFAOYSA-N	-1	3	328.288	1.289	20	5		EDBDHM
Cc1nc2ccc([N-]S(=O)(=O)Cc3ccccc3[N+](=O)[O-])cn2n1	ZINC000430362479	305051508	/nfs/dbraw/zinc/05/15/08/305051508.db2.gz	TYPMRRBDNNOEBX-UHFFFAOYSA-N	-1	3	347.356	1.888	20	5		EDBDHM
CO[C@H]1COCC[C@H]1C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000451770999	305368226	/nfs/dbraw/zinc/36/82/26/305368226.db2.gz	GQTPJTXYPPHVAP-AAEUAGOBSA-N	-1	3	344.389	1.233	20	5		EDBDHM
NC(=O)[C@@H]1CC[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000452053858	305380835	/nfs/dbraw/zinc/38/08/35/305380835.db2.gz	DZJOCPPDFWGWFM-SFYZADRCSA-N	-1	3	347.780	1.181	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)on1	ZINC000524945596	305821103	/nfs/dbraw/zinc/82/11/03/305821103.db2.gz	HUVGTESWTNJDMW-UHFFFAOYSA-N	-1	3	325.346	1.932	20	5		EDBDHM
CCOC(=O)Cc1csc([N-]C(=O)c2nn(C)cc2[N+](=O)[O-])n1	ZINC000138603044	441793688	/nfs/dbraw/zinc/79/36/88/441793688.db2.gz	OOZKRTIRFNNXGI-UHFFFAOYSA-N	-1	3	339.333	1.143	20	5		EDBDHM
CCNC(=O)C(C)(C)C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000120454741	442075753	/nfs/dbraw/zinc/07/57/53/442075753.db2.gz	RFGQCBVAUIDOCK-UHFFFAOYSA-N	-1	3	343.405	1.344	20	5		EDBDHM
O=[N+]([O-])c1cccc(CS(=O)(=O)[N-][C@H]2Cc3ccccc3[C@@H]2O)c1	ZINC000178717507	442462832	/nfs/dbraw/zinc/46/28/32/442462832.db2.gz	UXJWQXORQCPCAC-HOTGVXAUSA-N	-1	3	348.380	1.673	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]Cc2cccnc2)cc1[N+](=O)[O-]	ZINC000186176250	442478628	/nfs/dbraw/zinc/47/86/28/442478628.db2.gz	PCCWTJRCNKYMPA-UHFFFAOYSA-N	-1	3	341.320	1.616	20	5		EDBDHM
CS(=O)(=O)c1ccc(C(=O)[N-]c2ccncc2F)cc1[N+](=O)[O-]	ZINC000181823706	442718303	/nfs/dbraw/zinc/71/83/03/442718303.db2.gz	GYPSTDIVEBPCFF-UHFFFAOYSA-N	-1	3	339.304	1.785	20	5		EDBDHM
COc1cc(C(=O)Nc2nnc(SC)[n-]2)cc([N+](=O)[O-])c1OC	ZINC000265921965	442969649	/nfs/dbraw/zinc/96/96/49/442969649.db2.gz	CCDWTMJRCMPUMJ-UHFFFAOYSA-N	-1	3	339.333	1.704	20	5		EDBDHM
COc1cc(C(=O)Nc2nc(SC)n[n-]2)cc([N+](=O)[O-])c1OC	ZINC000265921965	442969650	/nfs/dbraw/zinc/96/96/50/442969650.db2.gz	CCDWTMJRCMPUMJ-UHFFFAOYSA-N	-1	3	339.333	1.704	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-][C@@H]1Cc2ccccc2[C@@H]1O	ZINC000184548866	443037831	/nfs/dbraw/zinc/03/78/31/443037831.db2.gz	YQJHNAJQVAMMMG-ZBFHGGJFSA-N	-1	3	348.380	1.673	20	5		EDBDHM
CCN1CCN(CCCNC(=O)c2ccc([N+](=O)[O-])cc2[O-])CC1	ZINC000184654586	443055702	/nfs/dbraw/zinc/05/57/02/443055702.db2.gz	XPOYGXQPOHGQLL-UHFFFAOYSA-N	-1	3	336.392	1.058	20	5		EDBDHM
CC(C)(C)OC(=O)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000266217289	443061637	/nfs/dbraw/zinc/06/16/37/443061637.db2.gz	RPGLHWGPELJFGP-UHFFFAOYSA-N	-1	3	348.352	1.744	20	5		EDBDHM
COC(=O)[C@H](C)C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000269295510	443271206	/nfs/dbraw/zinc/27/12/06/443271206.db2.gz	PPGMODWYVFLEGS-SECBINFHSA-N	-1	3	330.362	1.299	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCOCC2CC2)c([N+](=O)[O-])c1	ZINC000264523261	443314202	/nfs/dbraw/zinc/31/42/02/443314202.db2.gz	VYNMDHJGUVNRBL-UHFFFAOYSA-N	-1	3	330.362	1.308	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2([S@](C)=O)CC2)c1C	ZINC000282718115	443414432	/nfs/dbraw/zinc/41/44/32/443414432.db2.gz	ZCGRPEFEXKIAKY-NRFANRHFSA-N	-1	3	346.430	1.401	20	5		EDBDHM
CCCN1C[C@H](C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1=O	ZINC000420704082	319637470	/nfs/dbraw/zinc/63/74/70/319637470.db2.gz	IFQNYUQCINRRNH-NSHDSACASA-N	-1	3	341.389	1.132	20	5		EDBDHM
CC[C@@](C)([N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C(=O)OC	ZINC000276842656	443848699	/nfs/dbraw/zinc/84/86/99/443848699.db2.gz	QBCQEAWTZPLIBQ-CQSZACIVSA-N	-1	3	344.389	1.832	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@](C)(C(N)=O)C(C)C)c1[N+](=O)[O-]	ZINC000285450885	443989326	/nfs/dbraw/zinc/98/93/26/443989326.db2.gz	YNCCDFCJYVQFNP-AWEZNQCLSA-N	-1	3	343.405	1.390	20	5		EDBDHM
O=c1nc([C@@H]2CCCN(CCOc3cccc([N+](=O)[O-])c3)C2)[nH][n-]1	ZINC000289437452	444143689	/nfs/dbraw/zinc/14/36/89/444143689.db2.gz	OENBSQIKAWYWEE-LLVKDONJSA-N	-1	3	333.348	1.265	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CCCN(C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000342500847	444718800	/nfs/dbraw/zinc/71/88/00/444718800.db2.gz	DEGIFRVCLNUMFO-SCZZXKLOSA-N	-1	3	333.435	1.726	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1CCC[C@H]1OC	ZINC000341206749	444728775	/nfs/dbraw/zinc/72/87/75/444728775.db2.gz	XNNZKSAWVMZPEQ-CMPLNLGQSA-N	-1	3	344.389	1.697	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H]2CCC[C@@H]2OC)c([N+](=O)[O-])c1	ZINC000341221301	444736442	/nfs/dbraw/zinc/73/64/42/444736442.db2.gz	USMQKDZYJULUJI-MFKMUULPSA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCCN(C)[C@H]1C	ZINC000344068736	444763382	/nfs/dbraw/zinc/76/33/82/444763382.db2.gz	MLJIHLSSKMTUMB-NWDGAFQWSA-N	-1	3	327.406	1.664	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)C[C@H]2CCCO2)c([N+](=O)[O-])c1	ZINC000338725071	444822017	/nfs/dbraw/zinc/82/20/17/444822017.db2.gz	FYMBOUXNOCAXEK-CMPLNLGQSA-N	-1	3	344.389	1.839	20	5		EDBDHM
O=[N+]([O-])c1ccc(CS(=O)(=O)[N-]Cc2noc(C3CC3)n2)cc1	ZINC000343094830	445059743	/nfs/dbraw/zinc/05/97/43/445059743.db2.gz	GVVBPYQTUICMRB-UHFFFAOYSA-N	-1	3	338.345	1.475	20	5		EDBDHM
Cc1ncc(CNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])c(=O)[n-]1	ZINC000343607284	445260944	/nfs/dbraw/zinc/26/09/44/445260944.db2.gz	PICLAPSBKRZFBR-UHFFFAOYSA-N	-1	3	338.345	1.414	20	5		EDBDHM
CCn1cc(S(=O)(=O)[N-]CCc2cccc([N+](=O)[O-])c2)nc1C	ZINC000348342435	445261635	/nfs/dbraw/zinc/26/16/35/445261635.db2.gz	JITLJZIXBCLHJG-UHFFFAOYSA-N	-1	3	338.389	1.641	20	5		EDBDHM
COc1ccc(CNC(=O)NCc2cnc(C)[n-]c2=O)cc1[N+](=O)[O-]	ZINC000343631634	445271687	/nfs/dbraw/zinc/27/16/87/445271687.db2.gz	RIIFZDNOKCUEQA-UHFFFAOYSA-N	-1	3	347.331	1.407	20	5		EDBDHM
O=C([N-]c1n[nH]c2ccc([N+](=O)[O-])cc21)c1ncoc1[C@@H]1CCCO1	ZINC000354522439	445277725	/nfs/dbraw/zinc/27/77/25/445277725.db2.gz	SSYXWMDKTZAYHN-NSHDSACASA-N	-1	3	343.299	2.563	20	5		EDBDHM
O=C(c1ccc2n[n-]nc2c1)N1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000359642716	445352945	/nfs/dbraw/zinc/35/29/45/445352945.db2.gz	CQAFRMXLPOGDLU-UHFFFAOYSA-N	-1	3	339.311	1.901	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCc1ncccc1[O-]	ZINC000351893875	445360257	/nfs/dbraw/zinc/36/02/57/445360257.db2.gz	QZFBXCVTCCCISL-UHFFFAOYSA-N	-1	3	344.327	1.567	20	5		EDBDHM
COc1c([N-]C(=O)c2n[nH]cc2[N+](=O)[O-])cc(Cl)cc1C(N)=O	ZINC000357246545	445505229	/nfs/dbraw/zinc/50/52/29/445505229.db2.gz	PEVRISQIKYJZSW-UHFFFAOYSA-N	-1	3	339.695	1.331	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@]2(C)CCOC2)c1[N+](=O)[O-]	ZINC000360228680	445642258	/nfs/dbraw/zinc/64/22/58/445642258.db2.gz	UZELTVNFTZQDRK-CQSZACIVSA-N	-1	3	328.390	1.917	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C2(CC(N)=O)CCC2)c1C	ZINC000360220131	445636135	/nfs/dbraw/zinc/63/61/35/445636135.db2.gz	OGSHDLKLRFNXEQ-UHFFFAOYSA-N	-1	3	341.389	1.288	20	5		EDBDHM
Cc1ccc(NC(=O)[C@H]([N-]S(C)(=O)=O)C(C)C)cc1[N+](=O)[O-]	ZINC000349822186	445689872	/nfs/dbraw/zinc/68/98/72/445689872.db2.gz	VXZRKGGXFWRDAB-GFCCVEGCSA-N	-1	3	329.378	1.416	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]Cc1ccnc2ccnn21	ZINC000350620086	445857361	/nfs/dbraw/zinc/85/73/61/445857361.db2.gz	TYJBHYFJNWYZMR-UHFFFAOYSA-N	-1	3	333.329	1.116	20	5		EDBDHM
O=c1ccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)n[nH]1	ZINC000361852771	446006136	/nfs/dbraw/zinc/00/61/36/446006136.db2.gz	XRBDMOLRPQEUTP-UHFFFAOYSA-N	-1	3	330.709	1.545	20	5		EDBDHM
O=C([O-])c1cn(C2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)nn1	ZINC000583946008	326172069	/nfs/dbraw/zinc/17/20/69/326172069.db2.gz	MWYWHKIFNDJLBV-UHFFFAOYSA-N	-1	3	345.359	1.764	20	5		EDBDHM
COc1ccc([N+](=O)[O-])c(CC(=O)Nc2nnc(SC)[n-]2)c1F	ZINC000411762307	446670723	/nfs/dbraw/zinc/67/07/23/446670723.db2.gz	WJJSTRZNJXYPJO-UHFFFAOYSA-N	-1	3	341.324	1.764	20	5		EDBDHM
COc1ccc([N+](=O)[O-])c(CC(=O)Nc2nc(SC)n[n-]2)c1F	ZINC000411762307	446670732	/nfs/dbraw/zinc/67/07/32/446670732.db2.gz	WJJSTRZNJXYPJO-UHFFFAOYSA-N	-1	3	341.324	1.764	20	5		EDBDHM
COc1ccc([N+](=O)[O-])c(CC(=O)Nc2n[n-]c(SC)n2)c1F	ZINC000411762307	446670735	/nfs/dbraw/zinc/67/07/35/446670735.db2.gz	WJJSTRZNJXYPJO-UHFFFAOYSA-N	-1	3	341.324	1.764	20	5		EDBDHM
O=C(/C=C/c1cncc([O-])c1)N1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368406968	446842723	/nfs/dbraw/zinc/84/27/23/446842723.db2.gz	JFAPZUAJHKMCJQ-ITDFMYJTSA-N	-1	3	343.343	1.769	20	5		EDBDHM
CC[C@H](O)CCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000398497919	447559216	/nfs/dbraw/zinc/55/92/16/447559216.db2.gz	KMHLVSXDMXZALV-NSHDSACASA-N	-1	3	332.378	1.433	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCC[C@H]1OC	ZINC000451861384	447765822	/nfs/dbraw/zinc/76/58/22/447765822.db2.gz	AALAHQWNZKKXHR-GHMZBOCLSA-N	-1	3	330.362	1.449	20	5		EDBDHM
CC1(C)CCCN1CC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000452079591	447811818	/nfs/dbraw/zinc/81/18/18/447811818.db2.gz	ADVZUNGTSSFGSS-UHFFFAOYSA-N	-1	3	327.406	1.748	20	5		EDBDHM
CC[C@@H]1OCC[C@H]1[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000591331215	448325796	/nfs/dbraw/zinc/32/57/96/448325796.db2.gz	TVJGXSWDFBXMKF-KOLCDFICSA-N	-1	3	330.362	1.449	20	5		EDBDHM
COC[C@@]1(C(=O)[O-])CCCN(Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000574284406	448836023	/nfs/dbraw/zinc/83/60/23/448836023.db2.gz	AJYLXZOZOODHHZ-MRXNPFEDSA-N	-1	3	338.360	1.917	20	5		EDBDHM
COC(=O)c1cc([N-]C(=O)c2cn(C3CCC3)nn2)cc([N+](=O)[O-])c1	ZINC000592594600	448913736	/nfs/dbraw/zinc/91/37/36/448913736.db2.gz	LZPWEWJOMGKCPC-UHFFFAOYSA-N	-1	3	345.315	1.950	20	5		EDBDHM
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCC[C@@H]3CN(C)CC[C@@H]32)n1	ZINC000521252717	448967203	/nfs/dbraw/zinc/96/72/03/448967203.db2.gz	MSIAYWBNCPKZFU-YPMHNXCESA-N	-1	3	334.376	1.917	20	5		EDBDHM
COCC(C)(C)CCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593597391	449097950	/nfs/dbraw/zinc/09/79/50/449097950.db2.gz	WZONLJMSXQPWAY-UHFFFAOYSA-N	-1	3	331.394	1.721	20	5		EDBDHM
CC1(C)C[C@@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCO1	ZINC000593605536	449103272	/nfs/dbraw/zinc/10/32/72/449103272.db2.gz	IQGGWFNSMNQGJZ-JTQLQIEISA-N	-1	3	329.378	1.473	20	5		EDBDHM
CCCc1[nH]nc(C(=O)[N-]c2nc(CCO)cs2)c1[N+](=O)[O-]	ZINC000590393014	449145448	/nfs/dbraw/zinc/14/54/48/449145448.db2.gz	WSXIENDCZGZZPN-UHFFFAOYSA-N	-1	3	325.350	1.514	20	5		EDBDHM
CN1CCC[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000604278184	449201037	/nfs/dbraw/zinc/20/10/37/449201037.db2.gz	OEHVBNWLTNIWMV-SECBINFHSA-N	-1	3	333.797	1.621	20	5		EDBDHM
COc1cc(C(=O)NCCCc2cc(=O)[nH][n-]2)cc([N+](=O)[O-])c1C	ZINC000590549652	449185476	/nfs/dbraw/zinc/18/54/76/449185476.db2.gz	AVSOBJNNCATBLR-UHFFFAOYSA-N	-1	3	334.332	1.298	20	5		EDBDHM
Nc1c(C(=O)Nc2[nH][n-]c3cc(=O)ccc2-3)cc(F)cc1[N+](=O)[O-]	ZINC000590557781	449190482	/nfs/dbraw/zinc/19/04/82/449190482.db2.gz	JMFIJZDPVUKRCF-UHFFFAOYSA-N	-1	3	331.263	2.150	20	5		EDBDHM
CC[C@@H](CN1CCCC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593557444	449347669	/nfs/dbraw/zinc/34/76/69/449347669.db2.gz	DYTWRYUJRWITGG-NSHDSACASA-N	-1	3	328.394	1.143	20	5		EDBDHM
C[C@]1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCCC[C@@H]1O	ZINC000593562693	449352593	/nfs/dbraw/zinc/35/25/93/449352593.db2.gz	XIRYNDFBKCIJNY-WCQYABFASA-N	-1	3	329.378	1.209	20	5		EDBDHM
NC(=O)c1ccccc1N1CC[C@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C1	ZINC000596125371	449375906	/nfs/dbraw/zinc/37/59/06/449375906.db2.gz	PHGMALUAOJGOLM-JTQLQIEISA-N	-1	3	343.343	1.485	20	5		EDBDHM
CC(C)c1ccnc(N2CCN(c3cc[n-]c(=O)c3[N+](=O)[O-])CC2)n1	ZINC000596194661	449407016	/nfs/dbraw/zinc/40/70/16/449407016.db2.gz	IADXBMOJWDPHJI-UHFFFAOYSA-N	-1	3	344.375	1.935	20	5		EDBDHM
COCC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000594475390	449540109	/nfs/dbraw/zinc/54/01/09/449540109.db2.gz	ULCLZVMFYYQPPZ-UHFFFAOYSA-N	-1	3	334.781	1.953	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2C[C@@H](C)n3ncnc32)cc1[N+](=O)[O-]	ZINC000594805724	449717854	/nfs/dbraw/zinc/71/78/54/449717854.db2.gz	CFCHEARZGMCVAY-HTRCEHHLSA-N	-1	3	343.390	1.541	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-]C1(CCO)CC1	ZINC000594775670	449688344	/nfs/dbraw/zinc/68/83/44/449688344.db2.gz	GFWVGYRZNPBGRZ-UHFFFAOYSA-N	-1	3	337.357	1.336	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CCN(C3CC3)C2)c(F)cc1[N+](=O)[O-]	ZINC000601318543	449827249	/nfs/dbraw/zinc/82/72/49/449827249.db2.gz	OFCSESBJZSVULG-JTQLQIEISA-N	-1	3	343.380	1.557	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2CCN(CC3CC3)C2)c([N+](=O)[O-])s1	ZINC000601339210	449847899	/nfs/dbraw/zinc/84/78/99/449847899.db2.gz	ACSKNLJUHCQAQP-LLVKDONJSA-N	-1	3	345.446	1.727	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](CO)CCC(C)C	ZINC000599411203	449955879	/nfs/dbraw/zinc/95/58/79/449955879.db2.gz	XMDVPDQRYRDFGE-LLVKDONJSA-N	-1	3	346.405	1.679	20	5		EDBDHM
O=[N+]([O-])c1ncccc1S(=O)(=O)[N-][C@@H]1CCN(C2CCCC2)C1	ZINC000610212371	450154551	/nfs/dbraw/zinc/15/45/51/450154551.db2.gz	YQMVTPVVJFAZKH-LLVKDONJSA-N	-1	3	340.405	1.285	20	5		EDBDHM
C[S@](=O)C1(C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CCC1	ZINC000797848834	578553626	/nfs/dbraw/zinc/55/36/26/578553626.db2.gz	FDPALVRUTXZSEB-IBGZPJMESA-N	-1	3	338.432	1.236	20	5		EDBDHM
CC[S@@](=O)CC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000733898812	578787726	/nfs/dbraw/zinc/78/77/26/578787726.db2.gz	SQNSZYLVFCLYTQ-LJQANCHMSA-N	-1	3	340.810	1.295	20	5		EDBDHM
CC(C)[C@H]1CN(C)CCN1c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000735757310	578921048	/nfs/dbraw/zinc/92/10/48/578921048.db2.gz	AMFSZLZXXLWTQL-CQSZACIVSA-N	-1	3	331.380	1.551	20	5		EDBDHM
CC(C)[C@H]1CN(C)CCN1c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000735757310	578921049	/nfs/dbraw/zinc/92/10/49/578921049.db2.gz	AMFSZLZXXLWTQL-CQSZACIVSA-N	-1	3	331.380	1.551	20	5		EDBDHM
CO[C@H](CNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C(F)(F)F	ZINC000736962267	579035858	/nfs/dbraw/zinc/03/58/58/579035858.db2.gz	NYACXWSVJSNBKM-SECBINFHSA-N	-1	3	332.242	1.764	20	5		EDBDHM
CO[C@H](CNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])C(F)(F)F	ZINC000736962267	579035859	/nfs/dbraw/zinc/03/58/59/579035859.db2.gz	NYACXWSVJSNBKM-SECBINFHSA-N	-1	3	332.242	1.764	20	5		EDBDHM
Cc1ccc([C@H](O)CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)o1	ZINC000737320974	579072173	/nfs/dbraw/zinc/07/21/73/579072173.db2.gz	XNFKRPBGRSHBHI-SNVBAGLBSA-N	-1	3	331.292	1.217	20	5		EDBDHM
Cc1ccc([C@H](O)CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)o1	ZINC000737320974	579072174	/nfs/dbraw/zinc/07/21/74/579072174.db2.gz	XNFKRPBGRSHBHI-SNVBAGLBSA-N	-1	3	331.292	1.217	20	5		EDBDHM
COC(=O)C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000754886721	579915296	/nfs/dbraw/zinc/91/52/96/579915296.db2.gz	WFZOVCADZWYJAE-LLVKDONJSA-N	-1	3	346.336	1.354	20	5		EDBDHM
Cc1noc(C[N-]S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2Cl)n1	ZINC000757722740	579970390	/nfs/dbraw/zinc/97/03/90/579970390.db2.gz	KBDLTRBEPVVEEC-UHFFFAOYSA-N	-1	3	346.752	1.727	20	5		EDBDHM
O=[N+]([O-])c1ccc[n-]c1=NNS(=O)(=O)c1ccc2ncccc2c1	ZINC000759168939	580000107	/nfs/dbraw/zinc/00/01/07/580000107.db2.gz	IUNRLRMRFNTCCS-UHFFFAOYSA-N	-1	3	345.340	1.843	20	5		EDBDHM
C[C@H](COCC(F)(F)F)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768828238	580221450	/nfs/dbraw/zinc/22/14/50/580221450.db2.gz	WIKQVVWFIYHHFX-ZCFIWIBFSA-N	-1	3	348.324	1.902	20	5		EDBDHM
O=[N+]([O-])c1c(NCc2nnc(C(F)(F)F)[n-]2)nc2ccccn21	ZINC000775541330	580393251	/nfs/dbraw/zinc/39/32/51/580393251.db2.gz	VXEFWVAKMVTSAW-UHFFFAOYSA-N	-1	3	327.226	1.992	20	5		EDBDHM
O=[N+]([O-])c1c(NCc2n[n-]c(C(F)(F)F)n2)nc2ccccn21	ZINC000775541330	580393252	/nfs/dbraw/zinc/39/32/52/580393252.db2.gz	VXEFWVAKMVTSAW-UHFFFAOYSA-N	-1	3	327.226	1.992	20	5		EDBDHM
O=[N+]([O-])c1c(NCc2nc(C(F)(F)F)n[n-]2)nc2ccccn21	ZINC000775541330	580393253	/nfs/dbraw/zinc/39/32/53/580393253.db2.gz	VXEFWVAKMVTSAW-UHFFFAOYSA-N	-1	3	327.226	1.992	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)OC(=O)CC[C@@H]1NC(=O)[N-]C1=O	ZINC000778760767	580471558	/nfs/dbraw/zinc/47/15/58/580471558.db2.gz	DERRWIJIWGWNQO-SKDRFNHKSA-N	-1	3	335.316	1.496	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]Cc2cn(C)nn2)cc1[N+](=O)[O-]	ZINC000782982214	580590314	/nfs/dbraw/zinc/59/03/14/580590314.db2.gz	BPPLSCLMFZIWNS-UHFFFAOYSA-N	-1	3	345.768	1.164	20	5		EDBDHM
Nc1ccc(N2CCN(C(=O)c3ccc([O-])cc3)CC2)c([N+](=O)[O-])c1	ZINC000786580874	580674257	/nfs/dbraw/zinc/67/42/57/580674257.db2.gz	KMJDTISEEFTPNS-UHFFFAOYSA-N	-1	3	342.355	1.845	20	5		EDBDHM
Cc1n[n-]nc1C(=O)O[C@H](C)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000791044535	580783434	/nfs/dbraw/zinc/78/34/34/580783434.db2.gz	KJXPQHHIBPAVLS-SSDOTTSWSA-N	-1	3	337.267	1.344	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2OC)n[nH]1	ZINC000795112035	580913418	/nfs/dbraw/zinc/91/34/18/580913418.db2.gz	UIWQCRRWBLDTOL-UHFFFAOYSA-N	-1	3	340.361	1.367	20	5		EDBDHM
CC[C@@]1(C)NC(=O)N([N-]C(=O)c2ccc(NC)c([N+](=O)[O-])c2)C1=O	ZINC000906487913	592830497	/nfs/dbraw/zinc/83/04/97/592830497.db2.gz	DXLGHVBFEAVRNK-CQSZACIVSA-N	-1	3	335.320	1.002	20	5		EDBDHM
CCn1ccc(C[N-]S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)n1	ZINC000841553707	593317301	/nfs/dbraw/zinc/31/73/01/593317301.db2.gz	GLYUKDPIOIPKNW-UHFFFAOYSA-N	-1	3	342.352	1.737	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1C(=O)OC[C@@H]1CCCN1CC(=O)[O-]	ZINC000818611493	593707801	/nfs/dbraw/zinc/70/78/01/593707801.db2.gz	SRZKMIXJBRDGJH-NSHDSACASA-N	-1	3	338.316	1.309	20	5		EDBDHM
Cc1cc(C(=O)NCC(=O)[N-]C2=NC[C@H](C)S2)ccc1[N+](=O)[O-]	ZINC000819759360	593767321	/nfs/dbraw/zinc/76/73/21/593767321.db2.gz	GKAJCHNDMGOICI-VIFPVBQESA-N	-1	3	336.373	1.241	20	5		EDBDHM
C[C@@H](CN1CCCCC1)Nc1nccc(-c2nnn[n-]2)c1[N+](=O)[O-]	ZINC000820262313	593803996	/nfs/dbraw/zinc/80/39/96/593803996.db2.gz	VOWQVCFQENEMAS-JTQLQIEISA-N	-1	3	332.368	1.456	20	5		EDBDHM
COC(=O)C1CCN(c2ccc(-c3nnn[n-]3)c([N+](=O)[O-])c2)CC1	ZINC000821655438	593899319	/nfs/dbraw/zinc/89/93/19/593899319.db2.gz	LKFXHNYNKQBGME-UHFFFAOYSA-N	-1	3	332.320	1.164	20	5		EDBDHM
COC(=O)[C@@H]1CN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C[C@H]1C	ZINC000821656845	593900342	/nfs/dbraw/zinc/90/03/42/593900342.db2.gz	APCAZVUTPNPRMU-PSASIEDQSA-N	-1	3	332.320	1.020	20	5		EDBDHM
COC(=O)[C@@H]1CN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C[C@H]1C	ZINC000821656845	593900344	/nfs/dbraw/zinc/90/03/44/593900344.db2.gz	APCAZVUTPNPRMU-PSASIEDQSA-N	-1	3	332.320	1.020	20	5		EDBDHM
Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000822220494	594013266	/nfs/dbraw/zinc/01/32/66/594013266.db2.gz	UCGGBLIDTZDRGK-UHFFFAOYSA-N	-1	3	339.315	1.918	20	5		EDBDHM
Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000822220494	594013270	/nfs/dbraw/zinc/01/32/70/594013270.db2.gz	UCGGBLIDTZDRGK-UHFFFAOYSA-N	-1	3	339.315	1.918	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CC(=O)Oc1ccc(-c2nnn[n-]2)cc1F	ZINC000822458219	594051389	/nfs/dbraw/zinc/05/13/89/594051389.db2.gz	DHZHUKJMPLVTMF-UHFFFAOYSA-N	-1	3	347.266	1.025	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CC(=O)Oc1ccc(-c2nn[n-]n2)cc1F	ZINC000822458219	594051390	/nfs/dbraw/zinc/05/13/90/594051390.db2.gz	DHZHUKJMPLVTMF-UHFFFAOYSA-N	-1	3	347.266	1.025	20	5		EDBDHM
Cn1cc(-c2nnn[n-]2)cc1C(=O)N1CCc2c1cccc2[N+](=O)[O-]	ZINC000822631882	594076870	/nfs/dbraw/zinc/07/68/70/594076870.db2.gz	LEEBIMKVNXFSIU-UHFFFAOYSA-N	-1	3	339.315	1.316	20	5		EDBDHM
Cn1cc(-c2nn[n-]n2)cc1C(=O)N1CCc2c1cccc2[N+](=O)[O-]	ZINC000822631882	594076872	/nfs/dbraw/zinc/07/68/72/594076872.db2.gz	LEEBIMKVNXFSIU-UHFFFAOYSA-N	-1	3	339.315	1.316	20	5		EDBDHM
CCCCCN(CC(N)=O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825271042	594159465	/nfs/dbraw/zinc/15/94/65/594159465.db2.gz	FWIACZCCOVWHMU-UHFFFAOYSA-N	-1	3	333.352	1.257	20	5		EDBDHM
CCCCCN(CC(N)=O)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825271042	594159467	/nfs/dbraw/zinc/15/94/67/594159467.db2.gz	FWIACZCCOVWHMU-UHFFFAOYSA-N	-1	3	333.352	1.257	20	5		EDBDHM
O=C(NCc1cc(-c2nnn[n-]2)ccc1F)c1ccccc1[N+](=O)[O-]	ZINC000823242001	594174703	/nfs/dbraw/zinc/17/47/03/594174703.db2.gz	NJZMPSNHVZZCPS-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=C(NCc1cc(-c2nn[n-]n2)ccc1F)c1ccccc1[N+](=O)[O-]	ZINC000823242001	594174704	/nfs/dbraw/zinc/17/47/04/594174704.db2.gz	NJZMPSNHVZZCPS-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=C1CN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])[C@H]2CCCC[C@@H]2N1	ZINC000823535806	594215081	/nfs/dbraw/zinc/21/50/81/594215081.db2.gz	IADIOIPKLZMJBV-QWRGUYRKSA-N	-1	3	343.347	1.022	20	5		EDBDHM
O=C1CN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])[C@H]2CCCC[C@@H]2N1	ZINC000823535806	594215082	/nfs/dbraw/zinc/21/50/82/594215082.db2.gz	IADIOIPKLZMJBV-QWRGUYRKSA-N	-1	3	343.347	1.022	20	5		EDBDHM
O=[N+]([O-])c1cc(N2CCC3(CC2)OCCO3)ccc1-c1nnn[n-]1	ZINC000823634479	594223261	/nfs/dbraw/zinc/22/32/61/594223261.db2.gz	HEDPOGLHOVOKEZ-UHFFFAOYSA-N	-1	3	332.320	1.118	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCOC3(CCOCC3)C2)c(-c2nnn[n-]2)c1	ZINC000823640109	594223809	/nfs/dbraw/zinc/22/38/09/594223809.db2.gz	SSOMPXYOVPYDBD-UHFFFAOYSA-N	-1	3	346.347	1.161	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCOC3(CCOCC3)C2)c(-c2nn[n-]n2)c1	ZINC000823640109	594223810	/nfs/dbraw/zinc/22/38/10/594223810.db2.gz	SSOMPXYOVPYDBD-UHFFFAOYSA-N	-1	3	346.347	1.161	20	5		EDBDHM
O=[N+]([O-])c1ncn(Cc2ccc(-c3nnn[n-]3)cc2OC(F)F)n1	ZINC000823651771	594224892	/nfs/dbraw/zinc/22/48/92/594224892.db2.gz	PKSWTVYKTGQZLD-UHFFFAOYSA-N	-1	3	338.234	1.016	20	5		EDBDHM
O=[N+]([O-])c1ncn(Cc2ccc(-c3nn[n-]n3)cc2OC(F)F)n1	ZINC000823651771	594224893	/nfs/dbraw/zinc/22/48/93/594224893.db2.gz	PKSWTVYKTGQZLD-UHFFFAOYSA-N	-1	3	338.234	1.016	20	5		EDBDHM
CCc1ccc(OC(=O)c2ccc(-c3nnn[n-]3)[nH]2)c([N+](=O)[O-])c1	ZINC000825717187	594230846	/nfs/dbraw/zinc/23/08/46/594230846.db2.gz	IRKWOSRHPDGMAM-UHFFFAOYSA-N	-1	3	328.288	1.885	20	5		EDBDHM
CN(C)c1nccc(CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])n1	ZINC000825888018	594269261	/nfs/dbraw/zinc/26/92/61/594269261.db2.gz	MWPJLXUWYHBMGA-UHFFFAOYSA-N	-1	3	341.335	1.243	20	5		EDBDHM
CN(C)c1nccc(CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])n1	ZINC000825888018	594269263	/nfs/dbraw/zinc/26/92/63/594269263.db2.gz	MWPJLXUWYHBMGA-UHFFFAOYSA-N	-1	3	341.335	1.243	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCC(n2ccnn2)CC1	ZINC000826497300	594502040	/nfs/dbraw/zinc/50/20/40/594502040.db2.gz	BRAWQFKYHIKVFK-UHFFFAOYSA-N	-1	3	341.335	1.208	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCC(n2ccnn2)CC1	ZINC000826497300	594502041	/nfs/dbraw/zinc/50/20/41/594502041.db2.gz	BRAWQFKYHIKVFK-UHFFFAOYSA-N	-1	3	341.335	1.208	20	5		EDBDHM
O=[N+]([O-])c1cccc([C@H](O)COc2ccccc2-c2nnn[n-]2)c1	ZINC000826499780	594503311	/nfs/dbraw/zinc/50/33/11/594503311.db2.gz	XERRFGSRHDANOR-CYBMUJFWSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1cccc([C@H](O)COc2ccccc2-c2nn[n-]n2)c1	ZINC000826499780	594503313	/nfs/dbraw/zinc/50/33/13/594503313.db2.gz	XERRFGSRHDANOR-CYBMUJFWSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1cccc(OC[C@@H](O)c2ccc(-c3nnn[n-]3)cc2)c1	ZINC000826499505	594503749	/nfs/dbraw/zinc/50/37/49/594503749.db2.gz	LDDYFSDDZUNIDH-CQSZACIVSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1cccc(OC[C@@H](O)c2ccc(-c3nn[n-]n3)cc2)c1	ZINC000826499505	594503750	/nfs/dbraw/zinc/50/37/50/594503750.db2.gz	LDDYFSDDZUNIDH-CQSZACIVSA-N	-1	3	327.300	1.887	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN2CCC[C@H]2C)c([N+](=O)[O-])s1	ZINC000867146891	594889716	/nfs/dbraw/zinc/88/97/16/594889716.db2.gz	BAQZWGXDQNMCIQ-SECBINFHSA-N	-1	3	333.435	1.727	20	5		EDBDHM
CN1CCC[C@@H](CC[N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1	ZINC000841548054	594920579	/nfs/dbraw/zinc/92/05/79/594920579.db2.gz	DRQGFTNRALFRQE-NSHDSACASA-N	-1	3	345.396	1.744	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]Cc2nnc(C3CC3)s2)cs1	ZINC000841567968	594924257	/nfs/dbraw/zinc/92/42/57/594924257.db2.gz	YNVSRVRNWNNOHL-UHFFFAOYSA-N	-1	3	346.415	1.864	20	5		EDBDHM
CC(C)[C@H](CO)O[N-]C(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000836891139	595009627	/nfs/dbraw/zinc/00/96/27/595009627.db2.gz	LSJKSOJUVVBAQF-ZDUSSCGKSA-N	-1	3	341.320	1.500	20	5		EDBDHM
O=C([O-])CCN(C[C@@H](O)c1cccc([N+](=O)[O-])c1)C[C@H]1CCCO1	ZINC000846272939	595193842	/nfs/dbraw/zinc/19/38/42/595193842.db2.gz	QKBXWPMBUBMBGV-HUUCEWRRSA-N	-1	3	338.360	1.584	20	5		EDBDHM
CN1CCC(O[N-]C(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)CC1	ZINC000846647016	595292238	/nfs/dbraw/zinc/29/22/38/595292238.db2.gz	QXOXSUFBGIWNLV-UHFFFAOYSA-N	-1	3	333.348	1.087	20	5		EDBDHM
CC(C)(C)Oc1cc(N2CCN(CC(=O)[O-])CC2)ccc1[N+](=O)[O-]	ZINC000844215647	595304269	/nfs/dbraw/zinc/30/42/69/595304269.db2.gz	IBYANPZUBQHSFL-UHFFFAOYSA-N	-1	3	337.376	1.979	20	5		EDBDHM
COC[C@@H](CCO)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848584121	595409383	/nfs/dbraw/zinc/40/93/83/595409383.db2.gz	OQYYRVMSZFPTQC-SECBINFHSA-N	-1	3	334.275	1.080	20	5		EDBDHM
COC(=O)N1CC([N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000848585270	595409932	/nfs/dbraw/zinc/40/99/32/595409932.db2.gz	JOIRNZIULIJYRN-UHFFFAOYSA-N	-1	3	345.258	1.133	20	5		EDBDHM
C[C@@H]1CCNC(=O)[C@H]1[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848592406	595412388	/nfs/dbraw/zinc/41/23/88/595412388.db2.gz	ZHXRJJGTQLWULX-KCJUWKMLSA-N	-1	3	343.286	1.207	20	5		EDBDHM
CON(C)CC[N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl	ZINC000849408498	595522090	/nfs/dbraw/zinc/52/20/90/595522090.db2.gz	OCLBAFCSKLRIHO-UHFFFAOYSA-N	-1	3	337.785	1.328	20	5		EDBDHM
CCOC(=O)C(C)(C)O[N-]C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000855132721	595605572	/nfs/dbraw/zinc/60/55/72/595605572.db2.gz	TZUWMVBXCZHWIG-UHFFFAOYSA-N	-1	3	340.288	1.327	20	5		EDBDHM
O=c1nc(Cl)cc(N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)[n-]1	ZINC000858455745	595799856	/nfs/dbraw/zinc/79/98/56/595799856.db2.gz	UEJROJXSOIUZGS-QMMMGPOBSA-N	-1	3	336.739	1.830	20	5		EDBDHM
Cc1ccc(CC[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)cn1	ZINC000119749187	596735467	/nfs/dbraw/zinc/73/54/67/596735467.db2.gz	JNNFFVMCJKOESH-UHFFFAOYSA-N	-1	3	327.387	1.881	20	5		EDBDHM
O=C([N-]CC1CN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1)C(F)(F)F	ZINC000871991916	596782518	/nfs/dbraw/zinc/78/25/18/596782518.db2.gz	OGDGWPIYXQYWDQ-LBPRGKRZSA-N	-1	3	347.293	1.239	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2C[C@H]3CCC[C@@H]3O2)c(F)c1	ZINC000872559525	596964703	/nfs/dbraw/zinc/96/47/03/596964703.db2.gz	YCBPEDSYERNPDA-CDMKHQONSA-N	-1	3	344.364	1.970	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCC[C@H]1Cn1cccn1	ZINC000738360315	598337885	/nfs/dbraw/zinc/33/78/85/598337885.db2.gz	VLZSACOEADTTLY-LBPRGKRZSA-N	-1	3	340.347	1.640	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCC[C@H]1Cn1cccn1	ZINC000738360315	598337887	/nfs/dbraw/zinc/33/78/87/598337887.db2.gz	VLZSACOEADTTLY-LBPRGKRZSA-N	-1	3	340.347	1.640	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCCn2cccn2)c(Cl)c1	ZINC000056041095	214354406	/nfs/dbraw/zinc/35/44/06/214354406.db2.gz	WRGMRFCTXSVIRU-UHFFFAOYSA-N	-1	3	344.780	1.813	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]Cc1ccc(C(N)=O)o1	ZINC000175454724	231449850	/nfs/dbraw/zinc/44/98/50/231449850.db2.gz	IHHNXJJWDYVTJG-UHFFFAOYSA-N	-1	3	339.329	1.074	20	5		EDBDHM
CCOC(=O)c1ccnc(N2CCc3c(=O)[n-]cnc3C2)c1[N+](=O)[O-]	ZINC000561774770	306290923	/nfs/dbraw/zinc/29/09/23/306290923.db2.gz	CDOFRBWCPINNPF-UHFFFAOYSA-N	-1	3	345.315	1.225	20	5		EDBDHM
O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1ccc(-c2nnn[n-]2)cc1	ZINC000068973938	215350428	/nfs/dbraw/zinc/35/04/28/215350428.db2.gz	IEKHSBAUFIHFMN-UHFFFAOYSA-N	-1	3	338.327	1.634	20	5		EDBDHM
O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1ccc(-c2nn[n-]n2)cc1	ZINC000068973938	215350432	/nfs/dbraw/zinc/35/04/32/215350432.db2.gz	IEKHSBAUFIHFMN-UHFFFAOYSA-N	-1	3	338.327	1.634	20	5		EDBDHM
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCN(C3CC3)C[C@@H](C)C2)n1	ZINC000563203517	306323326	/nfs/dbraw/zinc/32/33/26/306323326.db2.gz	CJXXOZIVJDZMJB-SNVBAGLBSA-N	-1	3	334.376	1.917	20	5		EDBDHM
O=C([O-])c1cc(N2CCN(C[C@H]3CCOC3)CC2)ccc1[N+](=O)[O-]	ZINC000566071915	306398032	/nfs/dbraw/zinc/39/80/32/306398032.db2.gz	RFQCVUUNTWOEFA-GFCCVEGCSA-N	-1	3	335.360	1.452	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@](C)(O)C(F)(F)F	ZINC000270567191	140125095	/nfs/dbraw/zinc/12/50/95/140125095.db2.gz	SBMVDGJKDGQKMI-JTQLQIEISA-N	-1	3	342.295	1.495	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CCO[C@H](C)C1	ZINC000271261787	140266527	/nfs/dbraw/zinc/26/65/27/140266527.db2.gz	LBPFPTQYUARFKR-MNOVXSKESA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cc1ncc(CNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)c(=O)[n-]1	ZINC000345113876	143052147	/nfs/dbraw/zinc/05/21/47/143052147.db2.gz	AQJYOLLEXRAZJK-UHFFFAOYSA-N	-1	3	327.300	1.810	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCc1cc(C)no1	ZINC000352640918	149098071	/nfs/dbraw/zinc/09/80/71/149098071.db2.gz	NQMOOXNPRBXXTF-UHFFFAOYSA-N	-1	3	341.345	1.421	20	5		EDBDHM
Cn1ccnc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000355088832	150110375	/nfs/dbraw/zinc/11/03/75/150110375.db2.gz	CHVJZNPOTQKKJP-UHFFFAOYSA-N	-1	3	330.753	1.460	20	5		EDBDHM
CCN1CC[C@H]2OCCN(C(=O)c3cc([O-])cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000355368354	150238388	/nfs/dbraw/zinc/23/83/88/150238388.db2.gz	LGYACWGLHYGZQZ-HUUCEWRRSA-N	-1	3	335.360	1.236	20	5		EDBDHM
COC(=O)CCc1csc([N-]C(=O)c2nn(C)cc2[N+](=O)[O-])n1	ZINC000357946286	151206581	/nfs/dbraw/zinc/20/65/81/151206581.db2.gz	OYSWOOMOWCPIEX-UHFFFAOYSA-N	-1	3	339.333	1.143	20	5		EDBDHM
COCCOC[C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000360547656	152090227	/nfs/dbraw/zinc/09/02/27/152090227.db2.gz	RPHURNZPEFNLKH-SECBINFHSA-N	-1	3	336.341	1.064	20	5		EDBDHM
Cc1nn(C)c(C)c1C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000360764536	152193347	/nfs/dbraw/zinc/19/33/47/152193347.db2.gz	QFZDVWTTWFUPOX-UHFFFAOYSA-N	-1	3	338.389	1.732	20	5		EDBDHM
Cc1cc(C(=O)NCc2nnc(C(F)(F)F)[n-]2)cc([N+](=O)[O-])c1	ZINC000360823193	152220859	/nfs/dbraw/zinc/22/08/59/152220859.db2.gz	UOTPWWCVWDGIQO-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1cc(C(=O)NCc2n[n-]c(C(F)(F)F)n2)cc([N+](=O)[O-])c1	ZINC000360823193	152220861	/nfs/dbraw/zinc/22/08/61/152220861.db2.gz	UOTPWWCVWDGIQO-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1cc(C(=O)NCc2nc(C(F)(F)F)n[n-]2)cc([N+](=O)[O-])c1	ZINC000360823193	152220864	/nfs/dbraw/zinc/22/08/64/152220864.db2.gz	UOTPWWCVWDGIQO-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1cc(C(=O)NCc2nnc(C(F)(F)F)[n-]2)ccc1[N+](=O)[O-]	ZINC000361007769	152277348	/nfs/dbraw/zinc/27/73/48/152277348.db2.gz	HSGKJOFQSNULNO-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1cc(C(=O)NCc2n[n-]c(C(F)(F)F)n2)ccc1[N+](=O)[O-]	ZINC000361007769	152277350	/nfs/dbraw/zinc/27/73/50/152277350.db2.gz	HSGKJOFQSNULNO-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1cc(C(=O)NCc2nc(C(F)(F)F)n[n-]2)ccc1[N+](=O)[O-]	ZINC000361007769	152277352	/nfs/dbraw/zinc/27/73/52/152277352.db2.gz	HSGKJOFQSNULNO-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCO[C@@H]1C1CC1	ZINC000372257904	156291546	/nfs/dbraw/zinc/29/15/46/156291546.db2.gz	HQULLWHYQVFGEE-SMDDNHRTSA-N	-1	3	342.373	1.449	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(N2CC(S(=O)(=O)[N-]c3ccccc3)C2)n1	ZINC000374720848	157376520	/nfs/dbraw/zinc/37/65/20/157376520.db2.gz	SXDIBXSTSFHFBG-UHFFFAOYSA-N	-1	3	348.384	1.929	20	5		EDBDHM
CS[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])C[C@@H]1N(C)C	ZINC000274873050	268228070	/nfs/dbraw/zinc/22/80/70/268228070.db2.gz	ZSDIUCUULKKOGA-WCQYABFASA-N	-1	3	325.390	1.418	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C2CCOCC2)cc1[N+](=O)[O-]	ZINC000275288047	268314361	/nfs/dbraw/zinc/31/43/61/268314361.db2.gz	SYBDGXDRNKIGGP-UHFFFAOYSA-N	-1	3	334.325	1.200	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCN2CC=CCC2)cc1C	ZINC000280091950	273344689	/nfs/dbraw/zinc/34/46/89/273344689.db2.gz	AALNBJLBWKMKJD-UHFFFAOYSA-N	-1	3	339.417	1.752	20	5		EDBDHM
COCC1(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCOCC1	ZINC000292431841	289345435	/nfs/dbraw/zinc/34/54/35/289345435.db2.gz	WCSISICEZLOTQG-UHFFFAOYSA-N	-1	3	344.389	1.316	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C(C)(C)CC(N)=O)c1[N+](=O)[O-]	ZINC000190148976	301554926	/nfs/dbraw/zinc/55/49/26/301554926.db2.gz	FPIMXUNPADHZKK-UHFFFAOYSA-N	-1	3	329.378	1.144	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](O)C(F)(F)F)c1C	ZINC000269685022	301859772	/nfs/dbraw/zinc/85/97/72/301859772.db2.gz	HDAFMBDFFODMHM-SECBINFHSA-N	-1	3	342.295	1.413	20	5		EDBDHM
CCC1([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000295286293	303199745	/nfs/dbraw/zinc/19/97/45/303199745.db2.gz	NCCVIILTPFFZNJ-UHFFFAOYSA-N	-1	3	328.346	1.587	20	5		EDBDHM
Cc1ccc(C(=O)N2CCN(c3ncccc3[N+](=O)[O-])CC2)c([O-])c1	ZINC000297021528	303354597	/nfs/dbraw/zinc/35/45/97/303354597.db2.gz	SJOXUGSHHYZOSY-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-][C@@H]1CCSC1)OCCO2	ZINC000266294593	304801351	/nfs/dbraw/zinc/80/13/51/304801351.db2.gz	MRFWOQKEJXYTCR-MRVPVSSYSA-N	-1	3	346.386	1.150	20	5		EDBDHM
CCOc1cc(N2CCC[C@@]3(C2)NC(=O)[N-]C3=O)ccc1[N+](=O)[O-]	ZINC000432928666	305097853	/nfs/dbraw/zinc/09/78/53/305097853.db2.gz	NTTZADGVIBHFPE-HNNXBMFYSA-N	-1	3	334.332	1.172	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1COCC1(C)C	ZINC000451964806	305374727	/nfs/dbraw/zinc/37/47/27/305374727.db2.gz	JPMWBIUCBPETAK-LBPRGKRZSA-N	-1	3	330.362	1.307	20	5		EDBDHM
C[C@]1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCO[C@H]1C1CC1	ZINC000542318470	306052941	/nfs/dbraw/zinc/05/29/41/306052941.db2.gz	SUOLGBNFNNGEOQ-KBPBESRZSA-N	-1	3	344.364	1.970	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2nnc(C)s2)c([N+](=O)[O-])c1	ZINC000543728548	306068122	/nfs/dbraw/zinc/06/81/22/306068122.db2.gz	KSKZXMNBKKIKNP-UHFFFAOYSA-N	-1	3	344.374	1.242	20	5		EDBDHM
CCCc1[nH]nc(C(=O)[N-]c2ccnc(C(=O)N(C)C)c2)c1[N+](=O)[O-]	ZINC000160357933	441873561	/nfs/dbraw/zinc/87/35/61/441873561.db2.gz	OGQHQSDDILVACT-UHFFFAOYSA-N	-1	3	346.347	1.620	20	5		EDBDHM
Cc1cc(C(=O)[N-]c2nc(CS(C)(=O)=O)no2)cc([N+](=O)[O-])c1	ZINC000265493513	442794089	/nfs/dbraw/zinc/79/40/89/442794089.db2.gz	GSSQVIBFCXHTCX-UHFFFAOYSA-N	-1	3	340.317	1.083	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)C[S@](C)=O)c1C	ZINC000183205967	442902496	/nfs/dbraw/zinc/90/24/96/442902496.db2.gz	LUZHPDRVCYYULJ-YBYGRFCBSA-N	-1	3	334.419	1.257	20	5		EDBDHM
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)[N-]C[C@@H]1CCN(C2CC2)C1	ZINC000266079542	443010280	/nfs/dbraw/zinc/01/02/80/443010280.db2.gz	BPMPPECTFACWGL-JTQLQIEISA-N	-1	3	343.380	1.497	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCN2CCCC2)c1[N+](=O)[O-]	ZINC000189810922	443014887	/nfs/dbraw/zinc/01/48/87/443014887.db2.gz	PUVARTRJXBGJKG-UHFFFAOYSA-N	-1	3	327.406	1.586	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])Nc1ccccc1	ZINC000184386479	443017023	/nfs/dbraw/zinc/01/70/23/443017023.db2.gz	VQKVISFHJPVOIH-UHFFFAOYSA-N	-1	3	349.368	1.653	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CC[C@H](O)CC1	ZINC000319555196	318937954	/nfs/dbraw/zinc/93/79/54/318937954.db2.gz	HDHKNTLTHPWKKP-HOMQSWHASA-N	-1	3	330.362	1.185	20	5		EDBDHM
CCCOC(=O)CC[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000267157159	443361317	/nfs/dbraw/zinc/36/13/17/443361317.db2.gz	PROAVDZQNRUQOA-UHFFFAOYSA-N	-1	3	346.361	1.225	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC2([S@@](C)=O)CC2)c1[N+](=O)[O-]	ZINC000282665572	443403093	/nfs/dbraw/zinc/40/30/93/443403093.db2.gz	VQCACGQTHJVLBQ-OAQYLSRUSA-N	-1	3	346.430	1.401	20	5		EDBDHM
C[C@@H]1CN(CCCNC(=O)c2cc([N+](=O)[O-])ccc2[O-])CCCO1	ZINC000278809667	443447670	/nfs/dbraw/zinc/44/76/70/443447670.db2.gz	ZOYIJXGDAAMJSK-GFCCVEGCSA-N	-1	3	337.376	1.531	20	5		EDBDHM
CCc1nc([C@@H](C)[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)n[nH]1	ZINC000273994923	443590866	/nfs/dbraw/zinc/59/08/66/443590866.db2.gz	SCFSKJZTVPYXKO-MRVPVSSYSA-N	-1	3	325.350	1.315	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC2=CCN(C)CC2)c([N+](=O)[O-])c1	ZINC000272292760	443582183	/nfs/dbraw/zinc/58/21/83/443582183.db2.gz	VNCGFHUGGBZQGH-UHFFFAOYSA-N	-1	3	341.389	1.144	20	5		EDBDHM
CCCCOC(=O)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000265378669	443622620	/nfs/dbraw/zinc/62/26/20/443622620.db2.gz	FFBITNITZFZOQP-UHFFFAOYSA-N	-1	3	346.361	1.225	20	5		EDBDHM
COc1ccc(C[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])nc1	ZINC000443927555	320115425	/nfs/dbraw/zinc/11/54/25/320115425.db2.gz	MBJXMLSVMJVYGU-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
O=C(NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])OC1CCC1	ZINC000496419041	320405949	/nfs/dbraw/zinc/40/59/49/320405949.db2.gz	WMRLCSVILLRJMQ-UHFFFAOYSA-N	-1	3	343.361	1.152	20	5		EDBDHM
CC(C)[C@H](C)NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000280866798	443762422	/nfs/dbraw/zinc/76/24/22/443762422.db2.gz	YASYTQMNRILIQS-JTQLQIEISA-N	-1	3	329.378	1.034	20	5		EDBDHM
CN(C)C[C@@H](NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)c1ccc(F)cc1	ZINC000288100444	443771463	/nfs/dbraw/zinc/77/14/63/443771463.db2.gz	HZVDBVHCLKBKIH-CYBMUJFWSA-N	-1	3	348.334	1.867	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@](C)(C(N)=O)C(C)C)c1C	ZINC000285288225	443928655	/nfs/dbraw/zinc/92/86/55/443928655.db2.gz	KAVFAUHTKRCZFY-CQSZACIVSA-N	-1	3	343.405	1.390	20	5		EDBDHM
CC(C)(C)n1ncnc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000282224298	444119564	/nfs/dbraw/zinc/11/95/64/444119564.db2.gz	HKTOQDIOEOXIEN-UHFFFAOYSA-N	-1	3	339.377	1.420	20	5		EDBDHM
NS(=O)(=O)c1ccc([N-]c2ccn(CC(F)F)n2)c([N+](=O)[O-])c1	ZINC000301535504	444178371	/nfs/dbraw/zinc/17/83/71/444178371.db2.gz	MJVKJUVWUDLTSL-UHFFFAOYSA-N	-1	3	347.303	1.447	20	5		EDBDHM
COC(=O)CCCO[N-]C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-]	ZINC000290599936	444299805	/nfs/dbraw/zinc/29/98/05/444299805.db2.gz	KPMDSZRXJJVXJQ-UHFFFAOYSA-N	-1	3	342.304	1.227	20	5		EDBDHM
COc1cc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)ccc1O	ZINC000580753329	322090487	/nfs/dbraw/zinc/09/04/87/322090487.db2.gz	ZZHXCTAEKAKLRP-UHFFFAOYSA-N	-1	3	344.370	1.849	20	5		EDBDHM
COCCOC[C@@H](C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000342513245	444724783	/nfs/dbraw/zinc/72/47/83/444724783.db2.gz	KHDSZHHTHDPCDY-MRVPVSSYSA-N	-1	3	338.407	1.295	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCCN(C)[C@@H]1C	ZINC000344026568	444737377	/nfs/dbraw/zinc/73/73/77/444737377.db2.gz	GZOCCNTUVHPFCJ-ZYHUDNBSSA-N	-1	3	343.405	1.364	20	5		EDBDHM
C[C@@H](C[C@@H]1CCCO1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000338722705	444821077	/nfs/dbraw/zinc/82/10/77/444821077.db2.gz	BXKJSTCCZQDSPS-ONGXEEELSA-N	-1	3	332.353	1.970	20	5		EDBDHM
COC(=O)[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C(C)C	ZINC000342666186	444804733	/nfs/dbraw/zinc/80/47/33/444804733.db2.gz	AERIOGSPXLQGSY-JTQLQIEISA-N	-1	3	336.391	1.441	20	5		EDBDHM
COc1ccc(NC(=O)[C@@H]([N-]S(C)(=O)=O)C(C)C)cc1[N+](=O)[O-]	ZINC000360001667	445521812	/nfs/dbraw/zinc/52/18/12/445521812.db2.gz	BQMGGVVFRGTNLS-LBPRGKRZSA-N	-1	3	345.377	1.116	20	5		EDBDHM
Cn1cncc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000349806984	445684466	/nfs/dbraw/zinc/68/44/66/445684466.db2.gz	ASEIXJHJRSJBTQ-UHFFFAOYSA-N	-1	3	330.753	1.460	20	5		EDBDHM
CCC[C@@H]([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)C(=O)OC	ZINC000358606317	445672523	/nfs/dbraw/zinc/67/25/23/445672523.db2.gz	ZCVXCBWIOMDFPV-GFCCVEGCSA-N	-1	3	330.362	1.356	20	5		EDBDHM
CC1CCN(C[C@H](O)CNC(=O)c2cc([O-])ccc2[N+](=O)[O-])CC1	ZINC000354056424	445879818	/nfs/dbraw/zinc/87/98/18/445879818.db2.gz	HWPFKSLIUDTFDL-CYBMUJFWSA-N	-1	3	337.376	1.123	20	5		EDBDHM
CC(C)(C)c1ccc(NC(=O)c2[nH]c(=O)[n-]c(=O)c2N)cc1[N+](=O)[O-]	ZINC000356736111	445978103	/nfs/dbraw/zinc/97/81/03/445978103.db2.gz	OAMBWVPVEWQVRG-UHFFFAOYSA-N	-1	3	347.331	1.928	20	5		EDBDHM
O=C([O-])CC1CCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000583267585	326039233	/nfs/dbraw/zinc/03/92/33/326039233.db2.gz	AVPUADUALSMLDC-AWEZNQCLSA-N	-1	3	338.360	1.521	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]c2ccc(C)[nH]c2=O)c([N+](=O)[O-])c1	ZINC000359631926	446328444	/nfs/dbraw/zinc/32/84/44/446328444.db2.gz	ABRAOFGKBQXCMX-UHFFFAOYSA-N	-1	3	339.329	1.813	20	5		EDBDHM
Cn1cc2c(n1)CCC[C@@H]2[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000366970712	446435664	/nfs/dbraw/zinc/43/56/64/446435664.db2.gz	UMTORZVRMCGMGX-LBPRGKRZSA-N	-1	3	336.373	1.684	20	5		EDBDHM
Cc1noc(C2CCN(C(=O)c3cc(C)[n-]c(=O)c3[N+](=O)[O-])CC2)n1	ZINC000375094338	446577050	/nfs/dbraw/zinc/57/70/50/446577050.db2.gz	OUMRVFSIVPYIHX-UHFFFAOYSA-N	-1	3	347.331	1.715	20	5		EDBDHM
COC(=O)[C@@H](CNc1ccc([N+](=O)[O-])cn1)Cc1ccc([O-])c(F)c1	ZINC000420637535	446714051	/nfs/dbraw/zinc/71/40/51/446714051.db2.gz	OVKNNZGWHCYFIO-LLVKDONJSA-N	-1	3	349.318	2.278	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C[C@@H]2[C@H]3COC[C@H]32)c1	ZINC000368512422	446912295	/nfs/dbraw/zinc/91/22/95/446912295.db2.gz	TUUMPGMUBFUZDS-OWUUHHOZSA-N	-1	3	346.792	1.727	20	5		EDBDHM
CC(C)(C(N)=O)c1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc1	ZINC000445024781	447158656	/nfs/dbraw/zinc/15/86/56/447158656.db2.gz	XTRLGZMYHRKUKD-UHFFFAOYSA-N	-1	3	344.327	1.711	20	5		EDBDHM
CC[C@@H](C)[C@H](C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])OC	ZINC000451671199	447745629	/nfs/dbraw/zinc/74/56/29/447745629.db2.gz	FKJKQSYMFWZBIW-MFKMUULPSA-N	-1	3	346.405	1.943	20	5		EDBDHM
CCn1ccnc1[C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000451935155	447790977	/nfs/dbraw/zinc/79/09/77/447790977.db2.gz	QUPPVZKSFXHQEF-MRVPVSSYSA-N	-1	3	330.391	1.912	20	5		EDBDHM
CN1CCN(CCNc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1(C)C	ZINC000577377503	448280492	/nfs/dbraw/zinc/28/04/92/448280492.db2.gz	MCDTXWCPEHOAHX-UHFFFAOYSA-N	-1	3	336.392	1.731	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-]	ZINC000577463434	448300378	/nfs/dbraw/zinc/30/03/78/448300378.db2.gz	PPHKLDNJOBDNGG-SNVBAGLBSA-N	-1	3	338.751	1.798	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2CCNC(=O)CC2)c1[N+](=O)[O-]	ZINC000591332321	448326683	/nfs/dbraw/zinc/32/66/83/448326683.db2.gz	DLCKFPCCKFKBTG-LLVKDONJSA-N	-1	3	341.389	1.159	20	5		EDBDHM
COCC1([N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])CCCC1	ZINC000517759672	448616845	/nfs/dbraw/zinc/61/68/45/448616845.db2.gz	SRSCUTXZEACZKW-UHFFFAOYSA-N	-1	3	344.389	1.841	20	5		EDBDHM
COCC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)c1ccco1	ZINC000593572100	449081296	/nfs/dbraw/zinc/08/12/96/449081296.db2.gz	KBYPPTQTEDUXJN-NSHDSACASA-N	-1	3	341.345	1.639	20	5		EDBDHM
CN1CCC[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000604278185	449200346	/nfs/dbraw/zinc/20/03/46/449200346.db2.gz	OEHVBNWLTNIWMV-VIFPVBQESA-N	-1	3	333.797	1.621	20	5		EDBDHM
CC[C@@H](C)[C@H](O)C[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F	ZINC000590590338	449206840	/nfs/dbraw/zinc/20/68/40/449206840.db2.gz	FVBQGCMKRCIAAA-PRHODGIISA-N	-1	3	334.369	1.728	20	5		EDBDHM
O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000595943710	449270280	/nfs/dbraw/zinc/27/02/80/449270280.db2.gz	RANQYMRGVBBDAF-CQSZACIVSA-N	-1	3	344.327	1.609	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)N1CCCC[C@@H]1C	ZINC000593528564	449327100	/nfs/dbraw/zinc/32/71/00/449327100.db2.gz	NHMFPTKRGQNRCR-RYUDHWBXSA-N	-1	3	342.421	1.531	20	5		EDBDHM
CCc1noc(CC)c1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593560797	449350926	/nfs/dbraw/zinc/35/09/26/449350926.db2.gz	PMEMAHSORQDSII-UHFFFAOYSA-N	-1	3	340.361	1.581	20	5		EDBDHM
C[C@@H](c1cccnc1)N1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596128410	449378477	/nfs/dbraw/zinc/37/84/77/449378477.db2.gz	HDVJCRFXESIPSJ-LBPRGKRZSA-N	-1	3	329.360	1.974	20	5		EDBDHM
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)C1	ZINC000600624160	449464108	/nfs/dbraw/zinc/46/41/08/449464108.db2.gz	UKXVEWCSWBBJAP-MELADBBJSA-N	-1	3	349.387	1.672	20	5		EDBDHM
O=[N+]([O-])c1cc([O-])ccc1-n1cc(COC2CCC(CO)CC2)nn1	ZINC000594653483	449607885	/nfs/dbraw/zinc/60/78/85/449607885.db2.gz	WHWFKLOGZOQNFT-UHFFFAOYSA-N	-1	3	348.359	1.949	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)[n-]1	ZINC000617871787	449889235	/nfs/dbraw/zinc/88/92/35/449889235.db2.gz	HKWLPKXJSOWZHJ-UHFFFAOYSA-N	-1	3	337.267	1.468	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)c[n-]1	ZINC000617871787	449889242	/nfs/dbraw/zinc/88/92/42/449889242.db2.gz	HKWLPKXJSOWZHJ-UHFFFAOYSA-N	-1	3	337.267	1.468	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1nccn1C	ZINC000595384590	450098888	/nfs/dbraw/zinc/09/88/88/450098888.db2.gz	YNYOPNYVSGNOOW-MRVPVSSYSA-N	-1	3	328.325	1.507	20	5		EDBDHM
CC1(C)CC([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000595389482	450103251	/nfs/dbraw/zinc/10/32/51/450103251.db2.gz	OWIXZMUYKSSIMF-UHFFFAOYSA-N	-1	3	342.373	1.833	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)c2cccc(OC)c2[N+](=O)[O-])[n-]1	ZINC000619448386	450476281	/nfs/dbraw/zinc/47/62/81/450476281.db2.gz	PMYOYPVXJAEYKE-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)c2cccc(OC)c2[N+](=O)[O-])c[n-]1	ZINC000619448386	450476284	/nfs/dbraw/zinc/47/62/84/450476284.db2.gz	PMYOYPVXJAEYKE-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCCO[C@@H]1CCCCO1	ZINC000204817264	485557228	/nfs/dbraw/zinc/55/72/28/485557228.db2.gz	GLMUCPBVRCZYED-CQSZACIVSA-N	-1	3	344.389	1.806	20	5		EDBDHM
C[C@@H](CN(C)c1ncc(Br)cc1[N+](=O)[O-])c1nnn[n-]1	ZINC000132892035	533751889	/nfs/dbraw/zinc/75/18/89/533751889.db2.gz	RHTILMYNVWSHHS-LURJTMIESA-N	-1	3	342.157	1.505	20	5		EDBDHM
C[C@@H](CN(C)c1ncc(Br)cc1[N+](=O)[O-])c1nn[n-]n1	ZINC000132892035	533751894	/nfs/dbraw/zinc/75/18/94/533751894.db2.gz	RHTILMYNVWSHHS-LURJTMIESA-N	-1	3	342.157	1.505	20	5		EDBDHM
C[S@@](=O)C1(C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CCC1	ZINC000797848836	578553629	/nfs/dbraw/zinc/55/36/29/578553629.db2.gz	FDPALVRUTXZSEB-LJQANCHMSA-N	-1	3	338.432	1.236	20	5		EDBDHM
O=C(NCc1ccc(-c2nnn[n-]2)cc1F)c1ccccc1[N+](=O)[O-]	ZINC000738102976	578549154	/nfs/dbraw/zinc/54/91/54/578549154.db2.gz	WCWYWFKNSPNODI-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=C(NCc1ccc(-c2nn[n-]n2)cc1F)c1ccccc1[N+](=O)[O-]	ZINC000738102976	578549155	/nfs/dbraw/zinc/54/91/55/578549155.db2.gz	WCWYWFKNSPNODI-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCNCc1ccoc1	ZINC000735087116	578858053	/nfs/dbraw/zinc/85/80/53/578858053.db2.gz	XDAOQSQKPCJULO-UHFFFAOYSA-N	-1	3	325.346	1.256	20	5		EDBDHM
CC(C)n1cnnc1CNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000735966532	578943614	/nfs/dbraw/zinc/94/36/14/578943614.db2.gz	SJSBGIPGCLVRSE-UHFFFAOYSA-N	-1	3	329.324	1.559	20	5		EDBDHM
CC(C)n1cnnc1CNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000735966532	578943615	/nfs/dbraw/zinc/94/36/15/578943615.db2.gz	SJSBGIPGCLVRSE-UHFFFAOYSA-N	-1	3	329.324	1.559	20	5		EDBDHM
O=C(NC1CC1)[C@H]1CCCN1c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000738018665	579150403	/nfs/dbraw/zinc/15/04/03/579150403.db2.gz	DHWOBXPYGCENPU-GFCCVEGCSA-N	-1	3	343.347	1.022	20	5		EDBDHM
O=C(NC1CC1)[C@H]1CCCN1c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000738018665	579150404	/nfs/dbraw/zinc/15/04/04/579150404.db2.gz	DHWOBXPYGCENPU-GFCCVEGCSA-N	-1	3	343.347	1.022	20	5		EDBDHM
COCCON=C([O-])Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C	ZINC000753139386	579873361	/nfs/dbraw/zinc/87/33/61/579873361.db2.gz	NXMYJDUHXXBKOD-UHFFFAOYSA-N	-1	3	327.293	1.389	20	5		EDBDHM
COCCO[N-]C(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C	ZINC000753139386	579873362	/nfs/dbraw/zinc/87/33/62/579873362.db2.gz	NXMYJDUHXXBKOD-UHFFFAOYSA-N	-1	3	327.293	1.389	20	5		EDBDHM
Cc1cc(=O)[n-]c(Cn2cc(Br)c(=O)c([N+](=O)[O-])c2)n1	ZINC000763271624	580096716	/nfs/dbraw/zinc/09/67/16/580096716.db2.gz	KHTHVDBNOHCHPB-UHFFFAOYSA-N	-1	3	341.121	1.371	20	5		EDBDHM
Cc1nonc1[N-]C(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	ZINC000766577685	580169819	/nfs/dbraw/zinc/16/98/19/580169819.db2.gz	ONHCVIMJWWMNFD-UHFFFAOYSA-N	-1	3	345.271	1.192	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CCCCC1	ZINC000768804155	580220758	/nfs/dbraw/zinc/22/07/58/580220758.db2.gz	QDLLDFANLNFQPF-UHFFFAOYSA-N	-1	3	348.402	1.811	20	5		EDBDHM
O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)NN1CC(=O)[N-]C1=O	ZINC000770652248	580266804	/nfs/dbraw/zinc/26/68/04/580266804.db2.gz	JMQVDISQYOGAMM-UHFFFAOYSA-N	-1	3	347.209	1.202	20	5		EDBDHM
Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1nnc(-c2ccccn2)[n-]1	ZINC000771608777	580290043	/nfs/dbraw/zinc/29/00/43/580290043.db2.gz	FDRCIMDGWIFOMK-UHFFFAOYSA-N	-1	3	325.288	1.609	20	5		EDBDHM
Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2ccccn2)n[n-]1	ZINC000771608777	580290044	/nfs/dbraw/zinc/29/00/44/580290044.db2.gz	FDRCIMDGWIFOMK-UHFFFAOYSA-N	-1	3	325.288	1.609	20	5		EDBDHM
Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1n[n-]c(-c2ccccn2)n1	ZINC000771608777	580290045	/nfs/dbraw/zinc/29/00/45/580290045.db2.gz	FDRCIMDGWIFOMK-UHFFFAOYSA-N	-1	3	325.288	1.609	20	5		EDBDHM
C[C@@H]1CCNC(=O)[C@H]1[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000799428422	581027875	/nfs/dbraw/zinc/02/78/75/581027875.db2.gz	LVOBXXBJPPIUQY-KCJUWKMLSA-N	-1	3	327.287	1.327	20	5		EDBDHM
COc1c([O-])ccc(CN2CCC[C@@H](N3CCCC3=O)C2)c1[N+](=O)[O-]	ZINC000891994844	590733577	/nfs/dbraw/zinc/73/35/77/590733577.db2.gz	CRZGYGLWEBRUQS-CYBMUJFWSA-N	-1	3	349.387	1.896	20	5		EDBDHM
COc1c([O-])ccc(CN2CCSC[C@@H]2CCO)c1[N+](=O)[O-]	ZINC000892221779	590871333	/nfs/dbraw/zinc/87/13/33/590871333.db2.gz	FTZRBALNNXERFC-NSHDSACASA-N	-1	3	328.390	1.609	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCOC1CCSCC1	ZINC000908462150	592501814	/nfs/dbraw/zinc/50/18/14/592501814.db2.gz	QJGWOSQJYDWHID-UHFFFAOYSA-N	-1	3	346.430	1.785	20	5		EDBDHM
C[C@H]1CC2(CC([N-]S(=O)(=O)c3ccccc3[N+](=O)[O-])C2)CO1	ZINC000907723779	592771535	/nfs/dbraw/zinc/77/15/35/592771535.db2.gz	NRBYKIVNWORBKG-IFQILLTASA-N	-1	3	326.374	1.831	20	5		EDBDHM
COCC[C@H]([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C(=O)OC	ZINC000812393515	593500767	/nfs/dbraw/zinc/50/07/67/593500767.db2.gz	ODOXAGMOYHYPAO-NSHDSACASA-N	-1	3	346.286	1.381	20	5		EDBDHM
C[C@H](C[C@H](O)c1ccco1)Nc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820234982	593801410	/nfs/dbraw/zinc/80/14/10/593801410.db2.gz	PSUBXADJBXYZSE-KCJUWKMLSA-N	-1	3	345.319	1.687	20	5		EDBDHM
C[C@H](C[C@H](O)c1ccco1)Nc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820234982	593801411	/nfs/dbraw/zinc/80/14/11/593801411.db2.gz	PSUBXADJBXYZSE-KCJUWKMLSA-N	-1	3	345.319	1.687	20	5		EDBDHM
Cc1cccc(NCCNc2nccc(-c3nnn[n-]3)c2[N+](=O)[O-])n1	ZINC000822323713	594031547	/nfs/dbraw/zinc/03/15/47/594031547.db2.gz	NPXMHNAHEPQBPR-UHFFFAOYSA-N	-1	3	341.335	1.397	20	5		EDBDHM
Cc1cccc(NCCNc2nccc(-c3nn[n-]n3)c2[N+](=O)[O-])n1	ZINC000822323713	594031549	/nfs/dbraw/zinc/03/15/49/594031549.db2.gz	NPXMHNAHEPQBPR-UHFFFAOYSA-N	-1	3	341.335	1.397	20	5		EDBDHM
NC(=O)[C@@H]1CCCCC[C@H]1Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000822860085	594112606	/nfs/dbraw/zinc/11/26/06/594112606.db2.gz	MXDVHTRUSGIXQE-ZYHUDNBSSA-N	-1	3	345.363	1.621	20	5		EDBDHM
NC(=O)[C@@H]1CCCCC[C@H]1Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000822860085	594112607	/nfs/dbraw/zinc/11/26/07/594112607.db2.gz	MXDVHTRUSGIXQE-ZYHUDNBSSA-N	-1	3	345.363	1.621	20	5		EDBDHM
CC[C@H](OC)C(=O)Nc1cc(-c2nnn[n-]2)cc([N+](=O)[O-])c1Cl	ZINC000825154983	594137401	/nfs/dbraw/zinc/13/74/01/594137401.db2.gz	WTMDSJDQXDNZHU-VIFPVBQESA-N	-1	3	340.727	1.792	20	5		EDBDHM
CC[C@H](OC)C(=O)Nc1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl	ZINC000825154983	594137403	/nfs/dbraw/zinc/13/74/03/594137403.db2.gz	WTMDSJDQXDNZHU-VIFPVBQESA-N	-1	3	340.727	1.792	20	5		EDBDHM
O=C(Cc1cccc(-c2nnn[n-]2)c1)NCc1cccc([N+](=O)[O-])c1	ZINC000823097810	594152978	/nfs/dbraw/zinc/15/29/78/594152978.db2.gz	CKHVLQDIMODRPH-UHFFFAOYSA-N	-1	3	338.327	1.634	20	5		EDBDHM
O=C(Cc1cccc(-c2nn[n-]n2)c1)NCc1cccc([N+](=O)[O-])c1	ZINC000823097810	594152980	/nfs/dbraw/zinc/15/29/80/594152980.db2.gz	CKHVLQDIMODRPH-UHFFFAOYSA-N	-1	3	338.327	1.634	20	5		EDBDHM
O=C(OCc1ccc(-c2nnn[n-]2)cc1)c1ccc([N+](=O)[O-])cn1	ZINC000823418837	594199869	/nfs/dbraw/zinc/19/98/69/594199869.db2.gz	XLSJLUOGIXVHDJ-UHFFFAOYSA-N	-1	3	326.272	1.527	20	5		EDBDHM
O=C(OCc1ccc(-c2nn[n-]n2)cc1)c1ccc([N+](=O)[O-])cn1	ZINC000823418837	594199870	/nfs/dbraw/zinc/19/98/70/594199870.db2.gz	XLSJLUOGIXVHDJ-UHFFFAOYSA-N	-1	3	326.272	1.527	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NCCNc1ccccn1	ZINC000823630476	594223180	/nfs/dbraw/zinc/22/31/80/594223180.db2.gz	XMVUJYWXUUSZRV-UHFFFAOYSA-N	-1	3	326.320	1.694	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NCCNc1ccccn1	ZINC000823630476	594223181	/nfs/dbraw/zinc/22/31/81/594223181.db2.gz	XMVUJYWXUUSZRV-UHFFFAOYSA-N	-1	3	326.320	1.694	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCCOC[C@H]2CCCO2)c(-c2nnn[n-]2)c1	ZINC000823639944	594223866	/nfs/dbraw/zinc/22/38/66/594223866.db2.gz	MZINFFITHFQGHS-GFCCVEGCSA-N	-1	3	348.363	1.773	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCCOC[C@H]2CCCO2)c(-c2nn[n-]n2)c1	ZINC000823639944	594223867	/nfs/dbraw/zinc/22/38/67/594223867.db2.gz	MZINFFITHFQGHS-GFCCVEGCSA-N	-1	3	348.363	1.773	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC(OCCCO)CC2)c(-c2nnn[n-]2)c1	ZINC000823640252	594223917	/nfs/dbraw/zinc/22/39/17/594223917.db2.gz	YYJNITKDFCEXSS-UHFFFAOYSA-N	-1	3	348.363	1.143	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC(OCCCO)CC2)c(-c2nn[n-]n2)c1	ZINC000823640252	594223918	/nfs/dbraw/zinc/22/39/18/594223918.db2.gz	YYJNITKDFCEXSS-UHFFFAOYSA-N	-1	3	348.363	1.143	20	5		EDBDHM
O=[N+]([O-])c1ccc(Nc2ccn(CC(F)F)n2)c(-c2nnn[n-]2)c1	ZINC000823644268	594224394	/nfs/dbraw/zinc/22/43/94/594224394.db2.gz	IRAQCIVHZBFCFP-UHFFFAOYSA-N	-1	3	336.262	1.980	20	5		EDBDHM
O=[N+]([O-])c1ccc(Nc2ccn(CC(F)F)n2)c(-c2nn[n-]n2)c1	ZINC000823644268	594224395	/nfs/dbraw/zinc/22/43/95/594224395.db2.gz	IRAQCIVHZBFCFP-UHFFFAOYSA-N	-1	3	336.262	1.980	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC(c3c[nH]cn3)CC2)c(-c2nnn[n-]2)c1	ZINC000823647947	594224433	/nfs/dbraw/zinc/22/44/33/594224433.db2.gz	QPWWNEZIJDNGAT-UHFFFAOYSA-N	-1	3	341.335	1.277	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC(c3c[nH]cn3)CC2)c(-c2nn[n-]n2)c1	ZINC000823647947	594224434	/nfs/dbraw/zinc/22/44/34/594224434.db2.gz	QPWWNEZIJDNGAT-UHFFFAOYSA-N	-1	3	341.335	1.277	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H]2CCCn3ccnc32)c(-c2nnn[n-]2)c1	ZINC000826501022	594503305	/nfs/dbraw/zinc/50/33/05/594503305.db2.gz	WCBBSPKIBFSCEC-VIFPVBQESA-N	-1	3	341.335	1.356	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H]2CCCn3ccnc32)c(-c2nn[n-]n2)c1	ZINC000826501022	594503306	/nfs/dbraw/zinc/50/33/06/594503306.db2.gz	WCBBSPKIBFSCEC-VIFPVBQESA-N	-1	3	341.335	1.356	20	5		EDBDHM
CCc1[nH]nc(C(=O)OCc2cc(=O)[n-]c(C3CC3)n2)c1[N+](=O)[O-]	ZINC000837656699	595162724	/nfs/dbraw/zinc/16/27/24/595162724.db2.gz	IHEVSPOURNFVNA-UHFFFAOYSA-N	-1	3	333.304	1.610	20	5		EDBDHM
C[C@@H](Cn1ccnc1)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848580852	595408485	/nfs/dbraw/zinc/40/84/85/595408485.db2.gz	GWFCCIPDKUDGPF-JTQLQIEISA-N	-1	3	340.286	1.968	20	5		EDBDHM
COC[C@](C)(O)C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848582586	595409216	/nfs/dbraw/zinc/40/92/16/595409216.db2.gz	GSVNUIJEVBRQAE-GFCCVEGCSA-N	-1	3	334.275	1.080	20	5		EDBDHM
C[C@H](C[S@@](C)=O)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848586570	595410109	/nfs/dbraw/zinc/41/01/09/595410109.db2.gz	MZXOEMUAXTZWNW-CWMRNNLJSA-N	-1	3	336.316	1.450	20	5		EDBDHM
C[C@@H](C[S@](C)=O)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848586575	595410404	/nfs/dbraw/zinc/41/04/04/595410404.db2.gz	MZXOEMUAXTZWNW-ZCAPAMDOSA-N	-1	3	336.316	1.450	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)C(OC)OC	ZINC000849407676	595522066	/nfs/dbraw/zinc/52/20/66/595522066.db2.gz	VJMFTNNOHVEXBS-SNVBAGLBSA-N	-1	3	348.377	1.279	20	5		EDBDHM
CC(C)(C)N1CC[C@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000849420381	595524158	/nfs/dbraw/zinc/52/41/58/595524158.db2.gz	TYFHZNXCTPRHDT-VIFPVBQESA-N	-1	3	333.435	1.807	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H](CO)C2CCC2)c1	ZINC000849421462	595524378	/nfs/dbraw/zinc/52/43/78/595524378.db2.gz	PIMMMVYMTLHHAY-SNVBAGLBSA-N	-1	3	348.808	1.996	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)[C@H](C)N1CCOCC1	ZINC000119723254	596725494	/nfs/dbraw/zinc/72/54/94/596725494.db2.gz	DLUPUYISDMLJNK-UWVGGRQHSA-N	-1	3	349.434	1.044	20	5		EDBDHM
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCN(C3CC3)C[C@H](C)C2)n1	ZINC000563203516	306323263	/nfs/dbraw/zinc/32/32/63/306323263.db2.gz	CJXXOZIVJDZMJB-JTQLQIEISA-N	-1	3	334.376	1.917	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)C(=O)OC(C)C	ZINC000451980462	305376014	/nfs/dbraw/zinc/37/60/14/305376014.db2.gz	DQPRFXMXFXHYNX-VIFPVBQESA-N	-1	3	346.361	1.222	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1[C@@H]2CCO[C@H]2C12CCC2	ZINC000245533921	139078218	/nfs/dbraw/zinc/07/82/18/139078218.db2.gz	HRUSONYNQNQSGK-ZLKJLUDKSA-N	-1	3	338.385	1.831	20	5		EDBDHM
O=C(c1csc(=O)[n-]1)N1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000348929298	284760369	/nfs/dbraw/zinc/76/03/69/284760369.db2.gz	FPVXMFRRHTYLNU-UHFFFAOYSA-N	-1	3	334.357	1.719	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@H]1NCCc2ccccc21	ZINC000261725646	139220908	/nfs/dbraw/zinc/22/09/08/139220908.db2.gz	RECCURCBFKNORK-CQSZACIVSA-N	-1	3	347.396	1.760	20	5		EDBDHM
COc1cc(CN[C@H]2CCN(CC(F)F)C2)c([N+](=O)[O-])cc1[O-]	ZINC000418130664	251339445	/nfs/dbraw/zinc/33/94/45/251339445.db2.gz	GUTYYSCETMQKLX-JTQLQIEISA-N	-1	3	331.319	1.738	20	5		EDBDHM
O=[N+]([O-])c1cnn(CC[N-]S(=O)(=O)c2ccc(Cl)cc2F)c1	ZINC000152827015	224016739	/nfs/dbraw/zinc/01/67/39/224016739.db2.gz	BLQSGZDDDBBEOD-UHFFFAOYSA-N	-1	3	348.743	1.562	20	5		EDBDHM
CCOC(=O)C[C@H](C)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000270553583	140122693	/nfs/dbraw/zinc/12/26/93/140122693.db2.gz	NBCRFIALKACWQT-JTQLQIEISA-N	-1	3	330.362	1.462	20	5		EDBDHM
CS[C@H](CO)[C@H](C)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000271742566	140342893	/nfs/dbraw/zinc/34/28/93/140342893.db2.gz	WQGSPXBQSHJIJW-CMPLNLGQSA-N	-1	3	348.446	1.602	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCCOCC1	ZINC000271997244	140384971	/nfs/dbraw/zinc/38/49/71/140384971.db2.gz	RCGXGFYDDANMMJ-JTQLQIEISA-N	-1	3	330.362	1.451	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@H](C)N2CCc3ncc([N+](=O)[O-])cc3C2)on1	ZINC000332204862	141139998	/nfs/dbraw/zinc/13/99/98/141139998.db2.gz	ZWVXBWUULYNZKM-JTQLQIEISA-N	-1	3	331.332	1.672	20	5		EDBDHM
Cc1nn(C)cc1C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000416456910	304321255	/nfs/dbraw/zinc/32/12/55/304321255.db2.gz	MTMQZHVJIPBVIU-UHFFFAOYSA-N	-1	3	338.389	1.732	20	5		EDBDHM
CCC[C@H](C)[C@H](CO)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000572488675	306591172	/nfs/dbraw/zinc/59/11/72/306591172.db2.gz	QDESCJXVFVYUKV-JQWIXIFHSA-N	-1	3	330.406	1.979	20	5		EDBDHM
CC(C)(C)[C@H]([N-]S(C)(=O)=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1	ZINC000347976379	143386269	/nfs/dbraw/zinc/38/62/69/143386269.db2.gz	WGCHTVIVCHNNJD-LLVKDONJSA-N	-1	3	347.368	1.636	20	5		EDBDHM
COC(=O)CSCC[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000357338754	151001017	/nfs/dbraw/zinc/00/10/17/151001017.db2.gz	AFFYAJCVXZLHRF-UHFFFAOYSA-N	-1	3	348.402	1.088	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CSC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000352334268	162123676	/nfs/dbraw/zinc/12/36/76/162123676.db2.gz	ZIVKTUCIPOSRIR-WPRPVWTQSA-N	-1	3	332.403	1.633	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCOCC(F)(F)F)cc1[N+](=O)[O-]	ZINC000122989506	222194386	/nfs/dbraw/zinc/19/43/86/222194386.db2.gz	ILBYSLIPFUHRKZ-UHFFFAOYSA-N	-1	3	348.324	1.822	20	5		EDBDHM
O=C(NCc1ccc(-c2nnn[n-]2)cc1)c1csc([N+](=O)[O-])c1	ZINC000171820178	227300103	/nfs/dbraw/zinc/30/01/03/227300103.db2.gz	FLLSQPKAJVBTGR-UHFFFAOYSA-N	-1	3	330.329	1.766	20	5		EDBDHM
O=C(NCc1ccc(-c2nn[n-]n2)cc1)c1csc([N+](=O)[O-])c1	ZINC000171820178	227300107	/nfs/dbraw/zinc/30/01/07/227300107.db2.gz	FLLSQPKAJVBTGR-UHFFFAOYSA-N	-1	3	330.329	1.766	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CCOC(C)C)cc1[N+](=O)[O-]	ZINC000275366799	268330542	/nfs/dbraw/zinc/33/05/42/268330542.db2.gz	JQJSJGTYWSHXJB-UHFFFAOYSA-N	-1	3	336.341	1.446	20	5		EDBDHM
COc1cc(C(=O)[N-]OC[C@@H]2CCOC2)c([N+](=O)[O-])cc1OC	ZINC000276508026	268434676	/nfs/dbraw/zinc/43/46/76/268434676.db2.gz	VWUDFCZVDUYCDY-SECBINFHSA-N	-1	3	326.305	1.310	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCO1	ZINC000278593282	268688368	/nfs/dbraw/zinc/68/83/68/268688368.db2.gz	BLRXWWQFXCLJOK-KBPBESRZSA-N	-1	3	344.389	1.208	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CCCN(C)[C@H]1C	ZINC000344068749	302049712	/nfs/dbraw/zinc/04/97/12/302049712.db2.gz	MLJIHLSSKMTUMB-RYUDHWBXSA-N	-1	3	327.406	1.664	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H](OC)C1CC1	ZINC000293940993	303041847	/nfs/dbraw/zinc/04/18/47/303041847.db2.gz	ZSLAWNBPQLBYOU-GFCCVEGCSA-N	-1	3	330.362	1.307	20	5		EDBDHM
CCC[C@@](C)([N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C(=O)OC	ZINC000298266838	303511189	/nfs/dbraw/zinc/51/11/89/303511189.db2.gz	DTUXKJVMZFERGQ-CQSZACIVSA-N	-1	3	344.389	1.746	20	5		EDBDHM
Cc1cc(C(=O)N2CCO[C@H](c3ccco3)C2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000367162927	303838541	/nfs/dbraw/zinc/83/85/41/303838541.db2.gz	HKDZJWBXVGDDQK-LBPRGKRZSA-N	-1	3	333.300	1.811	20	5		EDBDHM
O=C(NCCn1cc([N+](=O)[O-])cn1)c1cc(=O)c2ccccc2[n-]1	ZINC000428715574	305015454	/nfs/dbraw/zinc/01/54/54/305015454.db2.gz	GOSVWOJESVONKJ-UHFFFAOYSA-N	-1	3	327.300	1.063	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H]2CCCC(=O)N2)cc1C	ZINC000433444785	305109228	/nfs/dbraw/zinc/10/92/28/305109228.db2.gz	TVAUVYBJLMDKBA-NSHDSACASA-N	-1	3	341.389	1.159	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CC2([S@@](C)=O)CC2)cc1[N+](=O)[O-]	ZINC000443092464	305235231	/nfs/dbraw/zinc/23/52/31/305235231.db2.gz	ZXXCMBWNKOYDNF-LJQANCHMSA-N	-1	3	338.432	1.154	20	5		EDBDHM
COC(=O)[C@@](C)([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C1CC1	ZINC000545934398	306087789	/nfs/dbraw/zinc/08/77/89/306087789.db2.gz	CXKXGJBKZNCJNX-LBPRGKRZSA-N	-1	3	348.402	1.585	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1cc(C)no1	ZINC000143488146	441872859	/nfs/dbraw/zinc/87/28/59/441872859.db2.gz	KCCNZAPOTNUDNZ-UHFFFAOYSA-N	-1	3	327.318	1.378	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CCCC[C@H]1C(N)=O	ZINC000175297797	442035684	/nfs/dbraw/zinc/03/56/84/442035684.db2.gz	RWEQONSPQMJHAD-MNOVXSKESA-N	-1	3	341.389	1.226	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCC(=O)N(C)C2)c1C	ZINC000120788945	442133554	/nfs/dbraw/zinc/13/35/54/442133554.db2.gz	RZGFNUNKAQVRMT-LLVKDONJSA-N	-1	3	341.389	1.111	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1C[C@H](C)N(C2CC2)C1	ZINC000126301954	442097129	/nfs/dbraw/zinc/09/71/29/442097129.db2.gz	NOYPBYGVDCMLBF-RYUDHWBXSA-N	-1	3	339.417	1.807	20	5		EDBDHM
COCCCN1CCC(NC(=O)c2ccc([N+](=O)[O-])cc2[O-])CC1	ZINC000157757324	442610634	/nfs/dbraw/zinc/61/06/34/442610634.db2.gz	CSHVIOVGWDGZGS-UHFFFAOYSA-N	-1	3	337.376	1.531	20	5		EDBDHM
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000187578799	442681819	/nfs/dbraw/zinc/68/18/19/442681819.db2.gz	YIKMPHBPSMPEAU-LBPRGKRZSA-N	-1	3	336.392	1.056	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]C[C@@H]2CC[C@H](O)C2)cc1[N+](=O)[O-]	ZINC000188352288	442742480	/nfs/dbraw/zinc/74/24/80/442742480.db2.gz	RZJXDCCRNOOZAS-ZJUUUORDSA-N	-1	3	332.353	1.482	20	5		EDBDHM
O=C(c1cccc2[n-]nnc21)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000188502860	442757419	/nfs/dbraw/zinc/75/74/19/442757419.db2.gz	XSELTTFLITZQAR-UHFFFAOYSA-N	-1	3	339.311	1.770	20	5		EDBDHM
O=C(c1cccc2nn[n-]c21)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000188502860	442757421	/nfs/dbraw/zinc/75/74/21/442757421.db2.gz	XSELTTFLITZQAR-UHFFFAOYSA-N	-1	3	339.311	1.770	20	5		EDBDHM
O=C(c1cccc2n[n-]nc21)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000188502860	442757423	/nfs/dbraw/zinc/75/74/23/442757423.db2.gz	XSELTTFLITZQAR-UHFFFAOYSA-N	-1	3	339.311	1.770	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCCn2ccnn2)c(Cl)c1	ZINC000183163137	318519405	/nfs/dbraw/zinc/51/94/05/318519405.db2.gz	INJCBRCVJHMGOU-UHFFFAOYSA-N	-1	3	345.768	1.208	20	5		EDBDHM
COC(=O)c1cc([N-]C(=O)c2n[nH]cc2[N+](=O)[O-])cc(C(=O)OC)c1	ZINC000196746538	443035430	/nfs/dbraw/zinc/03/54/30/443035430.db2.gz	QDAVUTBCXQXIBM-UHFFFAOYSA-N	-1	3	348.271	1.143	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC(=O)OCC2CC2)c1C	ZINC000268774893	443104736	/nfs/dbraw/zinc/10/47/36/443104736.db2.gz	AZDRTVCPERMCLT-UHFFFAOYSA-N	-1	3	342.373	1.443	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@H]1CCC[C@H]1CO	ZINC000228605624	443124755	/nfs/dbraw/zinc/12/47/55/443124755.db2.gz	QMKPRRWZQNDIEF-WPRPVWTQSA-N	-1	3	334.781	1.688	20	5		EDBDHM
C[S@](=O)Cc1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000185666629	443235555	/nfs/dbraw/zinc/23/55/55/443235555.db2.gz	JMEPDIRGGZVUMD-QHCPKHFHSA-N	-1	3	335.341	1.826	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCOCC2CC2)cc1C	ZINC000264454098	443297885	/nfs/dbraw/zinc/29/78/85/443297885.db2.gz	FDRJVYSGEUWORV-UHFFFAOYSA-N	-1	3	328.390	1.917	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[C@H]1CCCCO1	ZINC000272095105	443525235	/nfs/dbraw/zinc/52/52/35/443525235.db2.gz	VTPHUUYJWYOWRZ-BXKDBHETSA-N	-1	3	332.353	1.970	20	5		EDBDHM
CCCCOC(=O)C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000265384139	443624167	/nfs/dbraw/zinc/62/41/67/443624167.db2.gz	GGZXCEMNXWSJSZ-UHFFFAOYSA-N	-1	3	330.362	1.525	20	5		EDBDHM
NC(=O)CCOc1ccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)cc1	ZINC000439000649	320037965	/nfs/dbraw/zinc/03/79/65/320037965.db2.gz	NFMFJIZVGJOGEK-UHFFFAOYSA-N	-1	3	346.299	1.202	20	5		EDBDHM
COc1ccc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)nc1	ZINC000443931745	320115444	/nfs/dbraw/zinc/11/54/44/320115444.db2.gz	WNDWBUULDOIDOW-UHFFFAOYSA-N	-1	3	341.320	1.616	20	5		EDBDHM
O=C1CC[C@H](N2CCN(Cc3cc([O-])ccc3[N+](=O)[O-])CC2)CCN1	ZINC000449702950	320200188	/nfs/dbraw/zinc/20/01/88/320200188.db2.gz	STSPTOFLTZIDKD-AWEZNQCLSA-N	-1	3	348.403	1.087	20	5		EDBDHM
C[C@@H]1C[C@H]1N1CCN(C(=O)c2cc([N+](=O)[O-])c[n-]c2=O)C[C@@H](C)C1	ZINC000452121571	320243292	/nfs/dbraw/zinc/24/32/92/320243292.db2.gz	KNHKYAQQTMJNED-MISXGVKJSA-N	-1	3	334.376	1.498	20	5		EDBDHM
COC(=O)CCCCC[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000298488622	443782063	/nfs/dbraw/zinc/78/20/63/443782063.db2.gz	LOLSZCQDUVVRHI-UHFFFAOYSA-N	-1	3	344.389	1.915	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)c1nnc(C)[nH]1	ZINC000285408201	443973199	/nfs/dbraw/zinc/97/31/99/443973199.db2.gz	PJBFGOYWTGGMDH-ZETCQYMHSA-N	-1	3	341.349	1.069	20	5		EDBDHM
COCCN(C)CCCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000563182666	321100030	/nfs/dbraw/zinc/10/00/30/321100030.db2.gz	OTXLEMMLPMCOSV-UHFFFAOYSA-N	-1	3	345.783	1.652	20	5		EDBDHM
O=C([O-])c1cnccc1N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000565660864	321195893	/nfs/dbraw/zinc/19/58/93/321195893.db2.gz	OPHAHODLYTWXEY-JTQLQIEISA-N	-1	3	329.316	1.774	20	5		EDBDHM
CC[C@@H](C)[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)OC	ZINC000295179369	444168841	/nfs/dbraw/zinc/16/88/41/444168841.db2.gz	BMZHGWZSISIKSX-MFKMUULPSA-N	-1	3	346.405	1.943	20	5		EDBDHM
COC(=O)CCCO[N-]C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21	ZINC000290465168	444284373	/nfs/dbraw/zinc/28/43/73/444284373.db2.gz	CMBTZKMCULZFRD-UHFFFAOYSA-N	-1	3	349.299	1.463	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC)C1CC1	ZINC000323793266	444347132	/nfs/dbraw/zinc/34/71/32/444347132.db2.gz	DRNCDJPLCOQMRU-LBPRGKRZSA-N	-1	3	342.373	1.848	20	5		EDBDHM
COc1ccc(C[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])cn1	ZINC000337810623	444418669	/nfs/dbraw/zinc/41/86/69/444418669.db2.gz	NRJRIHOVAIQCEO-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@H]2CCOC2)cc1C	ZINC000343991685	444714122	/nfs/dbraw/zinc/71/41/22/444714122.db2.gz	MFGXPFGXNUHSGL-LBPRGKRZSA-N	-1	3	328.390	1.917	20	5		EDBDHM
COC(=O)[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C1CC1	ZINC000342508566	444722307	/nfs/dbraw/zinc/72/23/07/444722307.db2.gz	VBZSWQUDECOWCL-SNVBAGLBSA-N	-1	3	334.375	1.195	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCc1cnc(C)[n-]c1=O	ZINC000344091359	444776629	/nfs/dbraw/zinc/77/66/29/444776629.db2.gz	RGKCLHMJOWXWKV-UHFFFAOYSA-N	-1	3	338.345	1.186	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)c1nc(C)no1	ZINC000338904394	444923965	/nfs/dbraw/zinc/92/39/65/444923965.db2.gz	SBDLCGGABGAOPE-SSDOTTSWSA-N	-1	3	342.333	1.334	20	5		EDBDHM
O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)Nc1ncccc1[O-]	ZINC000341906658	445064900	/nfs/dbraw/zinc/06/49/00/445064900.db2.gz	ZQCCRYRVIWKNFO-UHFFFAOYSA-N	-1	3	345.315	1.133	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CC(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000343466855	445228080	/nfs/dbraw/zinc/22/80/80/445228080.db2.gz	RMZWAEKVPOIYBT-UHFFFAOYSA-N	-1	3	347.418	1.256	20	5		EDBDHM
Cn1ccc(CC[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])n1	ZINC000354685461	445339924	/nfs/dbraw/zinc/33/99/24/445339924.db2.gz	FXIXZWISSYPAIU-UHFFFAOYSA-N	-1	3	344.780	1.503	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]Cc2nc(CO)cs2)cc1[N+](=O)[O-]	ZINC000352079738	445478658	/nfs/dbraw/zinc/47/86/58/445478658.db2.gz	OMPBHPVBZVJHDI-UHFFFAOYSA-N	-1	3	349.415	1.392	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCc2cccnc2)c([N+](=O)[O-])c1	ZINC000352019690	445443674	/nfs/dbraw/zinc/44/36/74/445443674.db2.gz	CSVYZJFKHYXQQO-UHFFFAOYSA-N	-1	3	337.357	1.519	20	5		EDBDHM
COc1cc(CNc2ccc(OC(C)C)nn2)c([N+](=O)[O-])cc1[O-]	ZINC000357702279	445577743	/nfs/dbraw/zinc/57/77/43/445577743.db2.gz	QNOACICYPGTRBW-UHFFFAOYSA-N	-1	3	334.332	2.498	20	5		EDBDHM
COCc1nc(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])n[n-]1	ZINC000353827058	445773209	/nfs/dbraw/zinc/77/32/09/445773209.db2.gz	NMUPWASDPUJHNN-UHFFFAOYSA-N	-1	3	337.361	1.899	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](C)c2ncnn2C)c([N+](=O)[O-])c1	ZINC000353850486	445784129	/nfs/dbraw/zinc/78/41/29/445784129.db2.gz	PVGYKKCOMOTJPO-SECBINFHSA-N	-1	3	325.350	1.071	20	5		EDBDHM
COCC(=O)N1CCc2c1cccc2[N-]c1ncc([N+](=O)[O-])c(N)n1	ZINC000363779766	445875497	/nfs/dbraw/zinc/87/54/97/445875497.db2.gz	UAPMKNASDRHKAY-UHFFFAOYSA-N	-1	3	344.331	1.246	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCN(C3CC3)C2)c(Cl)c1	ZINC000354279307	446075663	/nfs/dbraw/zinc/07/56/63/446075663.db2.gz	BVELSAIIOKKJLC-SECBINFHSA-N	-1	3	345.808	1.763	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H](O)C(F)F)c2ncccc12	ZINC000361966860	446115947	/nfs/dbraw/zinc/11/59/47/446115947.db2.gz	ZCXUNKTXOLMJGC-VIFPVBQESA-N	-1	3	347.299	1.047	20	5		EDBDHM
Cc1cn2c(n1)CC[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C2	ZINC000365591337	446264676	/nfs/dbraw/zinc/26/46/76/446264676.db2.gz	BQELTGHKFPWHLF-LLVKDONJSA-N	-1	3	336.373	1.393	20	5		EDBDHM
CC[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)CCO1	ZINC000420731568	446777337	/nfs/dbraw/zinc/77/73/37/446777337.db2.gz	SDPCOXCFWMUSOP-CMPLNLGQSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CC[C@@H](C)[C@](C)(O)C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000443299541	447026735	/nfs/dbraw/zinc/02/67/35/447026735.db2.gz	RQTALIIPPMEBEY-BXUZGUMPSA-N	-1	3	330.406	1.979	20	5		EDBDHM
CNc1nc(C(=O)[N-]c2ncn(C3CCCCC3)n2)ccc1[N+](=O)[O-]	ZINC000456006728	447283039	/nfs/dbraw/zinc/28/30/39/447283039.db2.gz	MLTKEGWSQQKEOY-UHFFFAOYSA-N	-1	3	345.363	2.381	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CC12CCOCC2	ZINC000451893898	447775697	/nfs/dbraw/zinc/77/56/97/447775697.db2.gz	UHGSTBXJNHSDFI-ZDUSSCGKSA-N	-1	3	342.373	1.451	20	5		EDBDHM
CS(=O)(=O)[N-]c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000531887981	448167641	/nfs/dbraw/zinc/16/76/41/448167641.db2.gz	QCTJUSVCZCZXLI-UHFFFAOYSA-N	-1	3	336.329	1.614	20	5		EDBDHM
Cc1ncc(C(=O)N=c2cc(-c3cccc([N+](=O)[O-])c3)[n-][nH]2)c(N)n1	ZINC000532875371	448325719	/nfs/dbraw/zinc/32/57/19/448325719.db2.gz	UYOKICHJLKVUKB-UHFFFAOYSA-N	-1	3	339.315	1.340	20	5		EDBDHM
CCN1C[C@H](C[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])CC1=O	ZINC000593641800	449125664	/nfs/dbraw/zinc/12/56/64/449125664.db2.gz	SHRHZZQAENWCEX-NSHDSACASA-N	-1	3	341.389	1.050	20	5		EDBDHM
COc1ccc([N+](=O)[O-])c(C(=O)Nc2[nH][n-]c3cc(=O)ccc2-3)c1	ZINC000590558056	449190140	/nfs/dbraw/zinc/19/01/40/449190140.db2.gz	MKMCWRGUGHEKGI-UHFFFAOYSA-N	-1	3	328.284	2.438	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1CC12CCOCC2	ZINC000590762833	449282993	/nfs/dbraw/zinc/28/29/93/449282993.db2.gz	DESGZFHFNUWDHQ-LBPRGKRZSA-N	-1	3	342.373	1.451	20	5		EDBDHM
COc1ccc(C[C@H](CO)CNc2cc[n-]c(=O)c2[N+](=O)[O-])cc1O	ZINC000596143894	449383385	/nfs/dbraw/zinc/38/33/85/449383385.db2.gz	CFOBBSXAVHUUSI-NSHDSACASA-N	-1	3	349.343	1.673	20	5		EDBDHM
COCC1(C[N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])CC1	ZINC000594473642	449539293	/nfs/dbraw/zinc/53/92/93/449539293.db2.gz	CDWWMOCKQOKPRS-UHFFFAOYSA-N	-1	3	328.390	1.917	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H](C2CC2)[C@@H]2CCCCO2)nc1	ZINC000594485349	449549841	/nfs/dbraw/zinc/54/98/41/449549841.db2.gz	QFJZXYVKYAPKFW-GXTWGEPZSA-N	-1	3	341.389	1.616	20	5		EDBDHM
CN(C)C1(C[N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])CCCC1	ZINC000594748581	449664400	/nfs/dbraw/zinc/66/44/00/449664400.db2.gz	NBRDUSFAAHIBCQ-UHFFFAOYSA-N	-1	3	328.394	1.143	20	5		EDBDHM
C[C@@H]1CCC[C@@H](C)N1CC[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594754539	449669214	/nfs/dbraw/zinc/66/92/14/449669214.db2.gz	LWXMIRASELAORI-VXGBXAGGSA-N	-1	3	342.421	1.531	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-]C[C@@H](O)C1CC1	ZINC000594761878	449675904	/nfs/dbraw/zinc/67/59/04/449675904.db2.gz	LFLYSMVJBCGCND-GFCCVEGCSA-N	-1	3	337.357	1.192	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)C2(CO)CC2)c1C	ZINC000594827615	449733578	/nfs/dbraw/zinc/73/35/78/449733578.db2.gz	RQNIPNRPIUQRDM-NSHDSACASA-N	-1	3	328.390	1.651	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@]1(C)CC1(F)F	ZINC000594852202	449760409	/nfs/dbraw/zinc/76/04/09/449760409.db2.gz	OKJYBRMANMOKFR-LLVKDONJSA-N	-1	3	336.316	1.927	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN2CCC[C@@H](C)C2)c([N+](=O)[O-])s1	ZINC000601306855	449817316	/nfs/dbraw/zinc/81/73/16/449817316.db2.gz	SWNBKRIMIGQFSI-SNVBAGLBSA-N	-1	3	347.462	1.975	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H](C)[C@@H]2CCOC2)c(F)cc1[N+](=O)[O-]	ZINC000601356916	449869033	/nfs/dbraw/zinc/86/90/33/449869033.db2.gz	IDUNAGXOTULNCW-NXEZZACHSA-N	-1	3	332.353	1.746	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)CCn2cc([N+](=O)[O-])nc2C)[n-]1	ZINC000617871400	449889209	/nfs/dbraw/zinc/88/92/09/449889209.db2.gz	ACYCRSDKPAEOBO-UHFFFAOYSA-N	-1	3	336.308	1.028	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)CCn2cc([N+](=O)[O-])nc2C)c[n-]1	ZINC000617871400	449889213	/nfs/dbraw/zinc/88/92/13/449889213.db2.gz	ACYCRSDKPAEOBO-UHFFFAOYSA-N	-1	3	336.308	1.028	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@]12C[C@@H]1COC2(C)C	ZINC000599395557	449940609	/nfs/dbraw/zinc/94/06/09/449940609.db2.gz	AMMPAKRBEXGSMN-YGRLFVJLSA-N	-1	3	326.374	1.749	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC[C@H]2CCCOC2)c([N+](=O)[O-])c1	ZINC000599363159	449919642	/nfs/dbraw/zinc/91/96/42/449919642.db2.gz	CKJPQAUTZHUCLX-LLVKDONJSA-N	-1	3	344.389	1.698	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])C1CCCC1	ZINC000599473158	450002842	/nfs/dbraw/zinc/00/28/42/450002842.db2.gz	YQBVPVVCGCNMKF-UHFFFAOYSA-N	-1	3	326.374	1.774	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CO[C@H](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000599482104	450010042	/nfs/dbraw/zinc/01/00/42/450010042.db2.gz	MRPBQORXUNUIRL-KOLCDFICSA-N	-1	3	332.403	1.811	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CO[C@H](C3CC3)C2)c(F)c1	ZINC000599483791	450012284	/nfs/dbraw/zinc/01/22/84/450012284.db2.gz	WHZJIJAIHUDUDU-SKDRFNHKSA-N	-1	3	330.337	1.580	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2C[C@H](C)O[C@@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000601499717	450019785	/nfs/dbraw/zinc/01/97/85/450019785.db2.gz	RLUIUAGVRLSPCH-IQJOONFLSA-N	-1	3	332.353	1.887	20	5		EDBDHM
CN(C)C1(C[N-]S(=O)(=O)c2cccnc2[N+](=O)[O-])CCCCC1	ZINC000610261054	450173222	/nfs/dbraw/zinc/17/32/22/450173222.db2.gz	UUYHJIQGZYIVHI-UHFFFAOYSA-N	-1	3	342.421	1.533	20	5		EDBDHM
CCCc1[nH]nc(C(=O)[N-]c2cc(C(N)=O)sc2C)c1[N+](=O)[O-]	ZINC000610887157	450369442	/nfs/dbraw/zinc/36/94/42/450369442.db2.gz	UTTBZDUGXBEGGN-UHFFFAOYSA-N	-1	3	337.361	1.992	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)c2ccc(NC)c([N+](=O)[O-])c2)[n-]1	ZINC000619448034	450476632	/nfs/dbraw/zinc/47/66/32/450476632.db2.gz	ZPYSNFFVRQXFEC-UHFFFAOYSA-N	-1	3	333.304	1.789	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)c2ccc(NC)c([N+](=O)[O-])c2)c[n-]1	ZINC000619448034	450476634	/nfs/dbraw/zinc/47/66/34/450476634.db2.gz	ZPYSNFFVRQXFEC-UHFFFAOYSA-N	-1	3	333.304	1.789	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1CCOC(C)(C)C1	ZINC000619493638	450490494	/nfs/dbraw/zinc/49/04/94/450490494.db2.gz	YVQSPVSHWZVNQO-JTQLQIEISA-N	-1	3	344.389	1.839	20	5		EDBDHM
O=C(COC(=O)c1cncc([O-])c1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000732394734	578709228	/nfs/dbraw/zinc/70/92/28/578709228.db2.gz	SVLYLQOCBDGEJK-UHFFFAOYSA-N	-1	3	343.295	1.442	20	5		EDBDHM
COC(=O)c1cc(OS(=O)(=O)c2cn[n-]c2C)ccc1[N+](=O)[O-]	ZINC000732670380	578723428	/nfs/dbraw/zinc/72/34/28/578723428.db2.gz	ZOCBLJGOFRGPLQ-UHFFFAOYSA-N	-1	3	341.301	1.181	20	5		EDBDHM
CC(C)N1C[C@H](Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1=O	ZINC000735874434	578931357	/nfs/dbraw/zinc/93/13/57/578931357.db2.gz	DPNYLIHFJPEMBF-SNVBAGLBSA-N	-1	3	331.336	1.196	20	5		EDBDHM
CC(C)N1C[C@H](Nc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1=O	ZINC000735874434	578931359	/nfs/dbraw/zinc/93/13/59/578931359.db2.gz	DPNYLIHFJPEMBF-SNVBAGLBSA-N	-1	3	331.336	1.196	20	5		EDBDHM
C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000736807039	579022577	/nfs/dbraw/zinc/02/25/77/579022577.db2.gz	KGLLZSJAZDGJGU-HZMBPMFUSA-N	-1	3	335.360	1.705	20	5		EDBDHM
COCCN1CCC[C@@H](Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000737006403	579039964	/nfs/dbraw/zinc/03/99/64/579039964.db2.gz	IBLDOSIDNPTQSG-GFCCVEGCSA-N	-1	3	347.379	1.298	20	5		EDBDHM
CN1CCN(CCCNc2ccc(/C=C/C(=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000746994128	579621919	/nfs/dbraw/zinc/62/19/19/579621919.db2.gz	BFHWDUJMXBJYAL-GQCTYLIASA-N	-1	3	348.403	1.742	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)n[nH]1	ZINC000778005114	580454706	/nfs/dbraw/zinc/45/47/06/580454706.db2.gz	RAXHNLBEONVGDI-UHFFFAOYSA-N	-1	3	342.352	1.806	20	5		EDBDHM
COC(=O)CCC(C)(C)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768854939	580222546	/nfs/dbraw/zinc/22/25/46/580222546.db2.gz	VSANKANDMFIHFN-UHFFFAOYSA-N	-1	3	336.391	1.666	20	5		EDBDHM
Cc1cc(C(=O)NCc2nnc(C(F)(F)F)[n-]2)c(N)c([N+](=O)[O-])c1	ZINC000775913684	580404310	/nfs/dbraw/zinc/40/43/10/580404310.db2.gz	IFBLAEZAEGTJDB-UHFFFAOYSA-N	-1	3	344.253	1.552	20	5		EDBDHM
Cc1cc(C(=O)NCc2n[n-]c(C(F)(F)F)n2)c(N)c([N+](=O)[O-])c1	ZINC000775913684	580404311	/nfs/dbraw/zinc/40/43/11/580404311.db2.gz	IFBLAEZAEGTJDB-UHFFFAOYSA-N	-1	3	344.253	1.552	20	5		EDBDHM
Cc1cc(C(=O)NCc2nc(C(F)(F)F)n[n-]2)c(N)c([N+](=O)[O-])c1	ZINC000775913684	580404312	/nfs/dbraw/zinc/40/43/12/580404312.db2.gz	IFBLAEZAEGTJDB-UHFFFAOYSA-N	-1	3	344.253	1.552	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCN1CCC[C@@H]1C	ZINC000780864861	580535422	/nfs/dbraw/zinc/53/54/22/580535422.db2.gz	BTAQYCLWANTPEU-LBPRGKRZSA-N	-1	3	327.406	1.666	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H](C)C[C@@H](C)O)cc1[N+](=O)[O-]	ZINC000783000811	580590989	/nfs/dbraw/zinc/59/09/89/580590989.db2.gz	ZVBPTSVIVCBOPB-DTWKUNHWSA-N	-1	3	336.797	1.994	20	5		EDBDHM
O=C(Cn1ccc([N+](=O)[O-])n1)OCc1noc(-c2ccccc2[O-])n1	ZINC000783039673	580592095	/nfs/dbraw/zinc/59/20/95/580592095.db2.gz	MOYPFNGVUFVZEH-UHFFFAOYSA-N	-1	3	345.271	1.290	20	5		EDBDHM
C/C=C\C[C@@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C(=O)OCC	ZINC000788668162	580727660	/nfs/dbraw/zinc/72/76/60/580727660.db2.gz	HVDWQTKEGOGGIT-TZGMSPROSA-N	-1	3	348.402	1.833	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]Cc1cccnc1F	ZINC000795265179	580917074	/nfs/dbraw/zinc/91/70/74/580917074.db2.gz	JFPJCTCVGNAUMF-UHFFFAOYSA-N	-1	3	325.321	1.749	20	5		EDBDHM
O=C(OCCn1cc([N+](=O)[O-])ccc1=O)c1cc(F)cc2[n-]nnc21	ZINC000800262057	581049151	/nfs/dbraw/zinc/04/91/51/581049151.db2.gz	DCBFYYNVDRTJPI-UHFFFAOYSA-N	-1	3	347.262	1.024	20	5		EDBDHM
O=C(OCCn1cc([N+](=O)[O-])ccc1=O)c1cc(F)cc2nn[n-]c21	ZINC000800262057	581049152	/nfs/dbraw/zinc/04/91/52/581049152.db2.gz	DCBFYYNVDRTJPI-UHFFFAOYSA-N	-1	3	347.262	1.024	20	5		EDBDHM
O=C(OCCn1cc([N+](=O)[O-])ccc1=O)c1cc(F)cc2n[n-]nc21	ZINC000800262057	581049153	/nfs/dbraw/zinc/04/91/53/581049153.db2.gz	DCBFYYNVDRTJPI-UHFFFAOYSA-N	-1	3	347.262	1.024	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCO[C@@H](C(F)(F)F)C2)c(-c2nnn[n-]2)c1	ZINC000738371749	598855764	/nfs/dbraw/zinc/85/57/64/598855764.db2.gz	XUFOEBBEUQZLTQ-SNVBAGLBSA-N	-1	3	344.253	1.542	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCO[C@@H](C(F)(F)F)C2)c(-c2nn[n-]n2)c1	ZINC000738371749	598855766	/nfs/dbraw/zinc/85/57/66/598855766.db2.gz	XUFOEBBEUQZLTQ-SNVBAGLBSA-N	-1	3	344.253	1.542	20	5		EDBDHM
COc1c([O-])ccc(CN2CCC3(CC2)COCCO3)c1[N+](=O)[O-]	ZINC000896034762	591326032	/nfs/dbraw/zinc/32/60/32/591326032.db2.gz	XBHJCAFYDWRQOC-UHFFFAOYSA-N	-1	3	338.360	1.690	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2CC[C@@H](C3CC3)O2)c(F)c1	ZINC000907469533	592651131	/nfs/dbraw/zinc/65/11/31/592651131.db2.gz	NYLNUGCGASPQKP-YPMHNXCESA-N	-1	3	344.364	1.970	20	5		EDBDHM
O=C(Nc1ccc(C2(O)COC2)cc1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000807873841	593205880	/nfs/dbraw/zinc/20/58/80/593205880.db2.gz	CCSQJCKRBKCEKD-UHFFFAOYSA-N	-1	3	331.284	1.166	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1C(=O)OCC1(C)C	ZINC000841534626	593218192	/nfs/dbraw/zinc/21/81/92/593218192.db2.gz	LACWDXKDFIJANK-LLVKDONJSA-N	-1	3	328.346	1.133	20	5		EDBDHM
COCCCO[N-]C(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000805039131	593328167	/nfs/dbraw/zinc/32/81/67/593328167.db2.gz	UDPKNFMLYPNBHI-UHFFFAOYSA-N	-1	3	327.293	1.520	20	5		EDBDHM
CCOc1cc(C(=O)[N-]OCCCOC)c([N+](=O)[O-])cc1OC	ZINC000805042928	593328619	/nfs/dbraw/zinc/32/86/19/593328619.db2.gz	AEDBNWMXZKJUON-UHFFFAOYSA-N	-1	3	328.321	1.700	20	5		EDBDHM
CC(=O)[N-]OCc1cc(I)cc([N+](=O)[O-])c1	ZINC000809994876	593374308	/nfs/dbraw/zinc/37/43/08/593374308.db2.gz	HYUBRSAXCFNXKT-UHFFFAOYSA-N	-1	3	336.085	1.767	20	5		EDBDHM
C[C@H](O)CCNc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820474571	593821922	/nfs/dbraw/zinc/82/19/22/593821922.db2.gz	STFPHPRTSDSOPH-QMMMGPOBSA-N	-1	3	329.320	1.506	20	5		EDBDHM
C[C@H](O)CCNc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820474571	593821923	/nfs/dbraw/zinc/82/19/23/593821923.db2.gz	STFPHPRTSDSOPH-QMMMGPOBSA-N	-1	3	329.320	1.506	20	5		EDBDHM
COc1cc(C(=O)OC[C@H]2CCCN2CC(=O)[O-])ccc1[N+](=O)[O-]	ZINC000820759285	593883882	/nfs/dbraw/zinc/88/38/82/593883882.db2.gz	NTHPGSKEZBKZGT-LLVKDONJSA-N	-1	3	338.316	1.309	20	5		EDBDHM
Cc1cc(C[C@H](C)Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)n[nH]1	ZINC000822200122	594008686	/nfs/dbraw/zinc/00/86/86/594008686.db2.gz	VKAOAWPRXGCHML-QMMMGPOBSA-N	-1	3	328.336	1.850	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N3CCC[C@@H]3CO)cc(-c3nnn[n-]3)c2c1	ZINC000823645165	594224278	/nfs/dbraw/zinc/22/42/78/594224278.db2.gz	OWADUBXXZPLCEL-SNVBAGLBSA-N	-1	3	341.331	1.284	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N3CCC[C@@H]3CO)cc(-c3nn[n-]n3)c2c1	ZINC000823645165	594224279	/nfs/dbraw/zinc/22/42/79/594224279.db2.gz	OWADUBXXZPLCEL-SNVBAGLBSA-N	-1	3	341.331	1.284	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCC[C@@H]2CCCC[C@@H]2O)c(-c2nnn[n-]2)c1	ZINC000823651419	594224659	/nfs/dbraw/zinc/22/46/59/594224659.db2.gz	JBGWUGFASISWPA-GWCFXTLKSA-N	-1	3	347.379	1.913	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCC[C@@H]2CCCC[C@@H]2O)c(-c2nn[n-]n2)c1	ZINC000823651419	594224660	/nfs/dbraw/zinc/22/46/60/594224660.db2.gz	JBGWUGFASISWPA-GWCFXTLKSA-N	-1	3	347.379	1.913	20	5		EDBDHM
CN(C[C@H]1CCCC[C@H]1O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825909374	594275958	/nfs/dbraw/zinc/27/59/58/594275958.db2.gz	XFANNEYEKULLLP-QMTHXVAHSA-N	-1	3	332.364	1.762	20	5		EDBDHM
CN(C[C@H]1CCCC[C@H]1O)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825909374	594275960	/nfs/dbraw/zinc/27/59/60/594275960.db2.gz	XFANNEYEKULLLP-QMTHXVAHSA-N	-1	3	332.364	1.762	20	5		EDBDHM
COc1cc(-c2nnn[n-]2)ccc1Cn1cc([N+](=O)[O-])cc(C)c1=O	ZINC000826174493	594362595	/nfs/dbraw/zinc/36/25/95/594362595.db2.gz	YXRFVKHOMRFTQH-UHFFFAOYSA-N	-1	3	342.315	1.302	20	5		EDBDHM
COc1cc(-c2nn[n-]n2)ccc1Cn1cc([N+](=O)[O-])cc(C)c1=O	ZINC000826174493	594362596	/nfs/dbraw/zinc/36/25/96/594362596.db2.gz	YXRFVKHOMRFTQH-UHFFFAOYSA-N	-1	3	342.315	1.302	20	5		EDBDHM
Cc1ccc(-c2nnn[n-]2)cc1NC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000826278424	594408522	/nfs/dbraw/zinc/40/85/22/594408522.db2.gz	BJNUCCQSTZSYRR-UHFFFAOYSA-N	-1	3	328.292	1.069	20	5		EDBDHM
Cc1ccc(-c2nn[n-]n2)cc1NC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000826278424	594408523	/nfs/dbraw/zinc/40/85/23/594408523.db2.gz	BJNUCCQSTZSYRR-UHFFFAOYSA-N	-1	3	328.292	1.069	20	5		EDBDHM
O=C(OCCc1ccccc1[N+](=O)[O-])c1c[nH]c(-c2nnn[n-]2)c1	ZINC000826464208	594486378	/nfs/dbraw/zinc/48/63/78/594486378.db2.gz	MXMOKZRJGNPLNQ-UHFFFAOYSA-N	-1	3	328.288	1.503	20	5		EDBDHM
O=C(OCCc1ccccc1[N+](=O)[O-])c1c[nH]c(-c2nn[n-]n2)c1	ZINC000826464208	594486380	/nfs/dbraw/zinc/48/63/80/594486380.db2.gz	MXMOKZRJGNPLNQ-UHFFFAOYSA-N	-1	3	328.288	1.503	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCc3c(F)cccc3C2)c(-c2nnn[n-]2)c1	ZINC000826500726	594503532	/nfs/dbraw/zinc/50/35/32/594503532.db2.gz	JZPWEXLJGJZSID-UHFFFAOYSA-N	-1	3	341.306	1.872	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCc3c(F)cccc3C2)c(-c2nn[n-]n2)c1	ZINC000826500726	594503533	/nfs/dbraw/zinc/50/35/33/594503533.db2.gz	JZPWEXLJGJZSID-UHFFFAOYSA-N	-1	3	341.306	1.872	20	5		EDBDHM
CC(C)OC[C@H](C(=O)[O-])N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000833505832	594861460	/nfs/dbraw/zinc/86/14/60/594861460.db2.gz	OIHXHWOGMVHUPS-KGLIPLIRSA-N	-1	3	326.349	1.438	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C[C@@H]2CCN(C)C2)c1	ZINC000841524515	594914677	/nfs/dbraw/zinc/91/46/77/594914677.db2.gz	NVQKCOJACATEKK-JTQLQIEISA-N	-1	3	347.824	1.787	20	5		EDBDHM
CC(C)(CCC(=O)OCC(=O)[N-]C(=O)c1cccs1)[N+](=O)[O-]	ZINC000837924213	595228218	/nfs/dbraw/zinc/22/82/18/595228218.db2.gz	RKDCXALAONXBAF-UHFFFAOYSA-N	-1	3	328.346	1.383	20	5		EDBDHM
CNC(=O)[C@@H]([N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000848586103	595410310	/nfs/dbraw/zinc/41/03/10/595410310.db2.gz	RJVPJHMEZJTBSA-NSHDSACASA-N	-1	3	345.302	1.453	20	5		EDBDHM
Cc1nc([C@H](C)[N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)n[nH]1	ZINC000848590855	595411641	/nfs/dbraw/zinc/41/16/41/595411641.db2.gz	WUQFOFSSVVTHBO-ZETCQYMHSA-N	-1	3	341.274	1.870	20	5		EDBDHM
CC(C)(C)N1CC[C@@H]([N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1	ZINC000849419066	595524111	/nfs/dbraw/zinc/52/41/11/595524111.db2.gz	JXGXXCLFEYUGKB-SNVBAGLBSA-N	-1	3	345.396	1.885	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1cccs1)C(=O)OCC(C)(C)[N+](=O)[O-]	ZINC000851126380	595736760	/nfs/dbraw/zinc/73/67/60/595736760.db2.gz	MIBAVKATVQQRNC-QMMMGPOBSA-N	-1	3	336.391	1.013	20	5		EDBDHM
O=c1[n-]ccc(N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1[N+](=O)[O-]	ZINC000853455475	595755161	/nfs/dbraw/zinc/75/51/61/595755161.db2.gz	BEFBMBYTOMKLAL-VIFPVBQESA-N	-1	3	346.303	1.689	20	5		EDBDHM
CCOc1cccc([N+](=O)[O-])c1C(=O)[N-]OCCN1CCCC1=O	ZINC000856042663	595883948	/nfs/dbraw/zinc/88/39/48/595883948.db2.gz	COARIQYRNXROBO-UHFFFAOYSA-N	-1	3	337.332	1.277	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(F)c(C(=O)[N-]OC2CCN(C)CC2)c1F	ZINC000854357346	596051134	/nfs/dbraw/zinc/05/11/34/596051134.db2.gz	AGLVZLWBFVYZOM-UHFFFAOYSA-N	-1	3	329.303	1.937	20	5		EDBDHM
Cc1ccccc1[C@@H](O)C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000119824997	596745869	/nfs/dbraw/zinc/74/58/69/596745869.db2.gz	XKZRBIPGJDNIIX-LBPRGKRZSA-N	-1	3	342.398	1.977	20	5		EDBDHM
CCN1CCC[C@@H]1C[N-]S(=O)(=O)c1cc(F)c(C)cc1[N+](=O)[O-]	ZINC000866393529	596874593	/nfs/dbraw/zinc/87/45/93/596874593.db2.gz	GUJVWQRTGJRVAY-LLVKDONJSA-N	-1	3	345.396	1.805	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCSC(F)(F)F)c(-c2nnn[n-]2)c1	ZINC000738374147	598500137	/nfs/dbraw/zinc/50/01/37/598500137.db2.gz	JVWXLVOZOZOGTG-UHFFFAOYSA-N	-1	3	335.271	1.835	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCSC(F)(F)F)c(-c2nn[n-]n2)c1	ZINC000738374147	598500140	/nfs/dbraw/zinc/50/01/40/598500140.db2.gz	JVWXLVOZOZOGTG-UHFFFAOYSA-N	-1	3	335.271	1.835	20	5		EDBDHM
CC1(C)[C@@H](O)C[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000130222220	535035282	/nfs/dbraw/zinc/03/52/82/535035282.db2.gz	JCWRHKBDNSDPFQ-QWRGUYRKSA-N	-1	3	334.781	1.686	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1C[C@@H]2OCCC[C@H]12	ZINC000368920307	207685439	/nfs/dbraw/zinc/68/54/39/207685439.db2.gz	SQRZGEQEWFIAAP-WZRBSPASSA-N	-1	3	342.373	1.449	20	5		EDBDHM
Cn1[n-]c([C@H]2CCCN2C(=O)/C=C\c2cccc([N+](=O)[O-])c2)nc1=N	ZINC000493047532	255189715	/nfs/dbraw/zinc/18/97/15/255189715.db2.gz	LRJYANQEFKLBHX-MEJMFZKBSA-N	-1	3	342.359	1.513	20	5		EDBDHM
C[C@H]1C[C@@H]1C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000263989136	139374151	/nfs/dbraw/zinc/37/41/51/139374151.db2.gz	JAALPMUSORCKDG-DTWKUNHWSA-N	-1	3	328.346	1.300	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CC[C@@H](CO)CC1	ZINC000119479630	221329506	/nfs/dbraw/zinc/32/95/06/221329506.db2.gz	LMLJRDCUUCQECW-HAQNSBGRSA-N	-1	3	328.390	1.733	20	5		EDBDHM
CCc1nc([C@@H](C)[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])n[nH]1	ZINC000270546626	140121157	/nfs/dbraw/zinc/12/11/57/140121157.db2.gz	DYPRFHSNRWIYDE-MRVPVSSYSA-N	-1	3	325.350	1.315	20	5		EDBDHM
CCc1nnc([C@@H](C)[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])[nH]1	ZINC000270546626	140121158	/nfs/dbraw/zinc/12/11/58/140121158.db2.gz	DYPRFHSNRWIYDE-MRVPVSSYSA-N	-1	3	325.350	1.315	20	5		EDBDHM
O=C([O-])c1cc(N2CCN(CC3CCOCC3)CC2)ccc1[N+](=O)[O-]	ZINC000572124328	306581987	/nfs/dbraw/zinc/58/19/87/306581987.db2.gz	RBNNPRWWTCUZGV-UHFFFAOYSA-N	-1	3	349.387	1.842	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCC[C@H]1F	ZINC000339117636	141959775	/nfs/dbraw/zinc/95/97/75/141959775.db2.gz	BHNXZMBHQUQKPS-GHMZBOCLSA-N	-1	3	346.336	1.550	20	5		EDBDHM
COC(=O)c1cc([N-]C(=O)c2nccn3ccnc23)cc([N+](=O)[O-])c1	ZINC000340512601	142419104	/nfs/dbraw/zinc/41/91/04/142419104.db2.gz	UAMCPTRHJARZPT-UHFFFAOYSA-N	-1	3	341.283	1.676	20	5		EDBDHM
CCOc1cccc([N+](=O)[O-])c1C(=O)[N-]c1ncc(C(N)=O)s1	ZINC000348012532	143391202	/nfs/dbraw/zinc/39/12/02/143391202.db2.gz	MWQNCXKDTIDHSQ-UHFFFAOYSA-N	-1	3	336.329	1.801	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])[C@H](O)C(C)C	ZINC000416625782	304338049	/nfs/dbraw/zinc/33/80/49/304338049.db2.gz	PIFVXAPVILIIQK-DGCLKSJQSA-N	-1	3	330.406	1.977	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@](C)(C(N)=O)C(C)C)c([N+](=O)[O-])c1	ZINC000352595647	292184235	/nfs/dbraw/zinc/18/42/35/292184235.db2.gz	BKIDPGRXDRTMGM-CYBMUJFWSA-N	-1	3	329.378	1.082	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2C[C@@H](C)N(C3CC3)C2)c([N+](=O)[O-])c1	ZINC000124036623	292184830	/nfs/dbraw/zinc/18/48/30/292184830.db2.gz	LYKJSCUZAZKNHQ-NEPJUHHUSA-N	-1	3	339.417	1.807	20	5		EDBDHM
CCn1cc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)cn1	ZINC000352633208	149095094	/nfs/dbraw/zinc/09/50/94/149095094.db2.gz	LELWHCXFSQVTCK-UHFFFAOYSA-N	-1	3	330.391	1.660	20	5		EDBDHM
COc1ccc([N-]C(=O)c2cn([C@H]3CCOC3)nn2)c([N+](=O)[O-])c1	ZINC000357787095	151151692	/nfs/dbraw/zinc/15/16/92/151151692.db2.gz	JKZXVDNQAYXSMY-VIFPVBQESA-N	-1	3	333.304	1.409	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)NCc1nnc(C(F)(F)F)[n-]1	ZINC000360817621	152218487	/nfs/dbraw/zinc/21/84/87/152218487.db2.gz	DBJOPAILIHLQRS-UHFFFAOYSA-N	-1	3	330.226	1.365	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)NCc1n[n-]c(C(F)(F)F)n1	ZINC000360817621	152218488	/nfs/dbraw/zinc/21/84/88/152218488.db2.gz	DBJOPAILIHLQRS-UHFFFAOYSA-N	-1	3	330.226	1.365	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)NCc1nc(C(F)(F)F)n[n-]1	ZINC000360817621	152218489	/nfs/dbraw/zinc/21/84/89/152218489.db2.gz	DBJOPAILIHLQRS-UHFFFAOYSA-N	-1	3	330.226	1.365	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CSC[C@H]1C	ZINC000352347144	162133666	/nfs/dbraw/zinc/13/36/66/162133666.db2.gz	VGKVTMUONUVWEI-PSASIEDQSA-N	-1	3	332.403	1.633	20	5		EDBDHM
COCC[C@@H](COC)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000352506793	292630547	/nfs/dbraw/zinc/63/05/47/292630547.db2.gz	NGCXCIWNYJCSPN-LBPRGKRZSA-N	-1	3	346.405	1.541	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]C[C@H]2CCC[C@@H]2O)cc1[N+](=O)[O-]	ZINC000274718948	268190673	/nfs/dbraw/zinc/19/06/73/268190673.db2.gz	BSQBNNKIMPGRGA-RNCFNFMXSA-N	-1	3	332.353	1.482	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@H]2CCC[C@@H]2O)cc1[N+](=O)[O-]	ZINC000275104550	268282295	/nfs/dbraw/zinc/28/22/95/268282295.db2.gz	UTKSPMKNEOODTB-PELKAZGASA-N	-1	3	348.352	1.182	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCC[C@@H]1C	ZINC000273440567	273040004	/nfs/dbraw/zinc/04/00/04/273040004.db2.gz	BTIUJXFQVXGRNQ-JOYOIKCWSA-N	-1	3	342.373	1.848	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C[C@@H]2CCCN2C)c1	ZINC000277000246	273175458	/nfs/dbraw/zinc/17/54/58/273175458.db2.gz	WWDZWZIULRNPPA-JTQLQIEISA-N	-1	3	347.824	1.929	20	5		EDBDHM
CCn1cc(C[N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])cn1	ZINC000285798829	274652498	/nfs/dbraw/zinc/65/24/98/274652498.db2.gz	ZXZUKDQUPHZXLI-UHFFFAOYSA-N	-1	3	338.389	1.907	20	5		EDBDHM
CC1([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CCCC1	ZINC000264007851	278470872	/nfs/dbraw/zinc/47/08/72/278470872.db2.gz	QWPGTNPQMAQFGD-UHFFFAOYSA-N	-1	3	342.373	1.977	20	5		EDBDHM
CO[C@](C)(C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000291721201	289160863	/nfs/dbraw/zinc/16/08/63/289160863.db2.gz	PVJVKHWNPJUQPF-CQSZACIVSA-N	-1	3	328.390	1.829	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(-c2nccn2C)[n-]n1	ZINC000372850749	447315091	/nfs/dbraw/zinc/31/50/91/447315091.db2.gz	SMLLTDXYCHNUTQ-UHFFFAOYSA-N	-1	3	342.315	1.979	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(-c2nccn2C)n[n-]1	ZINC000372850749	447315095	/nfs/dbraw/zinc/31/50/95/447315095.db2.gz	SMLLTDXYCHNUTQ-UHFFFAOYSA-N	-1	3	342.315	1.979	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@H](O)COCC(C)C	ZINC000443386769	302048168	/nfs/dbraw/zinc/04/81/68/302048168.db2.gz	NDIWBDFISWLIMC-LBPRGKRZSA-N	-1	3	346.405	1.215	20	5		EDBDHM
CCN1CC[C@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])cc3[O-])[C@H]2C1	ZINC000293838524	303026801	/nfs/dbraw/zinc/02/68/01/303026801.db2.gz	HRPRZIQKKAHYJO-DZGCQCFKSA-N	-1	3	335.360	1.236	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2nnc(C3CC3)[nH]2)c(F)c1	ZINC000295207552	303188728	/nfs/dbraw/zinc/18/87/28/303188728.db2.gz	GEEPGRDEEVCKNL-UHFFFAOYSA-N	-1	3	341.324	1.208	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2n[nH]c(C3CC3)n2)c(F)c1	ZINC000295207552	303188731	/nfs/dbraw/zinc/18/87/31/303188731.db2.gz	GEEPGRDEEVCKNL-UHFFFAOYSA-N	-1	3	341.324	1.208	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)CC(C)(C)O)c([N+](=O)[O-])c1	ZINC000295619966	303243065	/nfs/dbraw/zinc/24/30/65/303243065.db2.gz	ZBESFSJDMYZRQP-SECBINFHSA-N	-1	3	332.378	1.431	20	5		EDBDHM
Cc1ncc(CNC(=O)C=Cc2ccc(F)cc2[N+](=O)[O-])c(=O)[n-]1	ZINC000492498231	305593478	/nfs/dbraw/zinc/59/34/78/305593478.db2.gz	CZGHNSUILUUPLC-HWKANZROSA-N	-1	3	332.291	1.868	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1	ZINC000527124192	305840724	/nfs/dbraw/zinc/84/07/24/305840724.db2.gz	KKFHEWGPUSDDNT-CYBMUJFWSA-N	-1	3	332.360	1.960	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)Cn1cccn1	ZINC000045741986	441026416	/nfs/dbraw/zinc/02/64/16/441026416.db2.gz	VHQJMDCWIOEYAI-SNVBAGLBSA-N	-1	3	340.361	1.167	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2cc(C)no2)c([N+](=O)[O-])c1	ZINC000060909309	441261636	/nfs/dbraw/zinc/26/16/36/441261636.db2.gz	XKWOUNURCFSZRG-UHFFFAOYSA-N	-1	3	327.318	1.378	20	5		EDBDHM
NC(=O)c1cc(NC(=O)c2n[n-]c3ccc([N+](=O)[O-])cc32)ccc1F	ZINC000033065424	441586435	/nfs/dbraw/zinc/58/64/35/441586435.db2.gz	GUEZJSIUQYVDDG-UHFFFAOYSA-N	-1	3	343.274	1.961	20	5		EDBDHM
O=c1cc(Cn2cc(Br)cc([N+](=O)[O-])c2=O)occ1[O-]	ZINC000158305563	441720772	/nfs/dbraw/zinc/72/07/72/441720772.db2.gz	TUOJAJRLWZOAAW-UHFFFAOYSA-N	-1	3	343.089	1.226	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@H](C)N(C)C1CC1	ZINC000069129167	441895995	/nfs/dbraw/zinc/89/59/95/441895995.db2.gz	ISIBHNSMWPATRP-NSHDSACASA-N	-1	3	327.406	1.664	20	5		EDBDHM
CCCN(CC)CC[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000175362121	442049905	/nfs/dbraw/zinc/04/99/05/442049905.db2.gz	MMOJFVRVXGKQPW-UHFFFAOYSA-N	-1	3	333.385	1.744	20	5		EDBDHM
CC1(C)C[C@H]1C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000152164549	442174513	/nfs/dbraw/zinc/17/45/13/442174513.db2.gz	AYCJDPIQSYSSAV-JTQLQIEISA-N	-1	3	341.389	1.035	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC(C)(C)CCO)cc1C	ZINC000178829613	442496340	/nfs/dbraw/zinc/49/63/40/442496340.db2.gz	FQMSJSHCULQNTG-UHFFFAOYSA-N	-1	3	330.406	1.899	20	5		EDBDHM
CCN1CCc2nc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)sc2C1	ZINC000193385665	442737820	/nfs/dbraw/zinc/73/78/20/442737820.db2.gz	UVOOWYDULYPYFM-UHFFFAOYSA-N	-1	3	349.372	1.782	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2CCN(C3CC3)C2)c(F)c1	ZINC000193871770	442802637	/nfs/dbraw/zinc/80/26/37/442802637.db2.gz	WEOXCDZAWPFJJS-JTQLQIEISA-N	-1	3	343.380	1.497	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@@]2(C1)NC(=O)[N-]C2=O	ZINC000248673279	442916272	/nfs/dbraw/zinc/91/62/72/442916272.db2.gz	GWPXDSWTZVEYJT-ZBEGNZNMSA-N	-1	3	332.360	1.638	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-][C@H]2CCCC[C@H]2O)cc1[N+](=O)[O-]	ZINC000184852834	443087027	/nfs/dbraw/zinc/08/70/27/443087027.db2.gz	ZHEXMCZTYVFHTD-WCQYABFASA-N	-1	3	332.353	1.624	20	5		EDBDHM
O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1[N-]C(CO)CO	ZINC000266282119	443085215	/nfs/dbraw/zinc/08/52/15/443085215.db2.gz	UJOZBLSPWMZDGX-UHFFFAOYSA-N	-1	3	325.199	1.287	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](CO)CC(C)C	ZINC000269660133	443383933	/nfs/dbraw/zinc/38/39/33/443383933.db2.gz	AZRRIJRBTALUMQ-SNVBAGLBSA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](O)C(C)(C)C)cc1C	ZINC000269768747	443433359	/nfs/dbraw/zinc/43/33/59/443433359.db2.gz	LYMMZFFAVMBOQB-CYBMUJFWSA-N	-1	3	330.406	1.897	20	5		EDBDHM
COC[C@@H]([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCO1	ZINC000279061134	443505009	/nfs/dbraw/zinc/50/50/09/443505009.db2.gz	AWQAQWNYQPNNRV-OLZOCXBDSA-N	-1	3	344.314	1.997	20	5		EDBDHM
COC(=O)c1ccc(C)c(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)c1[O-]	ZINC000436827091	320024296	/nfs/dbraw/zinc/02/42/96/320024296.db2.gz	JEVKRBDFYBKIAT-UHFFFAOYSA-N	-1	3	348.315	1.690	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]Cc1cccnn1	ZINC000443942545	320115970	/nfs/dbraw/zinc/11/59/70/320115970.db2.gz	QSXGQYDIFVXDGB-UHFFFAOYSA-N	-1	3	328.737	1.517	20	5		EDBDHM
O=C(c1c([O-])cccc1O)N1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000298367475	443755712	/nfs/dbraw/zinc/75/57/12/443755712.db2.gz	LWJKVEOKGJHZKL-UHFFFAOYSA-N	-1	3	344.327	1.363	20	5		EDBDHM
CC(C)(O)CO[N-]C(=O)c1ccc(Br)cc1[N+](=O)[O-]	ZINC000298953384	443912248	/nfs/dbraw/zinc/91/22/48/443912248.db2.gz	NYMUTVUTLAOREC-UHFFFAOYSA-N	-1	3	333.138	1.790	20	5		EDBDHM
CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cn(C)c(=O)[n-]c1=O	ZINC000299131527	443963838	/nfs/dbraw/zinc/96/38/38/443963838.db2.gz	KRIVMRWEAWDJQT-UHFFFAOYSA-N	-1	3	346.343	1.445	20	5		EDBDHM
Cc1nc([C@H](C)[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2C)n[nH]1	ZINC000285394696	443968817	/nfs/dbraw/zinc/96/88/17/443968817.db2.gz	OIBQMIWFXQPCON-QMMMGPOBSA-N	-1	3	325.350	1.369	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CCOC[C@H]1C	ZINC000285742376	444093401	/nfs/dbraw/zinc/09/34/01/444093401.db2.gz	VZLKTDOXJQPJOA-GHMZBOCLSA-N	-1	3	344.389	1.554	20	5		EDBDHM
Cc1cc(N[C@@H](C)CN2CCN(C)CC2)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000566290991	321225843	/nfs/dbraw/zinc/22/58/43/321225843.db2.gz	MEVWCLNNWXZXHN-LBPRGKRZSA-N	-1	3	336.392	1.649	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@]2(C)CCOC2=O)cc1C	ZINC000289453718	444148053	/nfs/dbraw/zinc/14/80/53/444148053.db2.gz	FWOQWQTYPXFOGA-CYBMUJFWSA-N	-1	3	328.346	1.196	20	5		EDBDHM
Cc1cnc(NCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])nc1	ZINC000301824109	444192306	/nfs/dbraw/zinc/19/23/06/444192306.db2.gz	LNPUFRSVIVCMCC-UHFFFAOYSA-N	-1	3	337.361	1.084	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H](O)C1CCC1	ZINC000315973799	444307757	/nfs/dbraw/zinc/30/77/57/444307757.db2.gz	FYCOPUPYNYSJTC-LLVKDONJSA-N	-1	3	330.362	1.043	20	5		EDBDHM
COC(=O)[C@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(C)C	ZINC000314232101	444298932	/nfs/dbraw/zinc/29/89/32/444298932.db2.gz	CMABVGJWWRXROJ-LLVKDONJSA-N	-1	3	330.362	1.379	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1CCC(CO)CC1	ZINC000324066878	444350379	/nfs/dbraw/zinc/35/03/79/444350379.db2.gz	XEPUWFFKLOVQTM-UHFFFAOYSA-N	-1	3	344.389	1.433	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCC2(O)CCC2)c(Cl)c1	ZINC000341110677	444679219	/nfs/dbraw/zinc/67/92/19/444679219.db2.gz	BWCFXHGKYDSSFZ-UHFFFAOYSA-N	-1	3	334.781	1.832	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000344001686	444719910	/nfs/dbraw/zinc/71/99/10/444719910.db2.gz	ZZIWITCUSWEMJC-SNVBAGLBSA-N	-1	3	330.362	1.308	20	5		EDBDHM
CCN1CCC[C@@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000338724071	444821806	/nfs/dbraw/zinc/82/18/06/444821806.db2.gz	NPGOIBXALQQBTH-JTQLQIEISA-N	-1	3	333.435	1.667	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)C[C@@H]1CCCO1	ZINC000338724469	444821965	/nfs/dbraw/zinc/82/19/65/444821965.db2.gz	FDHHIOYDVALTDC-PWSUYJOCSA-N	-1	3	344.389	1.839	20	5		EDBDHM
O=C(Cc1cc2c(cc1[N+](=O)[O-])OCCO2)Nc1ncccc1[O-]	ZINC000341903078	445062932	/nfs/dbraw/zinc/06/29/32/445062932.db2.gz	QDNVIUANUFZSHS-UHFFFAOYSA-N	-1	3	331.284	1.648	20	5		EDBDHM
Cc1cc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)nn1[C@H](C)C1CC1	ZINC000345975456	445203055	/nfs/dbraw/zinc/20/30/55/445203055.db2.gz	GYHOIYLIFZRFKS-SECBINFHSA-N	-1	3	331.332	2.424	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CCN(C3CC3)C2)cc1[N+](=O)[O-]	ZINC000343465270	445227813	/nfs/dbraw/zinc/22/78/13/445227813.db2.gz	PAECDUCNBSWFBL-VIFPVBQESA-N	-1	3	331.419	1.480	20	5		EDBDHM
Cn1c(C(=O)Nc2cc3c(cc2[O-])n(C)c(=O)n3C)ccc1[N+](=O)[O-]	ZINC000359820348	445445103	/nfs/dbraw/zinc/44/51/03/445445103.db2.gz	JYRRIUZABHTMBU-UHFFFAOYSA-N	-1	3	345.315	1.082	20	5		EDBDHM
CCN1CC[C@H]2OCCN(C(=O)c3cc([O-])ccc3[N+](=O)[O-])[C@@H]2C1	ZINC000355387165	445457708	/nfs/dbraw/zinc/45/77/08/445457708.db2.gz	SMBMJVROGNPGCH-HUUCEWRRSA-N	-1	3	335.360	1.236	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NCc2ncccc2[O-])c1	ZINC000360022774	445532864	/nfs/dbraw/zinc/53/28/64/445532864.db2.gz	ITSQFUZWPIKDAH-UHFFFAOYSA-N	-1	3	337.357	1.791	20	5		EDBDHM
COC(=O)[C@H]1CN(C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c2ccccc21	ZINC000356536603	445847433	/nfs/dbraw/zinc/84/74/33/445847433.db2.gz	CLLREBWAAKIJDT-NSHDSACASA-N	-1	3	343.295	1.612	20	5		EDBDHM
CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3CN2C(=O)c1cc(C)[n-]c(=O)c1[N+](=O)[O-]	ZINC000367718559	446578336	/nfs/dbraw/zinc/57/83/36/446578336.db2.gz	DJAHVXHHBLSTDG-JVOAVLCXSA-N	-1	3	333.344	1.499	20	5		EDBDHM
CN1Cc2ccccc2[C@@H](NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)C1	ZINC000371371483	446813296	/nfs/dbraw/zinc/81/32/96/446813296.db2.gz	BZLFZCGFPNNPDN-AWEZNQCLSA-N	-1	3	328.328	1.612	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1C(=O)[N-]c1ncn(-c2ccccn2)n1	ZINC000371506391	446900550	/nfs/dbraw/zinc/90/05/50/446900550.db2.gz	QYAQAIVWCOIYQP-UHFFFAOYSA-N	-1	3	340.299	1.831	20	5		EDBDHM
CC(C)(C)c1nc(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])n[nH]1	ZINC000416540364	447640449	/nfs/dbraw/zinc/64/04/49/447640449.db2.gz	HDARGRXCLGIVLQ-UHFFFAOYSA-N	-1	3	339.377	1.489	20	5		EDBDHM
CC(C)(C)c1nnc(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])[nH]1	ZINC000416540364	447640455	/nfs/dbraw/zinc/64/04/55/447640455.db2.gz	HDARGRXCLGIVLQ-UHFFFAOYSA-N	-1	3	339.377	1.489	20	5		EDBDHM
COc1cc(C(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)ccc1[O-]	ZINC000427797534	447650620	/nfs/dbraw/zinc/65/06/20/447650620.db2.gz	BAELGRAZADQHDP-UHFFFAOYSA-N	-1	3	346.343	1.983	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]c2c[nH]c(=O)c(C)c2)c([N+](=O)[O-])c1	ZINC000533788119	448422223	/nfs/dbraw/zinc/42/22/23/448422223.db2.gz	IJTCNJGEYBMWOB-UHFFFAOYSA-N	-1	3	339.329	1.813	20	5		EDBDHM
CN(C)CCN1CCC(Nc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1	ZINC000566564021	448509012	/nfs/dbraw/zinc/50/90/12/448509012.db2.gz	PKCAWHCYYOYXFQ-UHFFFAOYSA-N	-1	3	336.392	1.731	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000520292912	448881721	/nfs/dbraw/zinc/88/17/21/448881721.db2.gz	KVQCSDXGSSGYGC-SNVBAGLBSA-N	-1	3	344.389	1.993	20	5		EDBDHM
COCC1([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)CCCC1	ZINC000582312282	449065535	/nfs/dbraw/zinc/06/55/35/449065535.db2.gz	RKHUBHLEFCXGPR-UHFFFAOYSA-N	-1	3	344.389	1.841	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H](CO)CCF)c(Cl)c1	ZINC000593655949	449132932	/nfs/dbraw/zinc/13/29/32/449132932.db2.gz	GVVKQSPHZZFLAB-ZETCQYMHSA-N	-1	3	326.733	1.247	20	5		EDBDHM
Cc1cc(N2CCN(CCO)C(C)(C)C2)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000592977212	449091834	/nfs/dbraw/zinc/09/18/34/449091834.db2.gz	SUTXSSTXMJROKZ-UHFFFAOYSA-N	-1	3	337.376	1.494	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]([C@H](CO)C2CC2)C2CC2)nc1	ZINC000593601861	449101282	/nfs/dbraw/zinc/10/12/82/449101282.db2.gz	QWFMPVNPWKKFRB-OCCSQVGLSA-N	-1	3	341.389	1.065	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](CO)CC1CC1	ZINC000611109697	449171542	/nfs/dbraw/zinc/17/15/42/449171542.db2.gz	BDDTVWQCEXAVRB-SNVBAGLBSA-N	-1	3	330.362	1.043	20	5		EDBDHM
CCN1CCC([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000603957522	449164045	/nfs/dbraw/zinc/16/40/45/449164045.db2.gz	QTZLGMVHDLAJLN-UHFFFAOYSA-N	-1	3	331.369	1.497	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)NC1CCCC1	ZINC000604502869	449239282	/nfs/dbraw/zinc/23/92/82/449239282.db2.gz	WOOIHYIOCNHVJK-UHFFFAOYSA-N	-1	3	345.352	1.071	20	5		EDBDHM
O=C(CNc1cc[n-]c(=O)c1[N+](=O)[O-])N1CCc2ccccc2C1	ZINC000596104460	449363383	/nfs/dbraw/zinc/36/33/83/449363383.db2.gz	LELJWYSAKDBUOK-UHFFFAOYSA-N	-1	3	328.328	1.692	20	5		EDBDHM
CCN1CCC[C@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000593538374	449333631	/nfs/dbraw/zinc/33/36/31/449333631.db2.gz	MEDRFLNPZRZFHA-LLVKDONJSA-N	-1	3	328.394	1.000	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1(C)CC=CC1	ZINC000594474247	449539584	/nfs/dbraw/zinc/53/95/84/449539584.db2.gz	QALBXYQUQUQGBR-UHFFFAOYSA-N	-1	3	340.357	1.768	20	5		EDBDHM
O=[N+]([O-])c1c(NCc2nc([C@H]3CCCO3)n[n-]2)nc2sccn21	ZINC000594590539	449586264	/nfs/dbraw/zinc/58/62/64/449586264.db2.gz	YBZXYHVAJCGPQV-SSDOTTSWSA-N	-1	3	335.349	1.886	20	5		EDBDHM
O=C([O-])[C@H](CNCc1cc2c(cc1[N+](=O)[O-])OCCO2)C1CCC1	ZINC000596658100	449590611	/nfs/dbraw/zinc/59/06/11/449590611.db2.gz	QDKZYZRKZHCDNH-GFCCVEGCSA-N	-1	3	336.344	1.957	20	5		EDBDHM
O=[N+]([O-])c1ccc([O-])cc1CN1CCC[C@H](N2CCOCC2)CC1	ZINC000594616398	449595920	/nfs/dbraw/zinc/59/59/20/449595920.db2.gz	AXXRBXRQZRCWSN-HNNXBMFYSA-N	-1	3	335.404	1.987	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-][C@H]1CCCOC1	ZINC000594754245	449670033	/nfs/dbraw/zinc/67/00/33/449670033.db2.gz	JXOVXGGHIPHLIB-JTQLQIEISA-N	-1	3	337.357	1.600	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])CN1CCCC1	ZINC000594755541	449670367	/nfs/dbraw/zinc/67/03/67/449670367.db2.gz	NMBLDUHCGBVDIS-LLVKDONJSA-N	-1	3	328.394	1.000	20	5		EDBDHM
CCn1cc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)nn1	ZINC000594839994	449747642	/nfs/dbraw/zinc/74/76/42/449747642.db2.gz	WKLYNEUHXOCGQM-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C1CC1	ZINC000594858893	449768940	/nfs/dbraw/zinc/76/89/40/449768940.db2.gz	ZKZALCRDSKQYNQ-SNVBAGLBSA-N	-1	3	342.373	1.833	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H](C)[C@@H]2CCOC2)c(F)cc1[N+](=O)[O-]	ZINC000601356918	449869154	/nfs/dbraw/zinc/86/91/54/449869154.db2.gz	IDUNAGXOTULNCW-VHSXEESVSA-N	-1	3	332.353	1.746	20	5		EDBDHM
CO[C@H](C[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F)C(C)C	ZINC000601362384	449876038	/nfs/dbraw/zinc/87/60/38/449876038.db2.gz	UUBAPGMBBXOYHQ-GFCCVEGCSA-N	-1	3	334.369	1.992	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CC[C@H]2CCOC2)c(F)cc1[N+](=O)[O-]	ZINC000601389062	449904080	/nfs/dbraw/zinc/90/40/80/449904080.db2.gz	CRRSHXLNEXZHSX-JTQLQIEISA-N	-1	3	332.353	1.747	20	5		EDBDHM
CCO[C@H]1C[C@@H]([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)C1	ZINC000601437361	449958800	/nfs/dbraw/zinc/95/88/00/449958800.db2.gz	VHXSRBNZWVDWJI-AOOOYVTPSA-N	-1	3	332.353	1.888	20	5		EDBDHM
CCCN1CC[C@@H]([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000595353358	450067475	/nfs/dbraw/zinc/06/74/75/450067475.db2.gz	GUVRVIUPYKILAM-GFCCVEGCSA-N	-1	3	327.406	1.666	20	5		EDBDHM
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)[C@@H](C)C(=O)Nc1ncccc1[O-]	ZINC000597654046	450172676	/nfs/dbraw/zinc/17/26/76/450172676.db2.gz	SIEDZQPSWABMDZ-RKDXNWHRSA-N	-1	3	347.331	1.417	20	5		EDBDHM
CCN1CC[C@H]([N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C1=O	ZINC000619798286	450336488	/nfs/dbraw/zinc/33/64/88/450336488.db2.gz	KXZCTRWBYHXFBR-NSHDSACASA-N	-1	3	341.389	1.111	20	5		EDBDHM
CCOc1ccc(C(=O)[N-]c2nn3cnnc3s2)cc1[N+](=O)[O-]	ZINC000603825307	450354831	/nfs/dbraw/zinc/35/48/31/450354831.db2.gz	VLCDDKWPEDRATP-UHFFFAOYSA-N	-1	3	334.317	1.745	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1C[C@@H](O)C1(C)C	ZINC000619498122	450492138	/nfs/dbraw/zinc/49/21/38/450492138.db2.gz	YKIMOALRRPDJQH-GHMZBOCLSA-N	-1	3	330.362	1.041	20	5		EDBDHM
CCOC[C@@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC)C(C)C	ZINC000619499173	450493083	/nfs/dbraw/zinc/49/30/83/450493083.db2.gz	IBNWDBVPVFJQFX-LLVKDONJSA-N	-1	3	346.405	1.943	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)[n-]1	ZINC000619544087	450502412	/nfs/dbraw/zinc/50/24/12/450502412.db2.gz	YNKQCWMEMIUDCX-UHFFFAOYSA-N	-1	3	348.315	1.821	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c[n-]1	ZINC000619544087	450502415	/nfs/dbraw/zinc/50/24/15/450502415.db2.gz	YNKQCWMEMIUDCX-UHFFFAOYSA-N	-1	3	348.315	1.821	20	5		EDBDHM
CCO[C@@H]1COCC[C@H]1[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000352978730	535759713	/nfs/dbraw/zinc/75/97/13/535759713.db2.gz	YEOOWJQUDDKBTH-DGCLKSJQSA-N	-1	3	344.389	1.376	20	5		EDBDHM
Cn1cc(CN[C@H]2CCN(C(=O)[O-])C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000740290065	579327388	/nfs/dbraw/zinc/32/73/88/579327388.db2.gz	LWWIDCUPYUCGBU-ZDUSSCGKSA-N	-1	3	345.359	1.837	20	5		EDBDHM
O=C([N-]C1=NCCS1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000731876441	578682026	/nfs/dbraw/zinc/68/20/26/578682026.db2.gz	XXCFRFQMFJLCFA-MRVPVSSYSA-N	-1	3	338.345	1.011	20	5		EDBDHM
CC(C)C[C@H](CNC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)N(C)C	ZINC000736404596	578985475	/nfs/dbraw/zinc/98/54/75/578985475.db2.gz	VOTFPATWMWYBTH-CQSZACIVSA-N	-1	3	337.376	1.999	20	5		EDBDHM
Cc1ccc(C(=O)Nc2ccncc2-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000737316670	579071050	/nfs/dbraw/zinc/07/10/50/579071050.db2.gz	ZUXKBZPLYGZQJP-UHFFFAOYSA-N	-1	3	325.288	1.153	20	5		EDBDHM
Cc1ccc(C(=O)Nc2ccncc2-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000737316670	579071052	/nfs/dbraw/zinc/07/10/52/579071052.db2.gz	ZUXKBZPLYGZQJP-UHFFFAOYSA-N	-1	3	325.288	1.153	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)n[nH]1	ZINC000738383425	579188826	/nfs/dbraw/zinc/18/88/26/579188826.db2.gz	PWWGKAIDKDSHTG-UHFFFAOYSA-N	-1	3	340.361	1.367	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CCO)C2CC2)cc1C	ZINC000751444223	579807263	/nfs/dbraw/zinc/80/72/63/579807263.db2.gz	ZGKNPBHXLMLGTN-GFCCVEGCSA-N	-1	3	328.390	1.651	20	5		EDBDHM
COC1CCN(CC[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000768855485	580222673	/nfs/dbraw/zinc/22/26/73/580222673.db2.gz	YYKHAJOQUJQJLS-UHFFFAOYSA-N	-1	3	349.434	1.045	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H]2CCCCC23OCCO3)cs1	ZINC000768862226	580222859	/nfs/dbraw/zinc/22/28/59/580222859.db2.gz	QMNRZDBYGSPJMI-SNVBAGLBSA-N	-1	3	348.402	1.620	20	5		EDBDHM
CC(C)OC(=O)CCC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768891792	580223653	/nfs/dbraw/zinc/22/36/53/580223653.db2.gz	MSONDEGEWFKHDP-UHFFFAOYSA-N	-1	3	336.391	1.666	20	5		EDBDHM
COCC[C@]1([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CCOC1	ZINC000772720879	580318799	/nfs/dbraw/zinc/31/87/99/580318799.db2.gz	WQYMUTZXIGUHLR-AWEZNQCLSA-N	-1	3	344.314	1.998	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2COC[C@@H]2C2CC2)c([N+](=O)[O-])s1	ZINC000908405772	592482649	/nfs/dbraw/zinc/48/26/49/592482649.db2.gz	LIXJDQITHHRIAW-ZJUUUORDSA-N	-1	3	332.403	1.668	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-][C@@H]1COC[C@@H]1C1CC1	ZINC000908409589	592484274	/nfs/dbraw/zinc/48/42/74/592484274.db2.gz	LITDUFIEMUDXGA-CHWSQXEVSA-N	-1	3	326.374	1.439	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2COC[C@H]2C2CC2)c(F)c1	ZINC000908416718	592487917	/nfs/dbraw/zinc/48/79/17/592487917.db2.gz	WMFXFFNUWYWCQN-JQWIXIFHSA-N	-1	3	330.337	1.437	20	5		EDBDHM
O=C([O-])c1cc(N2CCCN(C[C@H]3CCCO3)CC2)ccc1[N+](=O)[O-]	ZINC000910343872	592838628	/nfs/dbraw/zinc/83/86/28/592838628.db2.gz	KGHAWHGSKOTGTQ-CQSZACIVSA-N	-1	3	349.387	1.984	20	5		EDBDHM
CC(=O)NC1CCC(Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1	ZINC000735475243	592984950	/nfs/dbraw/zinc/98/49/50/592984950.db2.gz	NXPJQKABBYRLRV-UHFFFAOYSA-N	-1	3	345.363	1.634	20	5		EDBDHM
CC(=O)NC1CCC(Nc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1	ZINC000735475243	592984951	/nfs/dbraw/zinc/98/49/51/592984951.db2.gz	NXPJQKABBYRLRV-UHFFFAOYSA-N	-1	3	345.363	1.634	20	5		EDBDHM
Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)[N-]N1CN=NC1=O	ZINC000807186915	593152405	/nfs/dbraw/zinc/15/24/05/593152405.db2.gz	XKJFODRQDCTWAO-UHFFFAOYSA-N	-1	3	342.109	1.347	20	5		EDBDHM
O=c1[n-]c(C2CCN(C[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC2)n[nH]1	ZINC000808755028	593285969	/nfs/dbraw/zinc/28/59/69/593285969.db2.gz	AZDZIJOKRUFABJ-CYBMUJFWSA-N	-1	3	333.348	1.332	20	5		EDBDHM
CN(C)CCN(CC(=O)[O-])C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000820539729	593827621	/nfs/dbraw/zinc/82/76/21/593827621.db2.gz	WXAKKMQPFMXZOI-UHFFFAOYSA-N	-1	3	348.359	1.093	20	5		EDBDHM
C[C@]1(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CCCC[C@@H]1O	ZINC000820623256	593847476	/nfs/dbraw/zinc/84/74/76/593847476.db2.gz	JRGOMYSNUAHRSG-SMDDNHRTSA-N	-1	3	333.352	1.523	20	5		EDBDHM
C[C@]1(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CCCC[C@@H]1O	ZINC000820623256	593847478	/nfs/dbraw/zinc/84/74/78/593847478.db2.gz	JRGOMYSNUAHRSG-SMDDNHRTSA-N	-1	3	333.352	1.523	20	5		EDBDHM
C[C@@H]1C[C@@H](Nc2nccc(-c3nnn[n-]3)c2[N+](=O)[O-])CN1C1CC1	ZINC000820666133	593857506	/nfs/dbraw/zinc/85/75/06/593857506.db2.gz	HBLWGHJBKGNCGS-RKDXNWHRSA-N	-1	3	330.352	1.207	20	5		EDBDHM
C[C@@H]1C[C@@H](Nc2nccc(-c3nn[n-]n3)c2[N+](=O)[O-])CN1C1CC1	ZINC000820666133	593857508	/nfs/dbraw/zinc/85/75/08/593857508.db2.gz	HBLWGHJBKGNCGS-RKDXNWHRSA-N	-1	3	330.352	1.207	20	5		EDBDHM
COC(=O)[C@]1(C)CCN(c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C1	ZINC000821654248	593898527	/nfs/dbraw/zinc/89/85/27/593898527.db2.gz	YAPCAZBQWNGLNS-CQSZACIVSA-N	-1	3	332.320	1.164	20	5		EDBDHM
COC(=O)[C@]1(C)CCN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C1	ZINC000821654248	593898528	/nfs/dbraw/zinc/89/85/28/593898528.db2.gz	YAPCAZBQWNGLNS-CQSZACIVSA-N	-1	3	332.320	1.164	20	5		EDBDHM
Cc1cc(=O)n(CCOc2cccc(-c3nnn[n-]3)c2)cc1[N+](=O)[O-]	ZINC000822160412	594002123	/nfs/dbraw/zinc/00/21/23/594002123.db2.gz	HLFGIHPQZIWWQD-UHFFFAOYSA-N	-1	3	342.315	1.324	20	5		EDBDHM
Cc1cc(=O)n(CCOc2cccc(-c3nn[n-]n3)c2)cc1[N+](=O)[O-]	ZINC000822160412	594002125	/nfs/dbraw/zinc/00/21/25/594002125.db2.gz	HLFGIHPQZIWWQD-UHFFFAOYSA-N	-1	3	342.315	1.324	20	5		EDBDHM
O=[N+]([O-])c1cc(N2CCC(c3ncc[nH]3)CC2)ccc1-c1nnn[n-]1	ZINC000823635491	594223559	/nfs/dbraw/zinc/22/35/59/594223559.db2.gz	XWZBIUDBPSOOBW-UHFFFAOYSA-N	-1	3	340.347	1.882	20	5		EDBDHM
O=[N+]([O-])c1cc(N2CCC(c3ncc[nH]3)CC2)ccc1-c1nn[n-]n1	ZINC000823635491	594223560	/nfs/dbraw/zinc/22/35/60/594223560.db2.gz	XWZBIUDBPSOOBW-UHFFFAOYSA-N	-1	3	340.347	1.882	20	5		EDBDHM
COc1ccc(OC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c([N+](=O)[O-])c1	ZINC000826210248	594380300	/nfs/dbraw/zinc/38/03/00/594380300.db2.gz	KCWOJYPVOVRPIF-UHFFFAOYSA-N	-1	3	330.260	1.331	20	5		EDBDHM
COc1ccc(OC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c([N+](=O)[O-])c1	ZINC000826210248	594380302	/nfs/dbraw/zinc/38/03/02/594380302.db2.gz	KCWOJYPVOVRPIF-UHFFFAOYSA-N	-1	3	330.260	1.331	20	5		EDBDHM
COc1ccc(OCCn2cc(C)c(-c3nnn[n-]3)c2)c([N+](=O)[O-])c1	ZINC000826211777	594380658	/nfs/dbraw/zinc/38/06/58/594380658.db2.gz	UAIGQTGXWCUUOE-UHFFFAOYSA-N	-1	3	344.331	1.972	20	5		EDBDHM
COc1ccc(OCCn2cc(C)c(-c3nn[n-]n3)c2)c([N+](=O)[O-])c1	ZINC000826211777	594380660	/nfs/dbraw/zinc/38/06/60/594380660.db2.gz	UAIGQTGXWCUUOE-UHFFFAOYSA-N	-1	3	344.331	1.972	20	5		EDBDHM
Cc1cc(=O)n(CC(=O)c2cccc(-c3nnn[n-]3)c2)cc1[N+](=O)[O-]	ZINC000826256428	594401089	/nfs/dbraw/zinc/40/10/89/594401089.db2.gz	IYMROVTVBXWBIO-UHFFFAOYSA-N	-1	3	340.299	1.128	20	5		EDBDHM
Cc1cc(=O)n(CC(=O)c2cccc(-c3nn[n-]n3)c2)cc1[N+](=O)[O-]	ZINC000826256428	594401091	/nfs/dbraw/zinc/40/10/91/594401091.db2.gz	IYMROVTVBXWBIO-UHFFFAOYSA-N	-1	3	340.299	1.128	20	5		EDBDHM
CC(C)N1C[C@@H](C)[C@H](NC(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000828424672	594416525	/nfs/dbraw/zinc/41/65/25/594416525.db2.gz	RUGIFTOHQXYBLO-QMTHXVAHSA-N	-1	3	335.360	1.752	20	5		EDBDHM
Cn1ncc([N+](=O)[O-])c1C(=O)OCc1ccc(F)c(-c2nnn[n-]2)c1	ZINC000826366301	594447651	/nfs/dbraw/zinc/44/76/51/594447651.db2.gz	BFMWOQBLVFYPHU-UHFFFAOYSA-N	-1	3	347.266	1.005	20	5		EDBDHM
Cn1ncc([N+](=O)[O-])c1C(=O)OCc1ccc(F)c(-c2nn[n-]n2)c1	ZINC000826366301	594447654	/nfs/dbraw/zinc/44/76/54/594447654.db2.gz	BFMWOQBLVFYPHU-UHFFFAOYSA-N	-1	3	347.266	1.005	20	5		EDBDHM
O=[N+]([O-])c1cnc(Sc2ccc(CO)cc2)c(-c2nnn[n-]2)c1	ZINC000826500801	594503618	/nfs/dbraw/zinc/50/36/18/594503618.db2.gz	MRNHARPPWUTNOU-UHFFFAOYSA-N	-1	3	330.329	1.813	20	5		EDBDHM
O=c1ccc([N+](=O)[O-])cn1CCSc1ccc(-c2nnn[n-]2)cc1	ZINC000826501808	594504033	/nfs/dbraw/zinc/50/40/33/594504033.db2.gz	HWCGCEKKILVCQA-UHFFFAOYSA-N	-1	3	344.356	1.729	20	5		EDBDHM
O=c1ccc([N+](=O)[O-])cn1CCSc1ccc(-c2nn[n-]n2)cc1	ZINC000826501808	594504036	/nfs/dbraw/zinc/50/40/36/594504036.db2.gz	HWCGCEKKILVCQA-UHFFFAOYSA-N	-1	3	344.356	1.729	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)co1	ZINC000832473291	594752914	/nfs/dbraw/zinc/75/29/14/594752914.db2.gz	MZFYFIQVVQBBMT-UHFFFAOYSA-N	-1	3	341.345	1.632	20	5		EDBDHM
Cc1cc(N2CCN(CC(=O)[O-])CC2)c2cccc([N+](=O)[O-])c2n1	ZINC000844214262	595303687	/nfs/dbraw/zinc/30/36/87/595303687.db2.gz	XCZVLDDWVQOQCM-UHFFFAOYSA-N	-1	3	330.344	1.658	20	5		EDBDHM
CCCNC(=O)C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848579880	595407867	/nfs/dbraw/zinc/40/78/67/595407867.db2.gz	DKIPPEPMDHOYEZ-UHFFFAOYSA-N	-1	3	331.275	1.209	20	5		EDBDHM
CN1CCC[C@@H]([N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000848581355	595408224	/nfs/dbraw/zinc/40/82/24/595408224.db2.gz	QHHWIWWPLZIXEL-SNVBAGLBSA-N	-1	3	329.303	1.777	20	5		EDBDHM
CCN(OC)C(=O)C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848593285	595412955	/nfs/dbraw/zinc/41/29/55/595412955.db2.gz	CYLHKFKDXRTTNS-UHFFFAOYSA-N	-1	3	347.274	1.093	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)C(OC)OC	ZINC000849407675	595522040	/nfs/dbraw/zinc/52/20/40/595522040.db2.gz	VJMFTNNOHVEXBS-JTQLQIEISA-N	-1	3	348.377	1.279	20	5		EDBDHM
O=c1[n-]ccc(N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1[N+](=O)[O-]	ZINC000853085957	595660378	/nfs/dbraw/zinc/66/03/78/595660378.db2.gz	BPBPCDCGMNCRNO-UHFFFAOYSA-N	-1	3	345.315	1.930	20	5		EDBDHM
CSc1cccc(C(=O)[N-]OCCN2CCCC2=O)c1[N+](=O)[O-]	ZINC000856042593	595883327	/nfs/dbraw/zinc/88/33/27/595883327.db2.gz	JIKCDHMHQYOEOF-UHFFFAOYSA-N	-1	3	339.373	1.601	20	5		EDBDHM
COCOCCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000859383449	596074554	/nfs/dbraw/zinc/07/45/54/596074554.db2.gz	QNQHJRFBHSYXLO-UHFFFAOYSA-N	-1	3	338.769	1.537	20	5		EDBDHM
C[C@@]1(C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CCCC[C@H]1O	ZINC000119924506	596796564	/nfs/dbraw/zinc/79/65/64/596796564.db2.gz	XVLXEFDNZIEOGU-PWSUYJOCSA-N	-1	3	334.419	1.876	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]CC2(CO)CC2)cc1[N+](=O)[O-]	ZINC000124397094	597189585	/nfs/dbraw/zinc/18/95/85/597189585.db2.gz	QMLAJAOIRYNKEJ-UHFFFAOYSA-N	-1	3	334.781	1.607	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NCCOC[C@H]1CCOC1	ZINC000738360473	598594543	/nfs/dbraw/zinc/59/45/43/598594543.db2.gz	XHDRCSHPMKMFJW-JTQLQIEISA-N	-1	3	334.336	1.240	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NCCOC[C@H]1CCOC1	ZINC000738360473	598594545	/nfs/dbraw/zinc/59/45/45/598594545.db2.gz	XHDRCSHPMKMFJW-JTQLQIEISA-N	-1	3	334.336	1.240	20	5		EDBDHM
O=C(Nc1cnn(-c2ccccn2)c1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000562472546	306299607	/nfs/dbraw/zinc/29/96/07/306299607.db2.gz	IKNYWILUTRPNPH-UHFFFAOYSA-N	-1	3	326.272	1.528	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H]1c2ccccc2C[C@H]1O	ZINC000097271786	138296800	/nfs/dbraw/zinc/29/68/00/138296800.db2.gz	OADASWXOICLAMV-HIFRSBDPSA-N	-1	3	334.353	1.531	20	5		EDBDHM
CCC1(C[N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])COC1	ZINC000451950150	305373544	/nfs/dbraw/zinc/37/35/44/305373544.db2.gz	FWMUVVDWLCSTJV-UHFFFAOYSA-N	-1	3	330.362	1.308	20	5		EDBDHM
Cc1c(Cl)cc(S(=O)(=O)[N-]C[C@H](O)C(F)F)cc1[N+](=O)[O-]	ZINC000228619465	139023284	/nfs/dbraw/zinc/02/32/84/139023284.db2.gz	UPDWANCQBYAAMM-VIFPVBQESA-N	-1	3	344.723	1.461	20	5		EDBDHM
C[C@H](O)CC[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000416402157	251066470	/nfs/dbraw/zinc/06/64/70/251066470.db2.gz	KJNLCRPGDMBLOS-ZETCQYMHSA-N	-1	3	342.295	1.663	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])[C@@H](O)C(C)C	ZINC000416618485	251084866	/nfs/dbraw/zinc/08/48/66/251084866.db2.gz	JPXXPEYNISBTQU-FZMZJTMJSA-N	-1	3	346.405	1.677	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C)C(=O)NC(C)C	ZINC000416622421	251088092	/nfs/dbraw/zinc/08/80/92/251088092.db2.gz	LYTXVVPQZLJCSE-JTQLQIEISA-N	-1	3	329.378	1.095	20	5		EDBDHM
O=C1NCCCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000056046801	296366985	/nfs/dbraw/zinc/36/69/85/296366985.db2.gz	NCVONHGCPXQEQJ-SNVBAGLBSA-N	-1	3	347.780	1.195	20	5		EDBDHM
CNc1ccc(C(=O)N2CCC[C@@H]2c2nc(=N)n(C)[n-]2)cc1[N+](=O)[O-]	ZINC000571171628	306559520	/nfs/dbraw/zinc/55/95/20/306559520.db2.gz	QUEGBVUPBVCXRO-LLVKDONJSA-N	-1	3	345.363	1.155	20	5		EDBDHM
CCOC(=O)C[N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl	ZINC000272090433	140399221	/nfs/dbraw/zinc/39/92/21/140399221.db2.gz	JFFIPGPCUPOENO-UHFFFAOYSA-N	-1	3	336.753	1.398	20	5		EDBDHM
C[C@@]1(CO)CCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000340079494	142259439	/nfs/dbraw/zinc/25/94/39/142259439.db2.gz	ZVBTVMMHJOPHIP-STQMWFEESA-N	-1	3	332.353	1.563	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H](CO)C(C)C)c([N+](=O)[O-])c1	ZINC000344807426	143014117	/nfs/dbraw/zinc/01/41/17/143014117.db2.gz	JERRFYMTKZRMRX-SNVBAGLBSA-N	-1	3	332.378	1.146	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1C=CCCC1	ZINC000345537210	143103196	/nfs/dbraw/zinc/10/31/96/143103196.db2.gz	HSRWJCMKAHBCMQ-SNVBAGLBSA-N	-1	3	340.357	1.768	20	5		EDBDHM
Cn1cnc([N+](=O)[O-])c1-c1noc(-c2n[n-]nc2-c2ccccc2)n1	ZINC000347125220	143285380	/nfs/dbraw/zinc/28/53/80/143285380.db2.gz	ZKDDUKFHEYNSJP-UHFFFAOYSA-N	-1	3	338.287	1.830	20	5		EDBDHM
CCN1CC[C@@H]2OCCN(C(=O)c3cc([O-])cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000355368347	150237393	/nfs/dbraw/zinc/23/73/93/150237393.db2.gz	LGYACWGLHYGZQZ-CABCVRRESA-N	-1	3	335.360	1.236	20	5		EDBDHM
Cc1noc([C@H](C)[N-]S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)n1	ZINC000355619938	150339997	/nfs/dbraw/zinc/33/99/97/150339997.db2.gz	PCMMOMXODWERHO-VIFPVBQESA-N	-1	3	340.361	1.509	20	5		EDBDHM
COc1ccc(NC(=O)c2cnc3c(cnn3C)c2[O-])cc1[N+](=O)[O-]	ZINC000360736210	152176761	/nfs/dbraw/zinc/17/67/61/152176761.db2.gz	GGLMUGYLJIIQON-UHFFFAOYSA-N	-1	3	343.299	1.843	20	5		EDBDHM
O=C(Cc1ccc([N+](=O)[O-])cc1F)NCc1nnc(C(F)(F)F)[n-]1	ZINC000360810860	152215530	/nfs/dbraw/zinc/21/55/30/152215530.db2.gz	DYJZEIYGYZGERZ-UHFFFAOYSA-N	-1	3	347.228	1.730	20	5		EDBDHM
O=C(Cc1ccc([N+](=O)[O-])cc1F)NCc1n[n-]c(C(F)(F)F)n1	ZINC000360810860	152215532	/nfs/dbraw/zinc/21/55/32/152215532.db2.gz	DYJZEIYGYZGERZ-UHFFFAOYSA-N	-1	3	347.228	1.730	20	5		EDBDHM
O=C(Cc1ccc([N+](=O)[O-])cc1F)NCc1nc(C(F)(F)F)n[n-]1	ZINC000360810860	152215533	/nfs/dbraw/zinc/21/55/33/152215533.db2.gz	DYJZEIYGYZGERZ-UHFFFAOYSA-N	-1	3	347.228	1.730	20	5		EDBDHM
Cc1cc(C(=O)N[C@H]2CCN(c3ccccn3)C2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000367114533	154012731	/nfs/dbraw/zinc/01/27/31/154012731.db2.gz	OXZHWNSOPNLZEX-NSHDSACASA-N	-1	3	343.343	1.408	20	5		EDBDHM
NS(=O)(=O)c1ccc(C(=O)[N-]c2cc(F)cc([N+](=O)[O-])c2)s1	ZINC000352179377	162033419	/nfs/dbraw/zinc/03/34/19/162033419.db2.gz	XLUYCSQYLFDBEZ-UHFFFAOYSA-N	-1	3	345.333	1.695	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CSC[C@@H]1C	ZINC000352345983	162131548	/nfs/dbraw/zinc/13/15/48/162131548.db2.gz	PAFNHMVBTPEWNR-WPRPVWTQSA-N	-1	3	332.403	1.633	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@H](O)C(C)C)c1C	ZINC000121972486	287376503	/nfs/dbraw/zinc/37/65/03/287376503.db2.gz	CCRFQUFOSYWSEA-ZDUSSCGKSA-N	-1	3	330.406	1.897	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCNC(=O)C(C)C)cc1[N+](=O)[O-]	ZINC000122864316	222173933	/nfs/dbraw/zinc/17/39/33/222173933.db2.gz	ILCMLGCVPOPWPJ-UHFFFAOYSA-N	-1	3	335.407	1.015	20	5		EDBDHM
CCC[C@@H](CCO)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000123746231	222325967	/nfs/dbraw/zinc/32/59/67/222325967.db2.gz	QZCJHMSPHMAZSB-JTQLQIEISA-N	-1	3	334.369	1.811	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCc2nccs2)cc1[N+](=O)[O-]	ZINC000123478134	222284524	/nfs/dbraw/zinc/28/45/24/222284524.db2.gz	MFZJLCLKDUQCOZ-UHFFFAOYSA-N	-1	3	333.416	1.942	20	5		EDBDHM
CCCC[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000273986474	273064924	/nfs/dbraw/zinc/06/49/24/273064924.db2.gz	RBMAULIDMUAWOD-JTQLQIEISA-N	-1	3	330.362	1.605	20	5		EDBDHM
CCCCCCNC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000280691324	273386240	/nfs/dbraw/zinc/38/62/40/273386240.db2.gz	DKFHZZRDHWNSSA-UHFFFAOYSA-N	-1	3	343.405	1.570	20	5		EDBDHM
CCCCN(CC)C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000280773081	273396541	/nfs/dbraw/zinc/39/65/41/273396541.db2.gz	NDOJZGLNFKVSAN-UHFFFAOYSA-N	-1	3	343.405	1.522	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCC2(O)CCC2)cc1C	ZINC000283821880	273974233	/nfs/dbraw/zinc/97/42/33/273974233.db2.gz	FLXAARJIHLQHHD-UHFFFAOYSA-N	-1	3	328.390	1.795	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C1CC1)C(C)(C)CO	ZINC000289624684	288745992	/nfs/dbraw/zinc/74/59/92/288745992.db2.gz	TVWYAPUTUJHJDB-CQSZACIVSA-N	-1	3	342.417	1.979	20	5		EDBDHM
Cc1nnsc1C[N-]S(=O)(=O)CCc1ccccc1[N+](=O)[O-]	ZINC000292005232	289237087	/nfs/dbraw/zinc/23/70/87/289237087.db2.gz	LZPKTQREYYQKOK-UHFFFAOYSA-N	-1	3	342.402	1.417	20	5		EDBDHM
Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H]2C[C@@]2(C)NC(=O)[N-]C2=O)n1	ZINC000343356383	301203651	/nfs/dbraw/zinc/20/36/51/301203651.db2.gz	QIWNIGJVMXXHEF-BDJLRTHQSA-N	-1	3	347.375	1.564	20	5		EDBDHM
CO[C@H](C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C1CC1	ZINC000293932767	303040430	/nfs/dbraw/zinc/04/04/30/303040430.db2.gz	YXGYXMDYIFHJBR-CYBMUJFWSA-N	-1	3	328.390	1.915	20	5		EDBDHM
CCN1CC[C@H]2OCCN(C(=O)c3cccc([O-])c3[N+](=O)[O-])[C@H]2C1	ZINC000294015097	303051833	/nfs/dbraw/zinc/05/18/33/303051833.db2.gz	YUNBBVJJVPSVGD-GXTWGEPZSA-N	-1	3	335.360	1.236	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@]2(O)CCC[C@H]2C)c([N+](=O)[O-])c1	ZINC000294422342	303104795	/nfs/dbraw/zinc/10/47/95/303104795.db2.gz	DMNCUDWPOYAFPB-YGRLFVJLSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COC(=O)c1cccc(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)c1[O-]	ZINC000436804370	305167412	/nfs/dbraw/zinc/16/74/12/305167412.db2.gz	UMCNSYSBWHSLKC-UHFFFAOYSA-N	-1	3	334.288	1.381	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])n[nH]1	ZINC000451592067	305355267	/nfs/dbraw/zinc/35/52/67/305355267.db2.gz	FGUKIHJVUDHDJP-UHFFFAOYSA-N	-1	3	325.350	1.062	20	5		EDBDHM
CCc1nnc(C[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])[nH]1	ZINC000451592067	305355268	/nfs/dbraw/zinc/35/52/68/305355268.db2.gz	FGUKIHJVUDHDJP-UHFFFAOYSA-N	-1	3	325.350	1.062	20	5		EDBDHM
CO[C@@H]1COCC[C@H]1C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000451771001	305368253	/nfs/dbraw/zinc/36/82/53/305368253.db2.gz	GQTPJTXYPPHVAP-WCQYABFASA-N	-1	3	344.389	1.233	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCC[C@H]2CCOC2)c(F)c1	ZINC000452016158	305378609	/nfs/dbraw/zinc/37/86/09/305378609.db2.gz	LCCQEOYGGUQHIP-JTQLQIEISA-N	-1	3	332.353	1.829	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCC[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000452023134	305379326	/nfs/dbraw/zinc/37/93/26/305379326.db2.gz	WIEYKLOXVAHULX-GFCCVEGCSA-N	-1	3	328.390	1.998	20	5		EDBDHM
CC[C@H](CCO)[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	ZINC000491516565	305576452	/nfs/dbraw/zinc/57/64/52/305576452.db2.gz	XEFKMOCYCZKABT-MRVPVSSYSA-N	-1	3	336.341	1.182	20	5		EDBDHM
O=C(Cc1cncc([O-])c1)N1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000521370386	305788979	/nfs/dbraw/zinc/78/89/79/305788979.db2.gz	RULRVLKAMBWRGV-UHFFFAOYSA-N	-1	3	329.312	1.659	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@H](CO)Cc1ccco1	ZINC000533697697	306002490	/nfs/dbraw/zinc/00/24/90/306002490.db2.gz	WRUNUSDNGLRCIR-LLVKDONJSA-N	-1	3	340.357	1.317	20	5		EDBDHM
CCOc1ccc([N+](=O)[O-])c(C(=O)NCCc2c(C)[n-][nH]c2=O)c1	ZINC000555008982	306199595	/nfs/dbraw/zinc/19/95/95/306199595.db2.gz	DAFPRRGRIKSBMJ-NSHDSACASA-N	-1	3	334.332	1.235	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCCn1cccn1	ZINC000030518648	441494746	/nfs/dbraw/zinc/49/47/46/441494746.db2.gz	WOYYQVKGVIBXDC-UHFFFAOYSA-N	-1	3	340.361	1.169	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2CCCN(C)C2)c([N+](=O)[O-])c1	ZINC000108406633	441451927	/nfs/dbraw/zinc/45/19/27/441451927.db2.gz	AAZVEORWNUYXMB-NSHDSACASA-N	-1	3	343.405	1.224	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](C(N)=O)C(C)(C)C)c([N+](=O)[O-])c1	ZINC000113290438	441598258	/nfs/dbraw/zinc/59/82/58/441598258.db2.gz	XKRGHQUGXRCXIS-LLVKDONJSA-N	-1	3	329.378	1.082	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCCNC(=O)C(C)C)c([N+](=O)[O-])c1	ZINC000158690925	441755086	/nfs/dbraw/zinc/75/50/86/441755086.db2.gz	TYKXDZFMTJSTKZ-UHFFFAOYSA-N	-1	3	343.405	1.344	20	5		EDBDHM
O=C(Nc1cccc(N2CCCC2=O)c1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000139906118	441829560	/nfs/dbraw/zinc/82/95/60/441829560.db2.gz	UFDBTNABQYWYQN-UHFFFAOYSA-N	-1	3	342.311	1.662	20	5		EDBDHM
Nc1nc([N-]c2cnn(CCN3CCCCC3)c2)ncc1[N+](=O)[O-]	ZINC000092978345	441845112	/nfs/dbraw/zinc/84/51/12/441845112.db2.gz	LGWVEHVFYIUSNU-UHFFFAOYSA-N	-1	3	332.368	1.393	20	5		EDBDHM
C[C@@]1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCCC[C@H]1O	ZINC000124806576	441955505	/nfs/dbraw/zinc/95/55/05/441955505.db2.gz	MOHAPAYESDVKQO-KGLIPLIRSA-N	-1	3	346.380	1.953	20	5		EDBDHM
C[C@@H](O)C[C@@H](C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000120765911	442129251	/nfs/dbraw/zinc/12/92/51/442129251.db2.gz	OCGHLJROTOKYHX-RKDXNWHRSA-N	-1	3	336.797	1.934	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCCn2ccnn2)cc1C	ZINC000183161582	318519601	/nfs/dbraw/zinc/51/96/01/318519601.db2.gz	DHIXOBMNHJGXNJ-UHFFFAOYSA-N	-1	3	339.377	1.172	20	5		EDBDHM
CCC(CC)[C@@H](O)C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000184551616	443037854	/nfs/dbraw/zinc/03/78/54/443037854.db2.gz	YKWYQBYNFFGXKP-AWEZNQCLSA-N	-1	3	330.406	1.811	20	5		EDBDHM
CSC1(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCOCC1	ZINC000266202394	443055646	/nfs/dbraw/zinc/05/56/46/443055646.db2.gz	OUEAOOXJEXEDTK-UHFFFAOYSA-N	-1	3	346.430	1.785	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)c1cnn(C)c1	ZINC000266245065	443072659	/nfs/dbraw/zinc/07/26/59/443072659.db2.gz	WSPYTLQDUBKGSL-SECBINFHSA-N	-1	3	340.361	1.376	20	5		EDBDHM
COC(=O)[C@@H](C)C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000268782963	443106762	/nfs/dbraw/zinc/10/67/62/443106762.db2.gz	KTQLNJFRRDJMMD-JTQLQIEISA-N	-1	3	330.362	1.299	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2C[C@H]3OCCC[C@H]23)c(F)c1	ZINC000190619183	443150384	/nfs/dbraw/zinc/15/03/84/443150384.db2.gz	DALMSUKOJAPERL-YUSALJHKSA-N	-1	3	330.337	1.580	20	5		EDBDHM
O=[N+]([O-])c1ccc([C@@H](O)[C@@H](CO)NCc2cc([O-])cc(F)c2)cc1	ZINC000185538969	443216246	/nfs/dbraw/zinc/21/62/46/443216246.db2.gz	YDPZYRHDAAAKJM-HZPDHXFCSA-N	-1	3	336.319	1.624	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CS[C@@H](C)C1	ZINC000416583469	319447484	/nfs/dbraw/zinc/44/74/84/319447484.db2.gz	FKWBETREELCAIX-DTWKUNHWSA-N	-1	3	332.403	1.776	20	5		EDBDHM
C[C@@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br	ZINC000269465985	443315345	/nfs/dbraw/zinc/31/53/45/443315345.db2.gz	JAZKHLLSRRAAJN-ZCFIWIBFSA-N	-1	3	339.167	1.016	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](O)C(F)(F)F)cc1C	ZINC000269742946	443420448	/nfs/dbraw/zinc/42/04/48/443420448.db2.gz	VNRHAYQMIOPLFK-JTQLQIEISA-N	-1	3	342.295	1.413	20	5		EDBDHM
CON1CCC([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)CC1	ZINC000420743207	319643549	/nfs/dbraw/zinc/64/35/49/319643549.db2.gz	ACLJOMGFONOTJY-UHFFFAOYSA-N	-1	3	335.407	1.269	20	5		EDBDHM
C[C@@]1([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCO[C@H]1C1CC1	ZINC000273102171	443539370	/nfs/dbraw/zinc/53/93/70/443539370.db2.gz	OWNLTWZHZSEVDR-UONOGXRCSA-N	-1	3	326.374	1.831	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC(C)(C)C[C@@H](C)O	ZINC000272164781	443545175	/nfs/dbraw/zinc/54/51/75/443545175.db2.gz	ZWPYUEHBWBKGJH-SNVBAGLBSA-N	-1	3	346.405	1.679	20	5		EDBDHM
COC(=O)[C@H](C)[N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl	ZINC000272413833	443618125	/nfs/dbraw/zinc/61/81/25/443618125.db2.gz	CQEXGHGWMJKERC-ZETCQYMHSA-N	-1	3	336.753	1.396	20	5		EDBDHM
C[C@]1(C[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2)NC(=O)[N-]C1=O	ZINC000286102620	443646597	/nfs/dbraw/zinc/64/65/97/443646597.db2.gz	FKPPFPMBCDYNLW-MLGOLLRUSA-N	-1	3	346.343	1.188	20	5		EDBDHM
Cc1cc(N2CCC[C@@H]2C[C@]2(C)NC(=O)[N-]C2=O)ccc1[N+](=O)[O-]	ZINC000286183815	443663365	/nfs/dbraw/zinc/66/33/65/443663365.db2.gz	AAGWMIOMHLUNAI-WBMJQRKESA-N	-1	3	332.360	1.860	20	5		EDBDHM
CN1CCCC(C)(C)[C@@H]1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000447940709	320148948	/nfs/dbraw/zinc/14/89/48/320148948.db2.gz	OVVVLJGCMTUQTA-AWEZNQCLSA-N	-1	3	341.433	1.994	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@@H]2CCCOC2)cc1[N+](=O)[O-]	ZINC000491186343	320365871	/nfs/dbraw/zinc/36/58/71/320365871.db2.gz	KVOLEYLUISFSHP-VIFPVBQESA-N	-1	3	348.352	1.447	20	5		EDBDHM
Cc1cc(=O)[n-]c([C@H](C)N2CCN(c3ncccc3[N+](=O)[O-])CC2)n1	ZINC000298191396	443716563	/nfs/dbraw/zinc/71/65/63/443716563.db2.gz	WVKCKPGVDGUDTP-LBPRGKRZSA-N	-1	3	344.375	1.677	20	5		EDBDHM
CC(C)[C@@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1nncn1C	ZINC000285362303	443957071	/nfs/dbraw/zinc/95/70/71/443957071.db2.gz	QRDIVIFPOIQAEY-GFCCVEGCSA-N	-1	3	339.377	1.399	20	5		EDBDHM
C[C@H]1CN(CCCNC(=O)c2ccc([N+](=O)[O-])c([O-])c2)CCCO1	ZINC000277665886	444023614	/nfs/dbraw/zinc/02/36/14/444023614.db2.gz	UHLJVFBWLLTJOJ-LBPRGKRZSA-N	-1	3	337.376	1.531	20	5		EDBDHM
COc1cc(C(=O)[N-]O[C@@H]2CCCCO2)c([N+](=O)[O-])cc1OC	ZINC000299612357	444095070	/nfs/dbraw/zinc/09/50/70/444095070.db2.gz	CFLIDZIKMSBZBK-CYBMUJFWSA-N	-1	3	326.305	1.800	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCC(C)(C)CO)c([N+](=O)[O-])c1	ZINC000295246236	444173098	/nfs/dbraw/zinc/17/30/98/444173098.db2.gz	JXVRKWBLVPVUNZ-UHFFFAOYSA-N	-1	3	332.378	1.290	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]C[C@H](O)C1CCC1	ZINC000316165811	444308979	/nfs/dbraw/zinc/30/89/79/444308979.db2.gz	YAMIQHYQPHWTSD-NSHDSACASA-N	-1	3	334.781	1.688	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000323727639	444345783	/nfs/dbraw/zinc/34/57/83/444345783.db2.gz	MKASSLQJRHQZBQ-GHMZBOCLSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COC(=O)c1cc([N-]C(=O)c2conc2C(C)(C)N)cc([N+](=O)[O-])c1	ZINC000579494527	321942643	/nfs/dbraw/zinc/94/26/43/321942643.db2.gz	RKNLHNGCEOJPIQ-UHFFFAOYSA-N	-1	3	348.315	1.816	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2C)nc(C)n1	ZINC000340765517	444503610	/nfs/dbraw/zinc/50/36/10/444503610.db2.gz	GSLIYSFJUZZZEJ-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CCC[C@H](O)C1	ZINC000336872386	444817478	/nfs/dbraw/zinc/81/74/78/444817478.db2.gz	MRDAAXWKFRCLPU-PWSUYJOCSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)CC1CC1	ZINC000336871938	444817520	/nfs/dbraw/zinc/81/75/20/444817520.db2.gz	IYDREJQHHMAIBW-VIFPVBQESA-N	-1	3	342.373	1.848	20	5		EDBDHM
Cn1cnc(S(=O)(=O)[N-]Cc2ccc([N+](=O)[O-])cc2Cl)c1	ZINC000341642448	444930633	/nfs/dbraw/zinc/93/06/33/444930633.db2.gz	PINMEOBWVCQUPS-UHFFFAOYSA-N	-1	3	330.753	1.460	20	5		EDBDHM
COC(=O)Cc1nnc(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)[n-]1	ZINC000342920577	444942319	/nfs/dbraw/zinc/94/23/19/444942319.db2.gz	KOLFYOXSNQAZSD-UHFFFAOYSA-N	-1	3	344.287	1.162	20	5		EDBDHM
COC(=O)Cc1n[n-]c(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)n1	ZINC000342920577	444942323	/nfs/dbraw/zinc/94/23/23/444942323.db2.gz	KOLFYOXSNQAZSD-UHFFFAOYSA-N	-1	3	344.287	1.162	20	5		EDBDHM
COC(=O)Cc1nc(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)n[n-]1	ZINC000342920577	444942327	/nfs/dbraw/zinc/94/23/27/444942327.db2.gz	KOLFYOXSNQAZSD-UHFFFAOYSA-N	-1	3	344.287	1.162	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@]2(O)CCC[C@H]2C)c([N+](=O)[O-])c1	ZINC000339095288	445030190	/nfs/dbraw/zinc/03/01/90/445030190.db2.gz	KSBFNYSHVGLVQO-BXUZGUMPSA-N	-1	3	328.390	1.733	20	5		EDBDHM
C[C@@H]1CN(Cc2cc([O-])ccc2[N+](=O)[O-])C[C@H]1C(=O)N1CCOCC1	ZINC000339191331	445081674	/nfs/dbraw/zinc/08/16/74/445081674.db2.gz	OEOLBYGCYXCBRM-IUODEOHRSA-N	-1	3	349.387	1.227	20	5		EDBDHM
Cc1cc(CS(=O)(=O)[N-]Cc2cccc([N+](=O)[O-])c2C)on1	ZINC000360135077	445587697	/nfs/dbraw/zinc/58/76/97/445587697.db2.gz	YVXXZYYPFUQXPW-UHFFFAOYSA-N	-1	3	325.346	1.819	20	5		EDBDHM
COCCOCCCC[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000355968712	445549894	/nfs/dbraw/zinc/54/98/94/445549894.db2.gz	YZNRRCNFCPWWTB-UHFFFAOYSA-N	-1	3	346.405	1.625	20	5		EDBDHM
CS(=O)(=O)c1cc(C(=O)Nc2cccc([O-])c2)cc([N+](=O)[O-])c1	ZINC000349952949	445732473	/nfs/dbraw/zinc/73/24/73/445732473.db2.gz	SDWZFRPQFXMILS-UHFFFAOYSA-N	-1	3	336.325	1.956	20	5		EDBDHM
Cn1nc([N+](=O)[O-])cc1C(=O)[N-]c1cc(S(C)(=O)=O)ccc1F	ZINC000361828267	445985521	/nfs/dbraw/zinc/98/55/21/445985521.db2.gz	KGDMHHSFMPKXJR-UHFFFAOYSA-N	-1	3	342.308	1.123	20	5		EDBDHM
O=c1[n-]c(Cn2cnc([N+](=O)[O-])n2)nc2c1cnn2-c1ccccc1	ZINC000356770157	446000042	/nfs/dbraw/zinc/00/00/42/446000042.db2.gz	IQIGGSQKTUSTBU-UHFFFAOYSA-N	-1	3	338.287	1.069	20	5		EDBDHM
C/C=C\C[C@@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000351618134	446213827	/nfs/dbraw/zinc/21/38/27/446213827.db2.gz	GUPHMOSNDTXZCS-XADBCAIWSA-N	-1	3	334.781	1.854	20	5		EDBDHM
O=C(Nc1n[nH]c(-c2ccncc2)n1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000366600994	446276045	/nfs/dbraw/zinc/27/60/45/446276045.db2.gz	JRYHLFDSLZGDKD-UHFFFAOYSA-N	-1	3	327.260	1.128	20	5		EDBDHM
CC(=O)N1Cc2ccc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)cc2C1	ZINC000365648975	446287129	/nfs/dbraw/zinc/28/71/29/446287129.db2.gz	MCXDIJVUROBVRA-UHFFFAOYSA-N	-1	3	342.311	1.810	20	5		EDBDHM
CC[C@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)CCO1	ZINC000420731569	446777254	/nfs/dbraw/zinc/77/72/54/446777254.db2.gz	SDPCOXCFWMUSOP-JQWIXIFHSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CCn1ccc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)n1	ZINC000416595961	447657151	/nfs/dbraw/zinc/65/71/51/447657151.db2.gz	YWNYNHLISYXCQK-UHFFFAOYSA-N	-1	3	340.361	1.298	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CC12CCOCC2	ZINC000451893896	447775730	/nfs/dbraw/zinc/77/57/30/447775730.db2.gz	UHGSTBXJNHSDFI-CYBMUJFWSA-N	-1	3	342.373	1.451	20	5		EDBDHM
CN1CCN(C(=O)c2n[n-]c3ccc([N+](=O)[O-])cc32)c2cccnc21	ZINC000488227756	447843788	/nfs/dbraw/zinc/84/37/88/447843788.db2.gz	GOXQMOCYIUCWDT-UHFFFAOYSA-N	-1	3	338.327	1.963	20	5		EDBDHM
CCOc1ccc(C(=O)N2CCc3c(=O)[n-]cnc3C2)cc1[N+](=O)[O-]	ZINC000571002742	448093782	/nfs/dbraw/zinc/09/37/82/448093782.db2.gz	JLCODWPGFUSJGC-UHFFFAOYSA-N	-1	3	344.327	1.688	20	5		EDBDHM
O=c1cc(Cn2cnc3sc([N+](=O)[O-])cc3c2=O)nc(C2CC2)[n-]1	ZINC000572600849	448419197	/nfs/dbraw/zinc/41/91/97/448419197.db2.gz	PRZSOWQQDRFSCA-UHFFFAOYSA-N	-1	3	345.340	1.788	20	5		EDBDHM
CN1CCC(O)(CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2[O-])CC1	ZINC000567354697	448674563	/nfs/dbraw/zinc/67/45/63/448674563.db2.gz	LDYSHUSSPINEDM-UHFFFAOYSA-N	-1	3	343.767	1.140	20	5		EDBDHM
CC[C@H](C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)OC	ZINC000592076878	448663446	/nfs/dbraw/zinc/66/34/46/448663446.db2.gz	JRJOLDYOLNGWLC-SNVBAGLBSA-N	-1	3	330.362	1.381	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)n[n-]1	ZINC000541904579	448703055	/nfs/dbraw/zinc/70/30/55/448703055.db2.gz	WCBZWLJXHOIOFQ-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)[n-]n1	ZINC000541904579	448703059	/nfs/dbraw/zinc/70/30/59/448703059.db2.gz	WCBZWLJXHOIOFQ-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
C[C@H]1C[C@H]1N1CCN(c2ncc(C(=O)[O-])cc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000568869274	448931880	/nfs/dbraw/zinc/93/18/80/448931880.db2.gz	ULAZQXFZTZUDNB-GMXVVIOVSA-N	-1	3	334.376	1.855	20	5		EDBDHM
CSc1ccc([N+](=O)[O-])c(C(=O)NCCc2c(C)[n-][nH]c2=O)c1	ZINC000522263007	449068977	/nfs/dbraw/zinc/06/89/77/449068977.db2.gz	RQBBIIHQGYNRAE-SNVBAGLBSA-N	-1	3	336.373	1.559	20	5		EDBDHM
C[C@]1([N-]S(=O)(=O)c2ccc3ncccc3c2[N+](=O)[O-])CCOC1	ZINC000594765792	449679430	/nfs/dbraw/zinc/67/94/30/449679430.db2.gz	QHPAERLIWAJHTP-AWEZNQCLSA-N	-1	3	337.357	1.600	20	5		EDBDHM
CC(C)N1CCC[C@H]([N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])C1	ZINC000594767117	449680702	/nfs/dbraw/zinc/68/07/02/449680702.db2.gz	LRJSKQYRUSMHQM-NSHDSACASA-N	-1	3	328.394	1.141	20	5		EDBDHM
CO[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[C@H]1CCOC1	ZINC000594791466	449701118	/nfs/dbraw/zinc/70/11/18/449701118.db2.gz	NLCTYBCUSFFMEY-CABZTGNLSA-N	-1	3	348.352	1.064	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2C[C@@H](O)C23CCC3)c(Cl)c1	ZINC000594866690	449781388	/nfs/dbraw/zinc/78/13/88/449781388.db2.gz	YFKCWTSCNPIJPY-VXGBXAGGSA-N	-1	3	346.792	1.830	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@H]2CCCOC2)c(F)cc1[N+](=O)[O-]	ZINC000601312320	449822316	/nfs/dbraw/zinc/82/23/16/449822316.db2.gz	IQJAPEYBCUWJKB-JTQLQIEISA-N	-1	3	332.353	1.747	20	5		EDBDHM
CCN1CCC[C@@H]([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)C1	ZINC000601314120	449823910	/nfs/dbraw/zinc/82/39/10/449823910.db2.gz	YXVUUZJFIPVCGJ-LLVKDONJSA-N	-1	3	345.396	1.805	20	5		EDBDHM
COC1(C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])CCOCC1	ZINC000612681024	449833291	/nfs/dbraw/zinc/83/32/91/449833291.db2.gz	FVAZETKPWWTAMJ-UHFFFAOYSA-N	-1	3	344.389	1.210	20	5		EDBDHM
O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCc2c(=O)[n-]cnc2C1	ZINC000612616666	449800769	/nfs/dbraw/zinc/80/07/69/449800769.db2.gz	SQIZJSKMRWXAFO-UHFFFAOYSA-N	-1	3	333.279	1.820	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)COc2cccc([N+](=O)[O-])c2)[n-]1	ZINC000617872782	449890418	/nfs/dbraw/zinc/89/04/18/449890418.db2.gz	YWMMHKGBYPCUAG-UHFFFAOYSA-N	-1	3	334.288	1.512	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)COc2cccc([N+](=O)[O-])c2)c[n-]1	ZINC000617872782	449890424	/nfs/dbraw/zinc/89/04/24/449890424.db2.gz	YWMMHKGBYPCUAG-UHFFFAOYSA-N	-1	3	334.288	1.512	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@]12C[C@H]1COC2(C)C	ZINC000599395555	449940744	/nfs/dbraw/zinc/94/07/44/449940744.db2.gz	AMMPAKRBEXGSMN-IINYFYTJSA-N	-1	3	326.374	1.749	20	5		EDBDHM
CCCN1CC[C@H]([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)C1	ZINC000601468918	449991387	/nfs/dbraw/zinc/99/13/87/449991387.db2.gz	VYHNDABJHHALBN-NSHDSACASA-N	-1	3	345.396	1.805	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCN(C)CC(F)F	ZINC000599521337	450040215	/nfs/dbraw/zinc/04/02/15/450040215.db2.gz	FVTUBHFHDZDNOW-UHFFFAOYSA-N	-1	3	337.348	1.378	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](C)c2nccn2C)c1[N+](=O)[O-]	ZINC000595384219	450099050	/nfs/dbraw/zinc/09/90/50/450099050.db2.gz	ULCTVYIMJNYBHO-NSHDSACASA-N	-1	3	338.389	1.985	20	5		EDBDHM
COC(=O)[C@H]1C[C@H]([N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C1	ZINC000595396953	450109879	/nfs/dbraw/zinc/10/98/79/450109879.db2.gz	GFFMRTGXUUPWKK-XYPYZODXSA-N	-1	3	342.373	1.442	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCN2CC[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000610409268	450210063	/nfs/dbraw/zinc/21/00/63/450210063.db2.gz	DVMXVZSOHWEJCZ-LBPRGKRZSA-N	-1	3	327.406	1.523	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2n[nH]c(C)c2Br)n1	ZINC000597732656	450226864	/nfs/dbraw/zinc/22/68/64/450226864.db2.gz	XQVAGJFPMNMGDR-UHFFFAOYSA-N	-1	3	343.141	1.858	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](CCO)C(C)C	ZINC000619487205	450487693	/nfs/dbraw/zinc/48/76/93/450487693.db2.gz	KRCGAPOIMGKLTR-SNVBAGLBSA-N	-1	3	332.378	1.289	20	5		EDBDHM
COc1cc(CNCCN2CCOC(C)(C)C2)c([N+](=O)[O-])cc1[O-]	ZINC000171766556	533875268	/nfs/dbraw/zinc/87/52/68/533875268.db2.gz	NQYZZTSRYSBKDR-UHFFFAOYSA-N	-1	3	339.392	1.509	20	5		EDBDHM
CC(=O)NCCC[N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl	ZINC000183468715	526745110	/nfs/dbraw/zinc/74/51/10/526745110.db2.gz	LFRDSPVZXVQWIN-UHFFFAOYSA-N	-1	3	349.796	1.361	20	5		EDBDHM
CN(C)CCn1cc(NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)ccc1=O	ZINC000339756899	535934134	/nfs/dbraw/zinc/93/41/34/535934134.db2.gz	CYMVFZLKQOKQFF-UHFFFAOYSA-N	-1	3	346.343	1.276	20	5		EDBDHM
COC(=O)CC(C)(C)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000741258858	579405696	/nfs/dbraw/zinc/40/56/96/579405696.db2.gz	ZGPYDOQODGBDDJ-UHFFFAOYSA-N	-1	3	330.362	1.523	20	5		EDBDHM
C[C@@H]1[C@@H](C)[S@@](=O)CCN1c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000736225936	578964990	/nfs/dbraw/zinc/96/49/90/578964990.db2.gz	UCLUJRLGPRJZBM-LVPZIMMTSA-N	-1	3	336.377	1.121	20	5		EDBDHM
C[C@@H]1[C@@H](C)[S@@](=O)CCN1c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000736225936	578964991	/nfs/dbraw/zinc/96/49/91/578964991.db2.gz	UCLUJRLGPRJZBM-LVPZIMMTSA-N	-1	3	336.377	1.121	20	5		EDBDHM
Cc1noc(CCCNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)n1	ZINC000737533820	579106138	/nfs/dbraw/zinc/10/61/38/579106138.db2.gz	FFXIVVXIGIGCKO-UHFFFAOYSA-N	-1	3	330.308	1.511	20	5		EDBDHM
Cc1noc(CCCNc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)n1	ZINC000737533820	579106139	/nfs/dbraw/zinc/10/61/39/579106139.db2.gz	FFXIVVXIGIGCKO-UHFFFAOYSA-N	-1	3	330.308	1.511	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](CCO)C1CC1	ZINC000751439989	579806796	/nfs/dbraw/zinc/80/67/96/579806796.db2.gz	CKSNFGLKMUPTND-LLVKDONJSA-N	-1	3	330.362	1.043	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H]2CCCN(C)C2)cc1[N+](=O)[O-]	ZINC000752235428	579842689	/nfs/dbraw/zinc/84/26/89/579842689.db2.gz	MFSFTTRUGYGXRB-SNVBAGLBSA-N	-1	3	347.824	1.929	20	5		EDBDHM
O=C([N-]CC(F)F)c1c2c(cc([N+](=O)[O-])c1[N+](=O)[O-])OCCO2	ZINC000752338807	579846188	/nfs/dbraw/zinc/84/61/88/579846188.db2.gz	RPNLXWNAUIIAJB-UHFFFAOYSA-N	-1	3	333.203	1.269	20	5		EDBDHM
CCOc1ccc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])cc1	ZINC000759167747	580000009	/nfs/dbraw/zinc/00/00/09/580000009.db2.gz	CREBBKWLZGYSKB-UHFFFAOYSA-N	-1	3	338.345	1.694	20	5		EDBDHM
CC[S@](=O)CC[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000765190300	580137072	/nfs/dbraw/zinc/13/70/72/580137072.db2.gz	BCXCUCIKENKICY-FQEVSTJZSA-N	-1	3	334.419	1.259	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C(=O)OC(C)(C)C	ZINC000768837715	580221798	/nfs/dbraw/zinc/22/17/98/580221798.db2.gz	PXQMJXDUKMCKJN-ZETCQYMHSA-N	-1	3	336.391	1.665	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C(=O)OC(C)(C)C	ZINC000768837714	580221847	/nfs/dbraw/zinc/22/18/47/580221847.db2.gz	PXQMJXDUKMCKJN-SSDOTTSWSA-N	-1	3	336.391	1.665	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@H](C)CC(N)=O)c1	ZINC000779902438	580502122	/nfs/dbraw/zinc/50/21/22/580502122.db2.gz	RDWKLPXOEWPUPE-ZETCQYMHSA-N	-1	3	335.769	1.099	20	5		EDBDHM
COC(=O)CC(C)(C)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000790854448	580780076	/nfs/dbraw/zinc/78/00/76/580780076.db2.gz	VAWPLEBWDGHDAB-UHFFFAOYSA-N	-1	3	344.389	1.832	20	5		EDBDHM
COc1c([O-])ccc(CN2CCO[C@H](COC(C)C)C2)c1[N+](=O)[O-]	ZINC000893666981	591039907	/nfs/dbraw/zinc/03/99/07/591039907.db2.gz	ZQVRBUHKAFNLET-ZDUSSCGKSA-N	-1	3	340.376	1.935	20	5		EDBDHM
CN(C)c1ncc(CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])n1C	ZINC000736779342	593036886	/nfs/dbraw/zinc/03/68/86/593036886.db2.gz	MVEQJHJZZAAKSQ-UHFFFAOYSA-N	-1	3	343.351	1.187	20	5		EDBDHM
CN(C)c1ncc(CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])n1C	ZINC000736779342	593036888	/nfs/dbraw/zinc/03/68/88/593036888.db2.gz	MVEQJHJZZAAKSQ-UHFFFAOYSA-N	-1	3	343.351	1.187	20	5		EDBDHM
O=C(OCc1cc2n(n1)CCC2)c1[n-]nc2ccc([N+](=O)[O-])cc21	ZINC000817480484	593607380	/nfs/dbraw/zinc/60/73/80/593607380.db2.gz	QOLSSWFZJGASQE-UHFFFAOYSA-N	-1	3	327.300	1.971	20	5		EDBDHM
O=C(OCc1cc2n(n1)CCC2)c1n[n-]c2ccc([N+](=O)[O-])cc21	ZINC000817480484	593607381	/nfs/dbraw/zinc/60/73/81/593607381.db2.gz	QOLSSWFZJGASQE-UHFFFAOYSA-N	-1	3	327.300	1.971	20	5		EDBDHM
C[C@@H]1CC[C@@H](OC(=O)C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000815244186	593621983	/nfs/dbraw/zinc/62/19/83/593621983.db2.gz	VANIIUJOMGSYIJ-GHMZBOCLSA-N	-1	3	342.373	1.605	20	5		EDBDHM
C[C@@H](Cc1ccncc1)Nc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820308500	593808568	/nfs/dbraw/zinc/80/85/68/593808568.db2.gz	VWTTUDWSWYXXRP-VIFPVBQESA-N	-1	3	326.320	1.608	20	5		EDBDHM
C[C@@H](Cc1ccncc1)Nc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820308500	593808569	/nfs/dbraw/zinc/80/85/69/593808569.db2.gz	VWTTUDWSWYXXRP-VIFPVBQESA-N	-1	3	326.320	1.608	20	5		EDBDHM
O=c1c([N+](=O)[O-])cc(Cl)cn1Cc1ccccc1-c1nnn[n-]1	ZINC000823658020	593827753	/nfs/dbraw/zinc/82/77/53/593827753.db2.gz	YNUVOAUTLDZWBA-UHFFFAOYSA-N	-1	3	332.707	1.638	20	5		EDBDHM
O=c1c([N+](=O)[O-])cc(Cl)cn1Cc1ccccc1-c1nn[n-]n1	ZINC000823658020	593827755	/nfs/dbraw/zinc/82/77/55/593827755.db2.gz	YNUVOAUTLDZWBA-UHFFFAOYSA-N	-1	3	332.707	1.638	20	5		EDBDHM
CC[C@H](CCO)Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820901687	593918459	/nfs/dbraw/zinc/91/84/59/593918459.db2.gz	DKWGQRMUEIRJJD-SECBINFHSA-N	-1	3	343.347	1.896	20	5		EDBDHM
CC[C@H](CCO)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820901687	593918461	/nfs/dbraw/zinc/91/84/61/593918461.db2.gz	DKWGQRMUEIRJJD-SECBINFHSA-N	-1	3	343.347	1.896	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(Cc2ccc(F)cc2-c2nnn[n-]2)c1=O	ZINC000822212894	594010884	/nfs/dbraw/zinc/01/08/84/594010884.db2.gz	LUSGWXPQMVVLSK-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(Cc2ccc(F)cc2-c2nn[n-]n2)c1=O	ZINC000822212894	594010885	/nfs/dbraw/zinc/01/08/85/594010885.db2.gz	LUSGWXPQMVVLSK-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
O=C(NCCCNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)C1CCC1	ZINC000823192651	594167434	/nfs/dbraw/zinc/16/74/34/594167434.db2.gz	YCMIOWHMOOAQEK-UHFFFAOYSA-N	-1	3	345.363	1.493	20	5		EDBDHM
O=C(NCCCNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)C1CCC1	ZINC000823192651	594167436	/nfs/dbraw/zinc/16/74/36/594167436.db2.gz	YCMIOWHMOOAQEK-UHFFFAOYSA-N	-1	3	345.363	1.493	20	5		EDBDHM
O=[N+]([O-])c1cnccc1NCCOc1ccc(-c2nnn[n-]2)cc1	ZINC000823652013	594224843	/nfs/dbraw/zinc/22/48/43/594224843.db2.gz	VWSWBNQHRUFDFR-UHFFFAOYSA-N	-1	3	327.304	1.083	20	5		EDBDHM
O=[N+]([O-])c1cnccc1NCCOc1ccc(-c2nn[n-]n2)cc1	ZINC000823652013	594224844	/nfs/dbraw/zinc/22/48/44/594224844.db2.gz	VWSWBNQHRUFDFR-UHFFFAOYSA-N	-1	3	327.304	1.083	20	5		EDBDHM
COCC1(C)CCN(c2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000826152506	594349404	/nfs/dbraw/zinc/34/94/04/594349404.db2.gz	BQAPFJCLMHKFGP-UHFFFAOYSA-N	-1	3	333.352	1.423	20	5		EDBDHM
COCC1(C)CCN(c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000826152506	594349407	/nfs/dbraw/zinc/34/94/07/594349407.db2.gz	BQAPFJCLMHKFGP-UHFFFAOYSA-N	-1	3	333.352	1.423	20	5		EDBDHM
COc1ccc(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cc1[N+](=O)[O-]	ZINC000826209553	594380373	/nfs/dbraw/zinc/38/03/73/594380373.db2.gz	HOGRJPKWSUKNEN-UHFFFAOYSA-N	-1	3	329.276	1.364	20	5		EDBDHM
COc1ccc(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cc1[N+](=O)[O-]	ZINC000826209553	594380375	/nfs/dbraw/zinc/38/03/75/594380375.db2.gz	HOGRJPKWSUKNEN-UHFFFAOYSA-N	-1	3	329.276	1.364	20	5		EDBDHM
O=C(Nc1cc(-c2nnn[n-]2)cc([N+](=O)[O-])c1Cl)[C@H]1CCOC1	ZINC000826451134	594481552	/nfs/dbraw/zinc/48/15/52/594481552.db2.gz	RFJZPJJETYUKTB-LURJTMIESA-N	-1	3	338.711	1.403	20	5		EDBDHM
O=C(Nc1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl)[C@H]1CCOC1	ZINC000826451134	594481553	/nfs/dbraw/zinc/48/15/53/594481553.db2.gz	RFJZPJJETYUKTB-LURJTMIESA-N	-1	3	338.711	1.403	20	5		EDBDHM
O=C(Nc1cccc([N+](=O)[O-])c1)[C@H](O)c1ccc(-c2nnn[n-]2)cc1	ZINC000826456952	594483385	/nfs/dbraw/zinc/48/33/85/594483385.db2.gz	GEDCCKIHTOXBDZ-CYBMUJFWSA-N	-1	3	340.299	1.447	20	5		EDBDHM
O=C(Nc1cccc([N+](=O)[O-])c1)[C@H](O)c1ccc(-c2nn[n-]n2)cc1	ZINC000826456952	594483387	/nfs/dbraw/zinc/48/33/87/594483387.db2.gz	GEDCCKIHTOXBDZ-CYBMUJFWSA-N	-1	3	340.299	1.447	20	5		EDBDHM
O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000826469837	594489308	/nfs/dbraw/zinc/48/93/08/594489308.db2.gz	TWYMTFQVMPNMHN-UHFFFAOYSA-N	-1	3	325.288	1.306	20	5		EDBDHM
O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000826469837	594489309	/nfs/dbraw/zinc/48/93/09/594489309.db2.gz	TWYMTFQVMPNMHN-UHFFFAOYSA-N	-1	3	325.288	1.306	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC(CCCO)CC2)c(-c2nnn[n-]2)c1	ZINC000826498458	594502992	/nfs/dbraw/zinc/50/29/92/594502992.db2.gz	VRYFTWMCZCOEPU-UHFFFAOYSA-N	-1	3	332.364	1.764	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC(CCCO)CC2)c(-c2nn[n-]n2)c1	ZINC000826498458	594502993	/nfs/dbraw/zinc/50/29/93/594502993.db2.gz	VRYFTWMCZCOEPU-UHFFFAOYSA-N	-1	3	332.364	1.764	20	5		EDBDHM
O=[N+]([O-])c1cccc([C@@H](O)COc2cccc(-c3nnn[n-]3)c2)c1	ZINC000826499622	594503212	/nfs/dbraw/zinc/50/32/12/594503212.db2.gz	QCKVWFCAYZKYJY-AWEZNQCLSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1cccc([C@@H](O)COc2cccc(-c3nn[n-]n3)c2)c1	ZINC000826499622	594503214	/nfs/dbraw/zinc/50/32/14/594503214.db2.gz	QCKVWFCAYZKYJY-AWEZNQCLSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCc3cccc(F)c3C2)c(-c2nnn[n-]2)c1	ZINC000826500662	594503732	/nfs/dbraw/zinc/50/37/32/594503732.db2.gz	HHMCKDDXKUYLNL-UHFFFAOYSA-N	-1	3	341.306	1.872	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCc3cccc(F)c3C2)c(-c2nn[n-]n2)c1	ZINC000826500662	594503734	/nfs/dbraw/zinc/50/37/34/594503734.db2.gz	HHMCKDDXKUYLNL-UHFFFAOYSA-N	-1	3	341.306	1.872	20	5		EDBDHM
O=c1ccc([N+](=O)[O-])cn1CCSc1ccccc1-c1nnn[n-]1	ZINC000826501836	594504326	/nfs/dbraw/zinc/50/43/26/594504326.db2.gz	JCGNNPZVJGRCQV-UHFFFAOYSA-N	-1	3	344.356	1.729	20	5		EDBDHM
O=c1ccc([N+](=O)[O-])cn1CCSc1ccccc1-c1nn[n-]n1	ZINC000826501836	594504328	/nfs/dbraw/zinc/50/43/28/594504328.db2.gz	JCGNNPZVJGRCQV-UHFFFAOYSA-N	-1	3	344.356	1.729	20	5		EDBDHM
CNC(=O)C[C@H](C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl	ZINC000832483598	594753627	/nfs/dbraw/zinc/75/36/27/594753627.db2.gz	KMLSPLWLWCENCA-QMMMGPOBSA-N	-1	3	349.796	1.360	20	5		EDBDHM
O=C([O-])NC[C@@H]1CCCN1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000834220566	595059836	/nfs/dbraw/zinc/05/98/36/595059836.db2.gz	LYZWWSFTWHIYGT-NWDGAFQWSA-N	-1	3	339.348	1.067	20	5		EDBDHM
C[C@H](Cn1cccn1)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848580312	595407742	/nfs/dbraw/zinc/40/77/42/595407742.db2.gz	MLVASPGJBYEQBU-SNVBAGLBSA-N	-1	3	340.286	1.968	20	5		EDBDHM
Cn1ccc(CC[N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)n1	ZINC000848588065	595410797	/nfs/dbraw/zinc/41/07/97/595410797.db2.gz	OBJZGQDGESTVGS-UHFFFAOYSA-N	-1	3	340.286	1.659	20	5		EDBDHM
CNc1nccc(C(=O)O[C@@H](C)C(=O)[N-]c2cc(C)no2)c1[N+](=O)[O-]	ZINC000848790107	595448607	/nfs/dbraw/zinc/44/86/07/595448607.db2.gz	NECVPVUBYVMFKK-QMMMGPOBSA-N	-1	3	349.303	1.512	20	5		EDBDHM
CNc1nccc(C(=O)NCc2nnc(C(F)(F)F)[n-]2)c1[N+](=O)[O-]	ZINC000847767483	595481218	/nfs/dbraw/zinc/48/12/18/595481218.db2.gz	VMWHBIFUBFWLIM-UHFFFAOYSA-N	-1	3	345.241	1.098	20	5		EDBDHM
CNc1nccc(C(=O)NCc2n[n-]c(C(F)(F)F)n2)c1[N+](=O)[O-]	ZINC000847767483	595481219	/nfs/dbraw/zinc/48/12/19/595481219.db2.gz	VMWHBIFUBFWLIM-UHFFFAOYSA-N	-1	3	345.241	1.098	20	5		EDBDHM
CNc1nccc(C(=O)NCc2nc(C(F)(F)F)n[n-]2)c1[N+](=O)[O-]	ZINC000847767483	595481222	/nfs/dbraw/zinc/48/12/22/595481222.db2.gz	VMWHBIFUBFWLIM-UHFFFAOYSA-N	-1	3	345.241	1.098	20	5		EDBDHM
O=[N+]([O-])c1c(F)cccc1S(=O)(=O)[N-][C@H]1CCN(CC2CC2)C1	ZINC000108403657	595497578	/nfs/dbraw/zinc/49/75/78/595497578.db2.gz	QEPQQHLSPKTSKD-NSHDSACASA-N	-1	3	343.380	1.497	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@]12OCCC[C@H]1C2(F)F	ZINC000849458141	595536313	/nfs/dbraw/zinc/53/63/13/595536313.db2.gz	CNDNBCZQJSXKRA-NEPJUHHUSA-N	-1	3	348.327	1.687	20	5		EDBDHM
O=c1[n-]ccc(N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1[N+](=O)[O-]	ZINC000853455474	595755390	/nfs/dbraw/zinc/75/53/90/595755390.db2.gz	BEFBMBYTOMKLAL-SECBINFHSA-N	-1	3	346.303	1.689	20	5		EDBDHM
O=c1[n-]ccc(N2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1[N+](=O)[O-]	ZINC000853544994	595794509	/nfs/dbraw/zinc/79/45/09/595794509.db2.gz	NTZZKUKCOLORRN-UHFFFAOYSA-N	-1	3	334.292	1.642	20	5		EDBDHM
CCn1ncc(C[N-]S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)n1	ZINC000859251950	596017509	/nfs/dbraw/zinc/01/75/09/596017509.db2.gz	KMIZKEQTBXIMPR-UHFFFAOYSA-N	-1	3	343.340	1.132	20	5		EDBDHM
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)[N-]N2CCOC2=O)CC1	ZINC000862694971	596389199	/nfs/dbraw/zinc/38/91/99/596389199.db2.gz	CAPLOTVYCMXPNF-UHFFFAOYSA-N	-1	3	348.359	1.928	20	5		EDBDHM
NC(=O)C1([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CCCCC1	ZINC000119656509	596701472	/nfs/dbraw/zinc/70/14/72/596701472.db2.gz	YPNYQWCJKGQECA-UHFFFAOYSA-N	-1	3	333.391	1.123	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@H](O)c2ccccc2F)cs1	ZINC000119810595	596743611	/nfs/dbraw/zinc/74/36/11/596743611.db2.gz	BTVYJZCMFNRGHS-NSHDSACASA-N	-1	3	346.361	1.807	20	5		EDBDHM
O=[N+]([O-])c1ccc(OCCNc2ccc(-c3nnn[n-]3)cn2)cc1	ZINC000738366732	598594742	/nfs/dbraw/zinc/59/47/42/598594742.db2.gz	IZSOCMGFVXUQNX-UHFFFAOYSA-N	-1	3	327.304	1.661	20	5		EDBDHM
O=[N+]([O-])c1ccc(OCCNc2ccc(-c3nn[n-]n3)cn2)cc1	ZINC000738366732	598594743	/nfs/dbraw/zinc/59/47/43/598594743.db2.gz	IZSOCMGFVXUQNX-UHFFFAOYSA-N	-1	3	327.304	1.661	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N(CCO)Cc1cccnc1	ZINC000738357904	599322919	/nfs/dbraw/zinc/32/29/19/599322919.db2.gz	IQIXSNZIZOTIOV-UHFFFAOYSA-N	-1	3	341.331	1.169	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N(CCO)Cc1cccnc1	ZINC000738357904	599322922	/nfs/dbraw/zinc/32/29/22/599322922.db2.gz	IQIXSNZIZOTIOV-UHFFFAOYSA-N	-1	3	341.331	1.169	20	5		EDBDHM
CCC(CC)(CO)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000269874828	534992456	/nfs/dbraw/zinc/99/24/56/534992456.db2.gz	OVIMVWRRAIKWGK-UHFFFAOYSA-N	-1	3	346.405	1.680	20	5		EDBDHM
O=C(NC[C@@H]1NCCc2ccccc21)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000375963703	303798866	/nfs/dbraw/zinc/79/88/66/303798866.db2.gz	KVMZNMOPWNAFFS-AWEZNQCLSA-N	-1	3	327.340	1.917	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H](C)c2cnn(C)c2)cc1[N+](=O)[O-]	ZINC000124543431	138327604	/nfs/dbraw/zinc/32/76/04/138327604.db2.gz	KFRQFNXVHABJAL-ZETCQYMHSA-N	-1	3	330.391	1.738	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C1CC1	ZINC000152386066	292839603	/nfs/dbraw/zinc/83/96/03/292839603.db2.gz	JFHQCUWTPPSYMD-GFCCVEGCSA-N	-1	3	328.390	1.915	20	5		EDBDHM
COC(=O)[C@@H]([N-]S(=O)(=O)CCc1ccccc1[N+](=O)[O-])C1CC1	ZINC000271044278	291265255	/nfs/dbraw/zinc/26/52/55/291265255.db2.gz	HUHPNLXOSUFHTK-ZDUSSCGKSA-N	-1	3	342.373	1.008	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CCC[C@@]2(C)CO)c([N+](=O)[O-])c1	ZINC000132720472	223357596	/nfs/dbraw/zinc/35/75/96/223357596.db2.gz	NPMKJTPDALNVDO-KBPBESRZSA-N	-1	3	328.390	1.733	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2CC[C@H](C)O2)c([N+](=O)[O-])c1	ZINC000416536596	251074472	/nfs/dbraw/zinc/07/44/72/251074472.db2.gz	QGBXVLHIAYUSPS-ONGXEEELSA-N	-1	3	330.362	1.449	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H](C)c2ccon2)cc1[N+](=O)[O-]	ZINC000493471826	255210577	/nfs/dbraw/zinc/21/05/77/255210577.db2.gz	GFINFTCSSAJCIQ-SSDOTTSWSA-N	-1	3	345.308	1.770	20	5		EDBDHM
CC[C@@H]1OCC[C@H]1[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000416559270	304331504	/nfs/dbraw/zinc/33/15/04/304331504.db2.gz	NXYFJJYCURLPEU-PWSUYJOCSA-N	-1	3	330.362	1.449	20	5		EDBDHM
Cc1nc([N-]C(=O)c2ccc(S(C)(=O)=O)o2)ccc1[N+](=O)[O-]	ZINC000355263498	150190731	/nfs/dbraw/zinc/19/07/31/150190731.db2.gz	SMTRQJAHQQDJBW-UHFFFAOYSA-N	-1	3	325.302	1.547	20	5		EDBDHM
CCc1nn(C)cc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000357420931	151027455	/nfs/dbraw/zinc/02/74/55/151027455.db2.gz	XSARXXMVSPTWAW-UHFFFAOYSA-N	-1	3	330.391	1.431	20	5		EDBDHM
Cc1nncn1CC[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000360514784	152076840	/nfs/dbraw/zinc/07/68/40/152076840.db2.gz	KGZDYRWHGMWOPD-UHFFFAOYSA-N	-1	3	339.377	1.090	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C2(C3CC3)CCOCC2)c(F)c1	ZINC000364043199	153131213	/nfs/dbraw/zinc/13/12/13/153131213.db2.gz	RHCWYQRLGHJOLE-UHFFFAOYSA-N	-1	3	344.364	1.971	20	5		EDBDHM
O=C([N-]CCCN1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1)C(F)(F)F	ZINC000364336231	153208789	/nfs/dbraw/zinc/20/87/89/153208789.db2.gz	KFCXZNDNJSAZJH-JTQLQIEISA-N	-1	3	349.313	1.497	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CNCC[N-]S(=O)(=O)c1cccs1	ZINC000122263828	222048680	/nfs/dbraw/zinc/04/86/80/222048680.db2.gz	LUZTWQIKXBFDIR-UHFFFAOYSA-N	-1	3	341.414	1.724	20	5		EDBDHM
CC(C)c1nc([C@H](C)[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)n[nH]1	ZINC000273925506	268094859	/nfs/dbraw/zinc/09/48/59/268094859.db2.gz	JZBOHCQZNJOCAJ-VIFPVBQESA-N	-1	3	339.377	1.876	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC2(C)OCCO2)c1[N+](=O)[O-]	ZINC000276768943	268472590	/nfs/dbraw/zinc/47/25/90/268472590.db2.gz	GWEPFRNPTQRZNM-UHFFFAOYSA-N	-1	3	330.362	1.253	20	5		EDBDHM
CN(C)CCn1cc(NC(=O)c2ccc([N+](=O)[O-])cc2[O-])ccc1=O	ZINC000275067243	273099497	/nfs/dbraw/zinc/09/94/97/273099497.db2.gz	OLNLHRWRVMKXCG-UHFFFAOYSA-N	-1	3	346.343	1.276	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCC2(O)CCC2)c([N+](=O)[O-])c1	ZINC000283792185	273965056	/nfs/dbraw/zinc/96/50/56/273965056.db2.gz	AGLMJERQMGVCBI-UHFFFAOYSA-N	-1	3	330.362	1.187	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@]2(C)CCOC2=O)cc1[N+](=O)[O-]	ZINC000289578259	288735118	/nfs/dbraw/zinc/73/51/18/288735118.db2.gz	OVYKCEZJCSLGQU-GFCCVEGCSA-N	-1	3	348.764	1.541	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000269733345	295200618	/nfs/dbraw/zinc/20/06/18/295200618.db2.gz	RTXOWQGVUNTNPU-JQWIXIFHSA-N	-1	3	330.362	1.185	20	5		EDBDHM
CC[C@@H](O)CCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000398497918	303857078	/nfs/dbraw/zinc/85/70/78/303857078.db2.gz	KMHLVSXDMXZALV-LLVKDONJSA-N	-1	3	332.378	1.433	20	5		EDBDHM
CC(C)N1CCC[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000435442221	305140432	/nfs/dbraw/zinc/14/04/32/305140432.db2.gz	HHBNBADQZGZQRL-JTQLQIEISA-N	-1	3	333.435	1.807	20	5		EDBDHM
COc1ncccc1C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C	ZINC000028041493	441423319	/nfs/dbraw/zinc/42/33/19/441423319.db2.gz	FPNFQMRSXSOLLC-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
O=C(NCCNC(=O)c1ccc([O-])cc1)c1csc([N+](=O)[O-])c1	ZINC000053742747	441539458	/nfs/dbraw/zinc/53/94/58/441539458.db2.gz	QTAMGHMEYILRKA-UHFFFAOYSA-N	-1	3	335.341	1.522	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2ncoc2C)c([N+](=O)[O-])c1	ZINC000090446782	441629466	/nfs/dbraw/zinc/62/94/66/441629466.db2.gz	UHQSBGPJOLPJLP-UHFFFAOYSA-N	-1	3	327.318	1.378	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@@H]2CCC[C@@H](O)C2)cc1[N+](=O)[O-]	ZINC000124535973	441934744	/nfs/dbraw/zinc/93/47/44/441934744.db2.gz	SNWGZIMSSRIRCB-NXEZZACHSA-N	-1	3	334.419	1.794	20	5		EDBDHM
CC(=O)N1CC[C@@H]([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000126719611	442137742	/nfs/dbraw/zinc/13/77/42/442137742.db2.gz	VUIPPOLPEBBXHR-SNVBAGLBSA-N	-1	3	347.780	1.147	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]c2ccc(=O)n(C)c2)c1C	ZINC000152319109	442197464	/nfs/dbraw/zinc/19/74/64/442197464.db2.gz	VVURSMYXEWJQDT-UHFFFAOYSA-N	-1	3	337.357	1.711	20	5		EDBDHM
CN(C)Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)cc1F	ZINC000155918041	442436227	/nfs/dbraw/zinc/43/62/27/442436227.db2.gz	TZVCTMQPEYWJLR-UHFFFAOYSA-N	-1	3	348.334	1.826	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@H]2C=C[C@H](CO)C2)c1	ZINC000180081740	442538684	/nfs/dbraw/zinc/53/86/84/442538684.db2.gz	VJTATMMMAXXPNL-VHSXEESVSA-N	-1	3	346.792	1.772	20	5		EDBDHM
C[C@@H](C[S@@](C)=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000183194278	442899488	/nfs/dbraw/zinc/89/94/88/442899488.db2.gz	XUXGHRLNHRQHLS-ZDVLTJLQSA-N	-1	3	340.810	1.294	20	5		EDBDHM
CCCN(C)S(=O)(=O)[N-]c1cc(C(=O)OC)cc([N+](=O)[O-])c1	ZINC000268801124	443112952	/nfs/dbraw/zinc/11/29/52/443112952.db2.gz	YRHLXZDJGYXQJM-UHFFFAOYSA-N	-1	3	331.350	1.380	20	5		EDBDHM
CN(C)CCN(CC(=O)[O-])C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-]	ZINC000237132774	443160403	/nfs/dbraw/zinc/16/04/03/443160403.db2.gz	NHHWGIYDTGGYHK-GQCTYLIASA-N	-1	3	339.323	1.222	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)OCC1CC1	ZINC000272466693	443328567	/nfs/dbraw/zinc/32/85/67/443328567.db2.gz	MIJNVUJAQMSSNA-UHFFFAOYSA-N	-1	3	342.373	1.010	20	5		EDBDHM
CCNC(=O)[C@H](C)[N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl	ZINC000272471992	443330865	/nfs/dbraw/zinc/33/08/65/443330865.db2.gz	NDHJGOXJNQTTNQ-QMMMGPOBSA-N	-1	3	349.796	1.360	20	5		EDBDHM
CC1(C(=O)NCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCC1	ZINC000267389299	443440078	/nfs/dbraw/zinc/44/00/78/443440078.db2.gz	MBODEMNOLRSPQK-UHFFFAOYSA-N	-1	3	341.389	1.180	20	5		EDBDHM
COC(=O)c1cc(N2CCc3nc[n-]c(=O)c3C2)cc(C)c1[N+](=O)[O-]	ZINC000269708079	443404713	/nfs/dbraw/zinc/40/47/13/443404713.db2.gz	MTWFPJNKGILBGV-UHFFFAOYSA-N	-1	3	344.327	1.748	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@H]1CC12CCOCC2	ZINC000431295290	319940042	/nfs/dbraw/zinc/94/00/42/319940042.db2.gz	PHLICZKYIJBLRQ-GFCCVEGCSA-N	-1	3	340.401	1.998	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](C)c2nncn2C)c1[N+](=O)[O-]	ZINC000276827253	443842303	/nfs/dbraw/zinc/84/23/03/443842303.db2.gz	OBHVTIGFVOORHA-JTQLQIEISA-N	-1	3	339.377	1.380	20	5		EDBDHM
NC(=O)CCCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000540471259	320760007	/nfs/dbraw/zinc/76/00/07/320760007.db2.gz	PGPLXNRDVYLFDG-UHFFFAOYSA-N	-1	3	335.769	1.182	20	5		EDBDHM
Cc1nc([C@@H](C)[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)n[nH]1	ZINC000285265036	443918097	/nfs/dbraw/zinc/91/80/97/443918097.db2.gz	DIURNBFMKYPHQZ-SSDOTTSWSA-N	-1	3	343.340	1.508	20	5		EDBDHM
C[C@@](CO)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1)c1ccccc1	ZINC000611020356	450409544	/nfs/dbraw/zinc/40/95/44/450409544.db2.gz	YPLBNAFSGWWSCJ-ZDUSSCGKSA-N	-1	3	342.398	1.842	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)n[nH]1	ZINC000297030458	444268935	/nfs/dbraw/zinc/26/89/35/444268935.db2.gz	LBBDJQBHSSPDKZ-UHFFFAOYSA-N	-1	3	325.350	1.062	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCCC[C@@H]2CO)c(F)c1	ZINC000318925765	444321935	/nfs/dbraw/zinc/32/19/35/444321935.db2.gz	ORHDQTPGDKOHPG-BXKDBHETSA-N	-1	3	332.353	1.563	20	5		EDBDHM
CC[C@@H](O)[C@H](CC)[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000313102896	444295581	/nfs/dbraw/zinc/29/55/81/444295581.db2.gz	GMLYQXNPSXHHLX-CMPLNLGQSA-N	-1	3	332.378	1.431	20	5		EDBDHM
Cn1ccc2c(NC(=O)c3cc([N+](=O)[O-])cnc3[O-])cccc2c1=O	ZINC000337698033	444359736	/nfs/dbraw/zinc/35/97/36/444359736.db2.gz	UWOGUQIWDXKKFK-UHFFFAOYSA-N	-1	3	340.295	1.800	20	5		EDBDHM
Cn1ccc2c(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)cccc2c1=O	ZINC000337698033	444359740	/nfs/dbraw/zinc/35/97/40/444359740.db2.gz	UWOGUQIWDXKKFK-UHFFFAOYSA-N	-1	3	340.295	1.800	20	5		EDBDHM
COC(=O)c1cc([N-]C(=O)c2cn(C(C)C)nn2)cc([N+](=O)[O-])c1	ZINC000340511941	444420171	/nfs/dbraw/zinc/42/01/71/444420171.db2.gz	PTTPMAFODIRBKN-UHFFFAOYSA-N	-1	3	333.304	1.806	20	5		EDBDHM
CN(C)CC(=O)Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])[n-]2)cc1	ZINC000340816300	444522597	/nfs/dbraw/zinc/52/25/97/444522597.db2.gz	FKIDXWQMCBHTMM-UHFFFAOYSA-N	-1	3	331.332	1.675	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1CCCS1	ZINC000340890501	444561209	/nfs/dbraw/zinc/56/12/09/444561209.db2.gz	VEZOHTBHLRLMEF-JTQLQIEISA-N	-1	3	332.403	1.777	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]c2cccn(C)c2=O)cc1[N+](=O)[O-]	ZINC000342354233	444649994	/nfs/dbraw/zinc/64/99/94/444649994.db2.gz	FKOCLCHWEDURNG-UHFFFAOYSA-N	-1	3	329.359	1.464	20	5		EDBDHM
CO[C@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C1CC1	ZINC000339058043	445012595	/nfs/dbraw/zinc/01/25/95/445012595.db2.gz	ZKFGDHKPOLDLBL-LLVKDONJSA-N	-1	3	334.781	1.952	20	5		EDBDHM
Cc1cc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)nn1[C@@H](C)C1CC1	ZINC000345975459	445202967	/nfs/dbraw/zinc/20/29/67/445202967.db2.gz	GYHOIYLIFZRFKS-VIFPVBQESA-N	-1	3	331.332	2.424	20	5		EDBDHM
CCCc1[nH]nc(C(=O)[N-]c2nnc3n(C)[nH]c(C)c2-3)c1[N+](=O)[O-]	ZINC000348394312	445275694	/nfs/dbraw/zinc/27/56/94/445275694.db2.gz	GKUUDUKIBBNGEF-UHFFFAOYSA-N	-1	3	332.324	1.441	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1ccc(F)cn1	ZINC000357182048	445471207	/nfs/dbraw/zinc/47/12/07/445471207.db2.gz	PYYHEXKTPFBXED-UHFFFAOYSA-N	-1	3	341.320	1.616	20	5		EDBDHM
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H]1OC	ZINC000358912217	445844756	/nfs/dbraw/zinc/84/47/56/445844756.db2.gz	YPCYCVSACXWTIH-MJBXVCDLSA-N	-1	3	344.389	1.207	20	5		EDBDHM
CN1CCC[C@H](N2CCN(C(=O)c3ccc([N+](=O)[O-])c([O-])c3)CC2)C1	ZINC000369345099	446088224	/nfs/dbraw/zinc/08/82/24/446088224.db2.gz	SROWURNTOKESDX-AWEZNQCLSA-N	-1	3	348.403	1.152	20	5		EDBDHM
CN1Cc2cc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)ccc2NC1=O	ZINC000373570266	446265260	/nfs/dbraw/zinc/26/52/60/446265260.db2.gz	YQWBPYYGLOKYCB-UHFFFAOYSA-N	-1	3	343.299	1.925	20	5		EDBDHM
O=C(NC1CCN([C@@H]2CCOC2)CC1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000376827573	446741577	/nfs/dbraw/zinc/74/15/77/446741577.db2.gz	JGGVJNYIBHYOPB-CYBMUJFWSA-N	-1	3	335.360	1.284	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@](C)(O)C2CC2)c1C	ZINC000443260892	447019679	/nfs/dbraw/zinc/01/96/79/447019679.db2.gz	IUNQDAYPJUNFNH-AWEZNQCLSA-N	-1	3	328.390	1.651	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@]2(C)CCC(=O)N2)c1C	ZINC000416501212	447627376	/nfs/dbraw/zinc/62/73/76/447627376.db2.gz	KDFIUZHRNOFSLL-CQSZACIVSA-N	-1	3	341.389	1.159	20	5		EDBDHM
CCN1C[C@@H]([N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])CC1=O	ZINC000451860699	447765474	/nfs/dbraw/zinc/76/54/74/447765474.db2.gz	BPINZQDXDGRTQG-NSHDSACASA-N	-1	3	341.389	1.111	20	5		EDBDHM
CCN1C[C@H]([N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])CC1=O	ZINC000451870818	447769431	/nfs/dbraw/zinc/76/94/31/447769431.db2.gz	PYMOIWVSFHRHPG-LLVKDONJSA-N	-1	3	341.389	1.111	20	5		EDBDHM
CCO[C@@H]1COC[C@H]1[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000452036038	447806505	/nfs/dbraw/zinc/80/65/05/447806505.db2.gz	IIGFRKZYFFMHSM-DGCLKSJQSA-N	-1	3	344.389	1.294	20	5		EDBDHM
C[C@H](CCN1CCN(C)CC1)Nc1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000570164175	447957096	/nfs/dbraw/zinc/95/70/96/447957096.db2.gz	AZGLMZSQPKYPFS-GFCCVEGCSA-N	-1	3	336.392	1.731	20	5		EDBDHM
O=C(Cc1cncc([O-])c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000566923870	448587578	/nfs/dbraw/zinc/58/75/78/448587578.db2.gz	JWERXXOYUJPJMH-LBPRGKRZSA-N	-1	3	343.343	1.346	20	5		EDBDHM
Cc1cc(N2CCN(C[C@@H](C)O)C[C@H]2C)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000579235720	448749737	/nfs/dbraw/zinc/74/97/37/448749737.db2.gz	DDKRZHWRHQSSLS-VXGBXAGGSA-N	-1	3	337.376	1.493	20	5		EDBDHM
O=C(NCCNc1ccccc1[N+](=O)[O-])c1cc(=O)[n-]c(C2CC2)n1	ZINC000582198294	449036312	/nfs/dbraw/zinc/03/63/12/449036312.db2.gz	UVXBBBWPXKDKNF-UHFFFAOYSA-N	-1	3	343.343	1.810	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H](CO)CCF)c2ncccc12	ZINC000593655852	449133060	/nfs/dbraw/zinc/13/30/60/449133060.db2.gz	DFVKMLYQZLRMTB-SECBINFHSA-N	-1	3	343.336	1.142	20	5		EDBDHM
CC(C)O[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1(C)C	ZINC000593578437	449086634	/nfs/dbraw/zinc/08/66/34/449086634.db2.gz	SJDNTVOOCNLGNP-VXGBXAGGSA-N	-1	3	343.405	1.860	20	5		EDBDHM
CC1(C)[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)[C@@H]2CCO[C@H]21	ZINC000593550679	449342284	/nfs/dbraw/zinc/34/22/84/449342284.db2.gz	GSZCJRIPMGBDOD-MVWJERBFSA-N	-1	3	327.362	1.082	20	5		EDBDHM
CO[C@]1(C)C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1(C)C	ZINC000593554710	449345663	/nfs/dbraw/zinc/34/56/63/449345663.db2.gz	AVLXKVRXBMCAHZ-GXFFZTMASA-N	-1	3	329.378	1.472	20	5		EDBDHM
CCCC(O)(CCC)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593556310	449346519	/nfs/dbraw/zinc/34/65/19/449346519.db2.gz	GKTZENSKHXVOCO-UHFFFAOYSA-N	-1	3	331.394	1.599	20	5		EDBDHM
C[C@@H](COCC(F)(F)F)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593536956	449332050	/nfs/dbraw/zinc/33/20/50/449332050.db2.gz	YRGGYRXLEPOHQU-ZETCQYMHSA-N	-1	3	343.283	1.236	20	5		EDBDHM
C[C@@H](O)CCC[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594770757	449683669	/nfs/dbraw/zinc/68/36/69/449683669.db2.gz	OQBOYWBWWDQLNY-SNVBAGLBSA-N	-1	3	339.373	1.582	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCC2CC(OC)C2)c([N+](=O)[O-])c1	ZINC000594790973	449700823	/nfs/dbraw/zinc/70/08/23/449700823.db2.gz	ZWXKNXOWMCNSLU-UHFFFAOYSA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](CO)C2CCC2)c1[N+](=O)[O-]	ZINC000594807345	449720122	/nfs/dbraw/zinc/72/01/22/449720122.db2.gz	XRKQCHHCSGAFQM-GFCCVEGCSA-N	-1	3	328.390	1.651	20	5		EDBDHM
COC(=O)[C@@H]1CN(c2cc[n-]c(=O)c2[N+](=O)[O-])Cc2ccccc21	ZINC000599184157	449784445	/nfs/dbraw/zinc/78/44/45/449784445.db2.gz	IRXUEUAKMPVGQT-GFCCVEGCSA-N	-1	3	329.312	1.972	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@H](C)N2CCCC2)c(F)cc1[N+](=O)[O-]	ZINC000601305021	449815036	/nfs/dbraw/zinc/81/50/36/449815036.db2.gz	QUMATSIGULLBCW-LLVKDONJSA-N	-1	3	345.396	1.805	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2CN(C(C)C)C[C@H]2C)c([N+](=O)[O-])s1	ZINC000601359233	449872866	/nfs/dbraw/zinc/87/28/66/449872866.db2.gz	SCZRWBFQCIALJP-MWLCHTKSSA-N	-1	3	347.462	1.972	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1nccn1C	ZINC000595384591	450098832	/nfs/dbraw/zinc/09/88/32/450098832.db2.gz	YNYOPNYVSGNOOW-QMMMGPOBSA-N	-1	3	328.325	1.507	20	5		EDBDHM
O=C(c1c[n-]c(=O)c([N+](=O)[O-])c1)N1CCN(c2ccncc2)CC1	ZINC000618342092	450164242	/nfs/dbraw/zinc/16/42/42/450164242.db2.gz	UQYPQFSVNZPNOK-UHFFFAOYSA-N	-1	3	329.316	1.053	20	5		EDBDHM
CCOC(=O)c1nnc(CNC(=O)c2cccc(C)c2[N+](=O)[O-])[n-]1	ZINC000615920428	450273447	/nfs/dbraw/zinc/27/34/47/450273447.db2.gz	TWECFQMRGFJSEY-UHFFFAOYSA-N	-1	3	333.304	1.128	20	5		EDBDHM
CCN1CC[C@@H]([N-]c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1=O	ZINC000619794743	450336349	/nfs/dbraw/zinc/33/63/49/450336349.db2.gz	WXMLLLQNMOGEAT-SSDOTTSWSA-N	-1	3	333.391	1.093	20	5		EDBDHM
C[N-]S(=O)(=O)c1ccc(CNc2cccnc2[N+](=O)[O-])s1	ZINC000603844913	450358490	/nfs/dbraw/zinc/35/84/90/450358490.db2.gz	IXFOXFQUDOKGOT-UHFFFAOYSA-N	-1	3	328.375	1.572	20	5		EDBDHM
CCN1CCN(CCCNC(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC1	ZINC000063744668	535696135	/nfs/dbraw/zinc/69/61/35/535696135.db2.gz	ZLVGRMURYFXMKA-UHFFFAOYSA-N	-1	3	336.392	1.058	20	5		EDBDHM
NC(=O)C1CCC(Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000737737288	578324599	/nfs/dbraw/zinc/32/45/99/578324599.db2.gz	AWPLUAVRVWSHPK-UHFFFAOYSA-N	-1	3	331.336	1.231	20	5		EDBDHM
NC(=O)C1CCC(Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000737737288	578324600	/nfs/dbraw/zinc/32/46/00/578324600.db2.gz	AWPLUAVRVWSHPK-UHFFFAOYSA-N	-1	3	331.336	1.231	20	5		EDBDHM
COc1cc(-c2nnn[n-]2)ccc1OCCn1cnc([N+](=O)[O-])c1	ZINC000737032468	579041882	/nfs/dbraw/zinc/04/18/82/579041882.db2.gz	MQXVVQHNRDLFTD-UHFFFAOYSA-N	-1	3	331.292	1.059	20	5		EDBDHM
COc1cc(-c2nn[n-]n2)ccc1OCCn1cnc([N+](=O)[O-])c1	ZINC000737032468	579041883	/nfs/dbraw/zinc/04/18/83/579041883.db2.gz	MQXVVQHNRDLFTD-UHFFFAOYSA-N	-1	3	331.292	1.059	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H](CCO)C2CC2)cc1[N+](=O)[O-]	ZINC000777978411	580454107	/nfs/dbraw/zinc/45/41/07/580454107.db2.gz	FIEXKDQJUAWSDM-LLVKDONJSA-N	-1	3	348.352	1.182	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H](O)c1ccco1	ZINC000751205384	579797234	/nfs/dbraw/zinc/79/72/34/579797234.db2.gz	PCMNBTDYEMCCJB-SNVBAGLBSA-N	-1	3	342.329	1.208	20	5		EDBDHM
Cc1cccc(NCC[N-]S(=O)(=O)c2cccnc2[N+](=O)[O-])n1	ZINC000754320728	579901165	/nfs/dbraw/zinc/90/11/65/579901165.db2.gz	VXRHBMUFBSFSNQ-UHFFFAOYSA-N	-1	3	337.361	1.084	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]C[C@H](O)c1ccccn1	ZINC000759073121	579997945	/nfs/dbraw/zinc/99/79/45/579997945.db2.gz	XUJOONUDWQPPCU-AWEZNQCLSA-N	-1	3	337.357	1.143	20	5		EDBDHM
CCOC(=O)[C@H](C)[N-]S(=O)(=O)CCc1ccccc1[N+](=O)[O-]	ZINC000766782494	580173864	/nfs/dbraw/zinc/17/38/64/580173864.db2.gz	KRSNPRWNVISLMK-JTQLQIEISA-N	-1	3	330.362	1.008	20	5		EDBDHM
CC[S@](=O)CC[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000767775097	580198948	/nfs/dbraw/zinc/19/89/48/580198948.db2.gz	OZBAVLTZBGGCHQ-SFHVURJKSA-N	-1	3	326.421	1.012	20	5		EDBDHM
COC(=O)C1CCC([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000768834356	580221703	/nfs/dbraw/zinc/22/17/03/580221703.db2.gz	BQQXDHFKPGICRJ-UHFFFAOYSA-N	-1	3	348.402	1.666	20	5		EDBDHM
COCC(=O)Nc1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc1	ZINC000770178733	580255176	/nfs/dbraw/zinc/25/51/76/580255176.db2.gz	LGFBXFFBNUXGBB-UHFFFAOYSA-N	-1	3	346.299	1.533	20	5		EDBDHM
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@H]1OC	ZINC000772956636	580324153	/nfs/dbraw/zinc/32/41/53/580324153.db2.gz	CANBPGVYQSMBNB-FXPVBKGRSA-N	-1	3	336.391	1.127	20	5		EDBDHM
O=C([N-]N1CCCC1=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1	ZINC000780707114	580531944	/nfs/dbraw/zinc/53/19/44/580531944.db2.gz	OZPYKJDLTMOLJQ-UHFFFAOYSA-N	-1	3	332.360	1.852	20	5		EDBDHM
C[C@H](CN1CCCCC1)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000788918259	580732656	/nfs/dbraw/zinc/73/26/56/580732656.db2.gz	GFTNGVVTTQKZFI-SNVBAGLBSA-N	-1	3	333.435	1.809	20	5		EDBDHM
COc1c([O-])ccc(CN2CCC3(CCN(C)C3=O)CC2)c1[N+](=O)[O-]	ZINC000894066471	591181790	/nfs/dbraw/zinc/18/17/90/591181790.db2.gz	CMKICTMABQEXKZ-UHFFFAOYSA-N	-1	3	349.387	1.753	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCCOC[C@H]2CCOC2)c(-c2nnn[n-]2)c1	ZINC000738368940	598973601	/nfs/dbraw/zinc/97/36/01/598973601.db2.gz	FZLVYNIANBCWNZ-LLVKDONJSA-N	-1	3	348.363	1.630	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCCOC[C@H]2CCOC2)c(-c2nn[n-]n2)c1	ZINC000738368940	598973603	/nfs/dbraw/zinc/97/36/03/598973603.db2.gz	FZLVYNIANBCWNZ-LLVKDONJSA-N	-1	3	348.363	1.630	20	5		EDBDHM
O=C([N-]CCO[C@@H]1CCOC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000902980793	592092468	/nfs/dbraw/zinc/09/24/68/592092468.db2.gz	SOGDNAAIDLVURB-GFCCVEGCSA-N	-1	3	346.286	1.488	20	5		EDBDHM
C[C@@H]1CC2(CC([N-]S(=O)(=O)c3ccc([N+](=O)[O-])cc3F)C2)CO1	ZINC000907725222	592771844	/nfs/dbraw/zinc/77/18/44/592771844.db2.gz	YDSHATAMDKZRII-NAUIOFCNSA-N	-1	3	344.364	1.970	20	5		EDBDHM
O=C(COC(=O)c1cnn[n-]1)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000805606128	593112176	/nfs/dbraw/zinc/11/21/76/593112176.db2.gz	SPQOJWDUJYQANE-UHFFFAOYSA-N	-1	3	325.668	1.162	20	5		EDBDHM
O=C(COC(=O)c1c[n-]nn1)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000805606128	593112179	/nfs/dbraw/zinc/11/21/79/593112179.db2.gz	SPQOJWDUJYQANE-UHFFFAOYSA-N	-1	3	325.668	1.162	20	5		EDBDHM
O=[N+]([O-])c1ccn(-c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)n1	ZINC000738370170	599050750	/nfs/dbraw/zinc/05/07/50/599050750.db2.gz	RIUXOXDUQQNRBT-UHFFFAOYSA-N	-1	3	326.198	1.374	20	5		EDBDHM
O=[N+]([O-])c1ccn(-c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)n1	ZINC000738370170	599050753	/nfs/dbraw/zinc/05/07/53/599050753.db2.gz	RIUXOXDUQQNRBT-UHFFFAOYSA-N	-1	3	326.198	1.374	20	5		EDBDHM
CN(C)[C@H](CNc1nccc(-c2nnn[n-]2)c1[N+](=O)[O-])c1ccco1	ZINC000821581307	593867914	/nfs/dbraw/zinc/86/79/14/593867914.db2.gz	IGQUJJMIDULRCR-SNVBAGLBSA-N	-1	3	344.335	1.478	20	5		EDBDHM
CN(C)[C@H](CNc1nccc(-c2nn[n-]n2)c1[N+](=O)[O-])c1ccco1	ZINC000821581307	593867917	/nfs/dbraw/zinc/86/79/17/593867917.db2.gz	IGQUJJMIDULRCR-SNVBAGLBSA-N	-1	3	344.335	1.478	20	5		EDBDHM
Cn1cc(-c2nnn[n-]2)cc1C(=O)Oc1cc(F)cc([N+](=O)[O-])c1	ZINC000822664993	594081744	/nfs/dbraw/zinc/08/17/44/594081744.db2.gz	FIWNXUHBAKALBF-UHFFFAOYSA-N	-1	3	332.251	1.472	20	5		EDBDHM
Cn1cc(-c2nn[n-]n2)cc1C(=O)Oc1cc(F)cc([N+](=O)[O-])c1	ZINC000822664993	594081745	/nfs/dbraw/zinc/08/17/45/594081745.db2.gz	FIWNXUHBAKALBF-UHFFFAOYSA-N	-1	3	332.251	1.472	20	5		EDBDHM
C[C@H]1OCC[C@H]1Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000825019845	594117140	/nfs/dbraw/zinc/11/71/40/594117140.db2.gz	HJMMNTDDYWNZGS-PRHODGIISA-N	-1	3	341.331	1.912	20	5		EDBDHM
C[C@H]1OCC[C@H]1Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000825019845	594117141	/nfs/dbraw/zinc/11/71/41/594117141.db2.gz	HJMMNTDDYWNZGS-PRHODGIISA-N	-1	3	341.331	1.912	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(NCc3ccon3)cc(-c3nnn[n-]3)c2c1	ZINC000823643737	594224371	/nfs/dbraw/zinc/22/43/71/594224371.db2.gz	AGIULJRAJKZWHW-UHFFFAOYSA-N	-1	3	338.287	1.923	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(NCc3ccon3)cc(-c3nn[n-]n3)c2c1	ZINC000823643737	594224372	/nfs/dbraw/zinc/22/43/72/594224372.db2.gz	AGIULJRAJKZWHW-UHFFFAOYSA-N	-1	3	338.287	1.923	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCOc2ccccc2F)c(-c2nnn[n-]2)c1	ZINC000823650804	594224750	/nfs/dbraw/zinc/22/47/50/594224750.db2.gz	AZANJZJBCAMFAX-UHFFFAOYSA-N	-1	3	345.294	1.800	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCOc2ccccc2F)c(-c2nn[n-]n2)c1	ZINC000823650804	594224751	/nfs/dbraw/zinc/22/47/51/594224751.db2.gz	AZANJZJBCAMFAX-UHFFFAOYSA-N	-1	3	345.294	1.800	20	5		EDBDHM
C[C@H]1CN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C(=O)[O-]	ZINC000828462725	594427418	/nfs/dbraw/zinc/42/74/18/594427418.db2.gz	MGHBNOLDAUXJEO-GXFFZTMASA-N	-1	3	331.332	1.463	20	5		EDBDHM
Cc1nn(CN(C)Cc2ccc(-c3nnn[n-]3)cc2)cc1[N+](=O)[O-]	ZINC000826334717	594431167	/nfs/dbraw/zinc/43/11/67/594431167.db2.gz	GWCPKWIPEGBKJI-UHFFFAOYSA-N	-1	3	328.336	1.369	20	5		EDBDHM
Cc1nn(CN(C)Cc2ccc(-c3nn[n-]n3)cc2)cc1[N+](=O)[O-]	ZINC000826334717	594431168	/nfs/dbraw/zinc/43/11/68/594431168.db2.gz	GWCPKWIPEGBKJI-UHFFFAOYSA-N	-1	3	328.336	1.369	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NCc1noc(C2CC2)n1	ZINC000826497809	594502530	/nfs/dbraw/zinc/50/25/30/594502530.db2.gz	VOAPEFBVZGVWIN-UHFFFAOYSA-N	-1	3	328.292	1.647	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NCc1noc(C2CC2)n1	ZINC000826497809	594502532	/nfs/dbraw/zinc/50/25/32/594502532.db2.gz	VOAPEFBVZGVWIN-UHFFFAOYSA-N	-1	3	328.292	1.647	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CC[C@H]([C@H]2CCOC2)C1	ZINC000826497673	594502947	/nfs/dbraw/zinc/50/29/47/594502947.db2.gz	PMCLPLLXUOXUKP-RYUDHWBXSA-N	-1	3	330.348	1.638	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CC[C@H]([C@H]2CCOC2)C1	ZINC000826497673	594502949	/nfs/dbraw/zinc/50/29/49/594502949.db2.gz	PMCLPLLXUOXUKP-RYUDHWBXSA-N	-1	3	330.348	1.638	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@@H]2c2cccnc2)c(-c2nnn[n-]2)c1	ZINC000826501042	594503595	/nfs/dbraw/zinc/50/35/95/594503595.db2.gz	XDMNDMKGSLRIQZ-CYBMUJFWSA-N	-1	3	338.331	1.906	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@@H]2c2cccnc2)c(-c2nn[n-]n2)c1	ZINC000826501042	594503599	/nfs/dbraw/zinc/50/35/99/594503599.db2.gz	XDMNDMKGSLRIQZ-CYBMUJFWSA-N	-1	3	338.331	1.906	20	5		EDBDHM
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000829160249	594575713	/nfs/dbraw/zinc/57/57/13/594575713.db2.gz	GGZLWYKKMRFLHZ-KBPBESRZSA-N	-1	3	347.371	1.992	20	5		EDBDHM
CCN(CC1CCN(CCn2ccc([N+](=O)[O-])n2)CC1)C(=O)[O-]	ZINC000827098760	594640479	/nfs/dbraw/zinc/64/04/79/594640479.db2.gz	GMZITPJHVXDOEV-UHFFFAOYSA-N	-1	3	325.369	1.503	20	5		EDBDHM
O=C([O-])N1CCC[C@H]1[C@@H]1CCCN(CCn2cc([N+](=O)[O-])cn2)C1	ZINC000832007145	594718793	/nfs/dbraw/zinc/71/87/93/594718793.db2.gz	XXABJTSLCNKMHT-OCCSQVGLSA-N	-1	3	337.380	1.646	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C[C@@H](O)C2CCC2)cc1[N+](=O)[O-]	ZINC000832653632	594766924	/nfs/dbraw/zinc/76/69/24/594766924.db2.gz	BQZLEVFFDRVNBK-GFCCVEGCSA-N	-1	3	348.808	1.996	20	5		EDBDHM
CC(C)(O)CO[N-]C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000834624963	595177916	/nfs/dbraw/zinc/17/79/16/595177916.db2.gz	ROJIPJDIEBKODH-UHFFFAOYSA-N	-1	3	332.740	1.836	20	5		EDBDHM
O=C([O-])CCN(C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@H]1CCCO1	ZINC000846272936	595193850	/nfs/dbraw/zinc/19/38/50/595193850.db2.gz	QKBXWPMBUBMBGV-CABCVRRESA-N	-1	3	338.360	1.584	20	5		EDBDHM
O=C([N-][C@@H](CCO)C1CC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848584239	595409605	/nfs/dbraw/zinc/40/96/05/595409605.db2.gz	RPIYCFSLIULTFY-LBPRGKRZSA-N	-1	3	330.287	1.844	20	5		EDBDHM
CNc1nccc(C(=O)OCc2cc(=O)[n-]c(C3CC3)n2)c1[N+](=O)[O-]	ZINC000848791034	595448981	/nfs/dbraw/zinc/44/89/81/595448981.db2.gz	UABSRHLDLPQCSI-UHFFFAOYSA-N	-1	3	345.315	1.762	20	5		EDBDHM
Cn1[n-]c([C@H]2CCCN2c2nc3ccccn3c2[N+](=O)[O-])nc1=N	ZINC000853660113	595849165	/nfs/dbraw/zinc/84/91/65/595849165.db2.gz	TWDKITOWCXEFLY-SECBINFHSA-N	-1	3	328.336	1.125	20	5		EDBDHM
C/C(=C/C(=O)[N-]OCCN1CCCC1=O)c1ccc([N+](=O)[O-])cc1	ZINC000856043361	595884035	/nfs/dbraw/zinc/88/40/35/595884035.db2.gz	VIOYJZKVZVQRGD-QXMHVHEDSA-N	-1	3	333.344	1.668	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H]1CCCN(CCF)C1	ZINC000867708997	596506762	/nfs/dbraw/zinc/50/67/62/596506762.db2.gz	CXHIYBLZEDCGSX-NSHDSACASA-N	-1	3	331.369	1.307	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1C[C@H]1C1CCOCC1	ZINC000867884934	596601488	/nfs/dbraw/zinc/60/14/88/596601488.db2.gz	AHFBBRNVDSYOAY-NWDGAFQWSA-N	-1	3	326.374	1.688	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]Cc2ccccc2CO)cs1	ZINC000119813265	596743622	/nfs/dbraw/zinc/74/36/22/596743622.db2.gz	OKCGZFFORXBNFA-UHFFFAOYSA-N	-1	3	328.371	1.627	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCNc2ncccc2-c2nnn[n-]2)cn1	ZINC000738368409	599265742	/nfs/dbraw/zinc/26/57/42/599265742.db2.gz	DDYOVLLDNKILPB-UHFFFAOYSA-N	-1	3	327.308	1.089	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCNc2ncccc2-c2nn[n-]n2)cn1	ZINC000738368409	599265744	/nfs/dbraw/zinc/26/57/44/599265744.db2.gz	DDYOVLLDNKILPB-UHFFFAOYSA-N	-1	3	327.308	1.089	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](CCO)C(C)(C)C	ZINC000178564617	232261925	/nfs/dbraw/zinc/26/19/25/232261925.db2.gz	VSHHKCCMRWLCIQ-GFCCVEGCSA-N	-1	3	330.406	1.979	20	5		EDBDHM
O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1cc(=O)[n-]c(C2CC2)n1	ZINC000412982254	304048106	/nfs/dbraw/zinc/04/81/06/304048106.db2.gz	JUYOEPVDXFYATK-UHFFFAOYSA-N	-1	3	340.295	1.764	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCN1CCCCC1	ZINC000046034720	138113891	/nfs/dbraw/zinc/11/38/91/138113891.db2.gz	VXFMGOCHGIZLEZ-UHFFFAOYSA-N	-1	3	343.405	1.368	20	5		EDBDHM
O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(-c2nnn[n-]2)cc1	ZINC000104367004	138299803	/nfs/dbraw/zinc/29/98/03/138299803.db2.gz	LQJQIFMGVBTGLE-UHFFFAOYSA-N	-1	3	339.315	1.826	20	5		EDBDHM
O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(-c2nn[n-]n2)cc1	ZINC000104367004	138299804	/nfs/dbraw/zinc/29/98/04/138299804.db2.gz	LQJQIFMGVBTGLE-UHFFFAOYSA-N	-1	3	339.315	1.826	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@](C)(O)C(C)C)c1C	ZINC000178741054	138745349	/nfs/dbraw/zinc/74/53/49/138745349.db2.gz	BBOIOXRDMKTGGI-CQSZACIVSA-N	-1	3	330.406	1.897	20	5		EDBDHM
CS[C@H]1CN(c2nc(C)cc(C(=O)[O-])c2[N+](=O)[O-])C[C@H]1N(C)C	ZINC000565034942	306373587	/nfs/dbraw/zinc/37/35/87/306373587.db2.gz	IYBZXFXHOMTFHK-MNOVXSKESA-N	-1	3	340.405	1.478	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1[C@H]2CCO[C@H]2C12CCC2	ZINC000245533917	139078234	/nfs/dbraw/zinc/07/82/34/139078234.db2.gz	HRUSONYNQNQSGK-LERXQTSPSA-N	-1	3	338.385	1.831	20	5		EDBDHM
COC1([C@@H](C)[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCOCC1	ZINC000420767721	251756530	/nfs/dbraw/zinc/75/65/30/251756530.db2.gz	VJPBGCFHPNNGRS-LLVKDONJSA-N	-1	3	344.389	1.457	20	5		EDBDHM
C/C=C/C[C@@H](CO)[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	ZINC000493910138	255225967	/nfs/dbraw/zinc/22/59/67/255225967.db2.gz	YZNHNXJBTBMLMN-NWALNABHSA-N	-1	3	348.352	1.348	20	5		EDBDHM
C[C@@H](NC(=O)CNC(=O)c1cccc([O-])c1)c1cccc([N+](=O)[O-])c1	ZINC000495141044	255269986	/nfs/dbraw/zinc/26/99/86/255269986.db2.gz	PAYAIYLBJFEQRT-LLVKDONJSA-N	-1	3	343.339	1.908	20	5		EDBDHM
CC[C@H](C)[C@H](O)C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000269831759	140002683	/nfs/dbraw/zinc/00/26/83/140002683.db2.gz	XMNMSBYTXLQODU-TVQRCGJNSA-N	-1	3	330.406	1.897	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@H]1CCO[C@H](C)C1	ZINC000271238165	140261610	/nfs/dbraw/zinc/26/16/10/140261610.db2.gz	CQTFUNNWWPXLJR-NEPJUHHUSA-N	-1	3	328.390	1.997	20	5		EDBDHM
CN(C)CCOC1CCN(c2ccc([N+](=O)[O-])c(C(=O)[O-])c2)CC1	ZINC000572409119	306588164	/nfs/dbraw/zinc/58/81/64/306588164.db2.gz	ZMCQCKOTCMOIKF-UHFFFAOYSA-N	-1	3	337.376	1.840	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@H](CO)c1cccnc1	ZINC000344961932	143031528	/nfs/dbraw/zinc/03/15/28/143031528.db2.gz	XMNUYUBLMFNOOR-GFCCVEGCSA-N	-1	3	337.357	1.044	20	5		EDBDHM
COC(=O)[C@@H](CC1CC1)[N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000416582247	304333889	/nfs/dbraw/zinc/33/38/89/304333889.db2.gz	KHYJCWSAGSSFFC-CYBMUJFWSA-N	-1	3	342.373	1.356	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)[C@H](O)C(C)C	ZINC000416610568	304337738	/nfs/dbraw/zinc/33/77/38/304337738.db2.gz	BGCUKYVNHQDGQN-BXUZGUMPSA-N	-1	3	346.405	1.677	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[C@H](O)C(C)C	ZINC000416628927	304338361	/nfs/dbraw/zinc/33/83/61/304338361.db2.gz	SAAZEOLOLOZSDF-DGCLKSJQSA-N	-1	3	334.369	1.808	20	5		EDBDHM
CC[C@](C)([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000352868826	149196354	/nfs/dbraw/zinc/19/63/54/149196354.db2.gz	DZOZWKHXPULBEH-ZDUSSCGKSA-N	-1	3	330.362	1.356	20	5		EDBDHM
CC(C)COC[C@@H](O)C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000352930100	149219293	/nfs/dbraw/zinc/21/92/93/149219293.db2.gz	DAVRCEFQPKGYOD-ZDUSSCGKSA-N	-1	3	346.405	1.048	20	5		EDBDHM
CCO[C@@H]1COCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000352979666	149237917	/nfs/dbraw/zinc/23/79/17/149237917.db2.gz	FKXQUZAELURZCW-NWDGAFQWSA-N	-1	3	348.352	1.206	20	5		EDBDHM
CC[C@@H](C)[C@H](O)C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000189999447	286810567	/nfs/dbraw/zinc/81/05/67/286810567.db2.gz	STCIJYCFSGFTNI-BXKDBHETSA-N	-1	3	330.406	1.897	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCO[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000275360471	268329848	/nfs/dbraw/zinc/32/98/48/268329848.db2.gz	IPNQHFSRDRUFMP-RKDXNWHRSA-N	-1	3	348.352	1.588	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1)C1CC1	ZINC000275380452	268333568	/nfs/dbraw/zinc/33/35/68/268333568.db2.gz	MEGGQSSELVSXGN-LLVKDONJSA-N	-1	3	348.352	1.446	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CSC2(C)C)c([N+](=O)[O-])c1	ZINC000276333790	273160209	/nfs/dbraw/zinc/16/02/09/273160209.db2.gz	PJPSCFDEEBXLAU-NSHDSACASA-N	-1	3	332.403	1.776	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H](C)CSC)cc1[N+](=O)[O-]	ZINC000275078906	273099960	/nfs/dbraw/zinc/09/99/60/273099960.db2.gz	MVVZHIFREFDTAQ-ZETCQYMHSA-N	-1	3	338.382	1.772	20	5		EDBDHM
O=C(/C=C/c1cncc([O-])c1)NCCNc1ccccc1[N+](=O)[O-]	ZINC000179394440	272943871	/nfs/dbraw/zinc/94/38/71/272943871.db2.gz	NGFIFUROHBFWAY-AATRIKPKSA-N	-1	3	328.328	1.937	20	5		EDBDHM
Cc1nnc(CC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])s1	ZINC000290213105	288858802	/nfs/dbraw/zinc/85/88/02/288858802.db2.gz	NWHRIHKGCOGBJO-UHFFFAOYSA-N	-1	3	328.375	1.276	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H](C)CCCO)c([N+](=O)[O-])c1	ZINC000295464000	303223390	/nfs/dbraw/zinc/22/33/90/303223390.db2.gz	ZXFMWSAQCDFLMC-JTQLQIEISA-N	-1	3	332.378	1.290	20	5		EDBDHM
Cc1[nH]n(C)c2nnc([N-]C(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])c1-2	ZINC000433741091	305113181	/nfs/dbraw/zinc/11/31/81/305113181.db2.gz	GEEPOISLSABBGD-UHFFFAOYSA-N	-1	3	332.324	1.612	20	5		EDBDHM
CC[C@@H](CCO)[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	ZINC000491516566	305576498	/nfs/dbraw/zinc/57/64/98/305576498.db2.gz	XEFKMOCYCZKABT-QMMMGPOBSA-N	-1	3	336.341	1.182	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCC[C@H]1CCO	ZINC000494621199	305632296	/nfs/dbraw/zinc/63/22/96/305632296.db2.gz	NVZPIHNLHZTTDG-CMPLNLGQSA-N	-1	3	344.389	1.433	20	5		EDBDHM
Cc1nnc([C@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)o1	ZINC000532096241	305973667	/nfs/dbraw/zinc/97/36/67/305973667.db2.gz	VBISSTVOTLGULD-QMMMGPOBSA-N	-1	3	326.334	1.634	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000536510980	306021049	/nfs/dbraw/zinc/02/10/49/306021049.db2.gz	CBCZGQHPYLKAIV-SECBINFHSA-N	-1	3	329.316	1.318	20	5		EDBDHM
COC(=O)[C@](C)([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C1CC1	ZINC000545934397	306087895	/nfs/dbraw/zinc/08/78/95/306087895.db2.gz	CXKXGJBKZNCJNX-GFCCVEGCSA-N	-1	3	348.402	1.585	20	5		EDBDHM
Cc1noc(C)c1S(=O)(=O)[N-]CCNc1ccc([N+](=O)[O-])cc1	ZINC000007908966	441074501	/nfs/dbraw/zinc/07/45/01/441074501.db2.gz	GUJVBAWFNIJTPV-UHFFFAOYSA-N	-1	3	340.361	1.590	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCC(=O)OC(C)C	ZINC000052794116	441475900	/nfs/dbraw/zinc/47/59/00/441475900.db2.gz	YQAVEOZXZKEXEY-UHFFFAOYSA-N	-1	3	346.361	1.223	20	5		EDBDHM
CCN1CCN([C@H]2CCN(Cc3cc([O-])ccc3[N+](=O)[O-])C2)CC1	ZINC000093132661	441859742	/nfs/dbraw/zinc/85/97/42/441859742.db2.gz	DRNDFEVZRVZEHF-HNNXBMFYSA-N	-1	3	334.420	1.512	20	5		EDBDHM
C[C@@H](CCO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000120356275	442055587	/nfs/dbraw/zinc/05/55/87/442055587.db2.gz	JMJRMQSQVYMIEZ-ZETCQYMHSA-N	-1	3	342.295	1.663	20	5		EDBDHM
CN(C)CCN(Cc1ccccn1)C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000125920471	442061812	/nfs/dbraw/zinc/06/18/12/442061812.db2.gz	WOQKUTBJQWPCJK-UHFFFAOYSA-N	-1	3	344.371	1.899	20	5		EDBDHM
CCN1CCN([C@@H](C)CNC(=O)c2ccc([N+](=O)[O-])cc2[O-])CC1	ZINC000186234293	442492463	/nfs/dbraw/zinc/49/24/63/442492463.db2.gz	IMWSGIQHKBBVEL-LBPRGKRZSA-N	-1	3	336.392	1.056	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C(C)(C)CC(N)=O)cc1[N+](=O)[O-]	ZINC000186712302	442597784	/nfs/dbraw/zinc/59/77/84/442597784.db2.gz	XSJQQNCSZTZOAI-UHFFFAOYSA-N	-1	3	349.796	1.489	20	5		EDBDHM
CCN1CCC[C@@H]1C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000158009688	442636854	/nfs/dbraw/zinc/63/68/54/442636854.db2.gz	RBLBYBBVYXLUMY-GFCCVEGCSA-N	-1	3	327.406	1.666	20	5		EDBDHM
CN(C)CCN(Cc1ccccc1)C(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000188310554	442736922	/nfs/dbraw/zinc/73/69/22/442736922.db2.gz	QZACBRRGMXWVEE-UHFFFAOYSA-N	-1	3	344.371	1.899	20	5		EDBDHM
CCC[C@@H](O)C[N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl	ZINC000182537188	442782878	/nfs/dbraw/zinc/78/28/78/442782878.db2.gz	WKXIVWDMMXHYJE-SECBINFHSA-N	-1	3	336.797	1.996	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC[C@@H](C)CCO	ZINC000296067916	318661937	/nfs/dbraw/zinc/66/19/37/318661937.db2.gz	DHJIHXJRDVWPSB-SNVBAGLBSA-N	-1	3	332.378	1.290	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCC[S@](C)=O)c1[N+](=O)[O-]	ZINC000189976092	443041643	/nfs/dbraw/zinc/04/16/43/443041643.db2.gz	BFIUGMBGTCTVJS-FQEVSTJZSA-N	-1	3	334.419	1.259	20	5		EDBDHM
CCOC(=O)[C@@H](C)C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000268831293	443120844	/nfs/dbraw/zinc/12/08/44/443120844.db2.gz	WBJXNXFXYCWTJY-JTQLQIEISA-N	-1	3	330.362	1.381	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]C2(C)CCOCC2)cc1[N+](=O)[O-]	ZINC000185425548	443197585	/nfs/dbraw/zinc/19/75/85/443197585.db2.gz	KRWKYFYMZWBAMZ-UHFFFAOYSA-N	-1	3	332.353	1.890	20	5		EDBDHM
CCc1n[nH]c([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)n1	ZINC000414455770	319327300	/nfs/dbraw/zinc/32/73/00/319327300.db2.gz	SVFZTVLZSIULSB-UHFFFAOYSA-N	-1	3	325.350	1.693	20	5		EDBDHM
CON1CCC([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000420750115	319645122	/nfs/dbraw/zinc/64/51/22/319645122.db2.gz	NFDQKTULRHFCAF-UHFFFAOYSA-N	-1	3	349.796	1.552	20	5		EDBDHM
CCOc1cc(CN2CCC[C@]3(C2)NC(=O)[N-]C3=O)ccc1[N+](=O)[O-]	ZINC000279103225	443514710	/nfs/dbraw/zinc/51/47/10/443514710.db2.gz	REVCZMNOEAZVNX-MRXNPFEDSA-N	-1	3	348.359	1.168	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCOCC(F)F)c([N+](=O)[O-])c1	ZINC000276184544	443664431	/nfs/dbraw/zinc/66/44/31/443664431.db2.gz	FZXUQVLLIHCKPE-UHFFFAOYSA-N	-1	3	340.304	1.163	20	5		EDBDHM
C[C@H]1CC[C@@H]([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000444213794	320120750	/nfs/dbraw/zinc/12/07/50/320120750.db2.gz	CWEGZYBZPJOXLP-VHSXEESVSA-N	-1	3	342.373	1.833	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC(=O)OCC2CC2)c1[N+](=O)[O-]	ZINC000276842612	443848649	/nfs/dbraw/zinc/84/86/49/443848649.db2.gz	PZTOHTDMVJLQEK-UHFFFAOYSA-N	-1	3	342.373	1.443	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C(C)C)C(C)(C)O)c([N+](=O)[O-])c1	ZINC000277055668	443898310	/nfs/dbraw/zinc/89/83/10/443898310.db2.gz	OEQHZYLMHZMRIW-ZDUSSCGKSA-N	-1	3	346.405	1.677	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C2CCN(C)CC2)cc1C	ZINC000299078206	443947914	/nfs/dbraw/zinc/94/79/14/443947914.db2.gz	QDLXAYYTAJOVBP-UHFFFAOYSA-N	-1	3	327.406	1.584	20	5		EDBDHM
CCCNC(=O)C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000298996649	443923623	/nfs/dbraw/zinc/92/36/23/443923623.db2.gz	AZAKQTUTUATORT-UHFFFAOYSA-N	-1	3	329.378	1.016	20	5		EDBDHM
COc1cc(C(=O)N2CCc3c(=O)[n-]cnc3C2)c([N+](=O)[O-])cc1F	ZINC000564099980	321120616	/nfs/dbraw/zinc/12/06/16/321120616.db2.gz	RISRHRIRMAQVRU-UHFFFAOYSA-N	-1	3	348.290	1.437	20	5		EDBDHM
Cc1cc(N2C[C@@H](C)N(CCO)C[C@H]2C)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000571566342	321392714	/nfs/dbraw/zinc/39/27/14/321392714.db2.gz	QTGSWEUTSSSYLR-VXGBXAGGSA-N	-1	3	337.376	1.493	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CC[C@H](C)C1	ZINC000323183351	444342201	/nfs/dbraw/zinc/34/22/01/444342201.db2.gz	PWORQBZDWDWDAP-VHSXEESVSA-N	-1	3	342.373	1.848	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@](C)(O)C1CC1	ZINC000320229869	444328660	/nfs/dbraw/zinc/32/86/60/444328660.db2.gz	VZIPTBLDLWQXBH-ZDUSSCGKSA-N	-1	3	330.362	1.043	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCC[C@]1(C)CO	ZINC000331152039	444419998	/nfs/dbraw/zinc/41/99/98/444419998.db2.gz	BZQDPHLKOUZHTN-UONOGXRCSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COc1ccc([N-]C(=O)c2ccnc3c2nnn3C)c([N+](=O)[O-])c1	ZINC000337778999	444402125	/nfs/dbraw/zinc/40/21/25/444402125.db2.gz	ZUESVQBVHXVOMA-UHFFFAOYSA-N	-1	3	328.288	1.532	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H](C)N2CCCC2)c1[N+](=O)[O-]	ZINC000579423807	321931305	/nfs/dbraw/zinc/93/13/05/321931305.db2.gz	IYGKXGANBMWLQJ-CYBMUJFWSA-N	-1	3	341.433	1.974	20	5		EDBDHM
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1cnc(C)[n-]c1=O	ZINC000343980566	444707377	/nfs/dbraw/zinc/70/73/77/444707377.db2.gz	MWPHHYXSOMRFSB-UHFFFAOYSA-N	-1	3	338.345	1.186	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CN(C3CC3)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000342511903	444723887	/nfs/dbraw/zinc/72/38/87/444723887.db2.gz	JPHWRGOWORUUEH-KCJUWKMLSA-N	-1	3	345.446	1.726	20	5		EDBDHM
CCc1nc([C@H](C)[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)n[nH]1	ZINC000342577708	444752758	/nfs/dbraw/zinc/75/27/58/444752758.db2.gz	XRNQXIXMLWJPRK-LURJTMIESA-N	-1	3	345.406	1.685	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CC(=O)OC(C)(C)C)cc1[N+](=O)[O-]	ZINC000343519427	445237704	/nfs/dbraw/zinc/23/77/04/445237704.db2.gz	ZTPHZMORXCOAOQ-UHFFFAOYSA-N	-1	3	336.391	1.585	20	5		EDBDHM
O=C(Nc1ccn(CC(F)F)n1)c1n[n-]c2ccc([N+](=O)[O-])cc21	ZINC000354486688	445258866	/nfs/dbraw/zinc/25/88/66/445258866.db2.gz	MVDDGJFDTAHHOC-UHFFFAOYSA-N	-1	3	336.258	2.185	20	5		EDBDHM
CC[C@](C)([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(=O)OC	ZINC000354631853	445321958	/nfs/dbraw/zinc/32/19/58/445321958.db2.gz	ZUISHMWIVZDITF-AWEZNQCLSA-N	-1	3	344.389	1.832	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC(=O)OC(C)(C)C)c1[N+](=O)[O-]	ZINC000360234603	445646319	/nfs/dbraw/zinc/64/63/19/445646319.db2.gz	OOIRIXIPLNXDQX-UHFFFAOYSA-N	-1	3	344.389	1.832	20	5		EDBDHM
CCn1c(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)nc2cccnc21	ZINC000349878292	445708949	/nfs/dbraw/zinc/70/89/49/445708949.db2.gz	OITBRLJLUZFNKH-UHFFFAOYSA-N	-1	3	328.288	1.712	20	5		EDBDHM
CN1CCC[C@H](N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3[O-])CC2)C1	ZINC000370365225	446247454	/nfs/dbraw/zinc/24/74/54/446247454.db2.gz	DTWNKEFWCBLXOC-AWEZNQCLSA-N	-1	3	348.403	1.152	20	5		EDBDHM
O=C(Nc1ccn(-c2ncccc2F)n1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000366872525	446392131	/nfs/dbraw/zinc/39/21/31/446392131.db2.gz	BOLIMJOUUKIWTP-UHFFFAOYSA-N	-1	3	344.262	1.668	20	5		EDBDHM
CN(C)C[C@@H](O)COc1ccc(NC(=O)c2ccc([N+](=O)[O-])[n-]2)cc1	ZINC000426898176	447514169	/nfs/dbraw/zinc/51/41/69/447514169.db2.gz	SRMLNGPCQRCPPI-GFCCVEGCSA-N	-1	3	348.359	1.477	20	5		EDBDHM
COc1ccc(Cn2ccc([N-]c3c([N+](=O)[O-])ncn3C)n2)cc1	ZINC000489907411	447879525	/nfs/dbraw/zinc/87/95/25/447879525.db2.gz	DJNVWKHMSMAHLE-UHFFFAOYSA-N	-1	3	328.332	2.325	20	5		EDBDHM
CNc1nccc(C(=O)[N-]c2nc3c(s2)C(=O)CCC3)c1[N+](=O)[O-]	ZINC000553418229	447992200	/nfs/dbraw/zinc/99/22/00/447992200.db2.gz	NOQONYRWBHMXAG-UHFFFAOYSA-N	-1	3	347.356	2.259	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1C[C@@H](OC(C)C)C1	ZINC000591329580	448324914	/nfs/dbraw/zinc/32/49/14/448324914.db2.gz	DCMACURSOVIUSD-PHIMTYICSA-N	-1	3	344.389	1.838	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC)[C@H](O)C(C)C	ZINC000591332328	448327229	/nfs/dbraw/zinc/32/72/29/448327229.db2.gz	DUJCFUXDIYBLJW-ZWNOBZJWSA-N	-1	3	346.405	1.677	20	5		EDBDHM
CC[C@@H](C)C[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000592066127	448656869	/nfs/dbraw/zinc/65/68/69/448656869.db2.gz	DGVWKERZAPVSSX-MNOVXSKESA-N	-1	3	344.389	1.851	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](CO)C1CCCC1	ZINC000589305436	449005279	/nfs/dbraw/zinc/00/52/79/449005279.db2.gz	IYTDEYQGCKOYLT-NSHDSACASA-N	-1	3	344.389	1.433	20	5		EDBDHM
CN1CCC2(CC1)CN(C(=O)c1cc([O-])cc([N+](=O)[O-])c1)CCO2	ZINC000592898299	449042478	/nfs/dbraw/zinc/04/24/78/449042478.db2.gz	FEIDROYVALXWJE-UHFFFAOYSA-N	-1	3	335.360	1.237	20	5		EDBDHM
C[C@H](CN1CCC[C@@H](C)C1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593583154	449089512	/nfs/dbraw/zinc/08/95/12/449089512.db2.gz	ZLPZJXRJFDJNFM-VXGBXAGGSA-N	-1	3	342.421	1.389	20	5		EDBDHM
Cn1c([N-]C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)nnc1C1CC1	ZINC000597897146	449137187	/nfs/dbraw/zinc/13/71/87/449137187.db2.gz	KDBSJAYZFDCHBD-UHFFFAOYSA-N	-1	3	345.315	1.624	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](CO)CC1CC1	ZINC000611109696	449171776	/nfs/dbraw/zinc/17/17/76/449171776.db2.gz	BDDTVWQCEXAVRB-JTQLQIEISA-N	-1	3	330.362	1.043	20	5		EDBDHM
Cc1cc(Cc2noc([C@@H]3CCS(=O)(=O)[N-]3)n2)ccc1[N+](=O)[O-]	ZINC000593294248	449211317	/nfs/dbraw/zinc/21/13/17/449211317.db2.gz	HJJDURMFSSOWLO-JTQLQIEISA-N	-1	3	338.345	1.241	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1CCOC1(C)C	ZINC000590759307	449277964	/nfs/dbraw/zinc/27/79/64/449277964.db2.gz	KZACHCIPSXJHPL-NSHDSACASA-N	-1	3	330.362	1.449	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCc1ccc(CO)cc1	ZINC000611417067	449285419	/nfs/dbraw/zinc/28/54/19/449285419.db2.gz	KAOMXEUDQHMXGF-UHFFFAOYSA-N	-1	3	336.369	1.608	20	5		EDBDHM
O=c1[n-]ccc(N2CCN(c3cc(C4CC4)[nH]n3)CC2)c1[N+](=O)[O-]	ZINC000596200216	449410424	/nfs/dbraw/zinc/41/04/24/449410424.db2.gz	IHHYFPUIOVIMKN-UHFFFAOYSA-N	-1	3	330.348	1.623	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1CC(C)C1	ZINC000598624054	449501433	/nfs/dbraw/zinc/50/14/33/449501433.db2.gz	WJAMPFYCXDFQTK-UHFFFAOYSA-N	-1	3	342.373	1.706	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CO)C2CCC2)c1C	ZINC000594800422	449712173	/nfs/dbraw/zinc/71/21/73/449712173.db2.gz	FQGSOIRJKJEYKC-LBPRGKRZSA-N	-1	3	328.390	1.651	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2C[C@H](O)C23CCC3)c1C	ZINC000594865371	449778938	/nfs/dbraw/zinc/77/89/38/449778938.db2.gz	RMEDXMMPPPHOHX-STQMWFEESA-N	-1	3	340.401	1.793	20	5		EDBDHM
CCN1CCC[C@H]([N-]S(=O)(=O)c2cc(C)sc2[N+](=O)[O-])C1	ZINC000601314100	449823220	/nfs/dbraw/zinc/82/32/20/449823220.db2.gz	YRZKOTBXRMOJDE-JTQLQIEISA-N	-1	3	333.435	1.727	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](O)[C@@H]2CCCO2)c1C	ZINC000599392285	449939498	/nfs/dbraw/zinc/93/94/98/449939498.db2.gz	PWJXWZBNQLCHAH-STQMWFEESA-N	-1	3	344.389	1.030	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1[C@@H](C)[C@H](C)O[C@H]1C	ZINC000599459992	449993746	/nfs/dbraw/zinc/99/37/46/449993746.db2.gz	PDFACLCMONMMSM-QSDJMHMYSA-N	-1	3	344.389	1.694	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)c([N+](=O)[O-])c1	ZINC000599460508	449994891	/nfs/dbraw/zinc/99/48/91/449994891.db2.gz	XZXKLQJSDYFXTJ-YCWTYVPXSA-N	-1	3	344.389	1.694	20	5		EDBDHM
CCCN1CC[C@@H]([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C1	ZINC000595353655	450067080	/nfs/dbraw/zinc/06/70/80/450067080.db2.gz	JEIUWRVTMIJZMN-SNVBAGLBSA-N	-1	3	333.435	1.727	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCOC[C@H]2CCCO2)c(F)c1	ZINC000609675291	450083746	/nfs/dbraw/zinc/08/37/46/450083746.db2.gz	ILAZRAIGBZXBPQ-LLVKDONJSA-N	-1	3	348.352	1.208	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CCOC1(C)C	ZINC000595393303	450106713	/nfs/dbraw/zinc/10/67/13/450106713.db2.gz	UQZUQGCJTTZYPP-JTQLQIEISA-N	-1	3	344.389	1.697	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)c2ccc([N+](=O)[O-])cc2OC)[n-]1	ZINC000619446391	450475844	/nfs/dbraw/zinc/47/58/44/450475844.db2.gz	IFFFWGUFUTUHPA-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)c2ccc([N+](=O)[O-])cc2OC)c[n-]1	ZINC000619446391	450475846	/nfs/dbraw/zinc/47/58/46/450475846.db2.gz	IFFFWGUFUTUHPA-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
CCC(=O)N1CC[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000133212891	528379153	/nfs/dbraw/zinc/37/91/53/528379153.db2.gz	ATZAIZABGZPCLY-VIFPVBQESA-N	-1	3	345.352	1.023	20	5		EDBDHM
CCc1nc([C@H](C)[N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)n[nH]1	ZINC000270604094	536153869	/nfs/dbraw/zinc/15/38/69/536153869.db2.gz	WNKQYNOPRRXJJV-VIFPVBQESA-N	-1	3	339.377	1.623	20	5		EDBDHM
CC(C)(C)[S@@](=O)CCNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000735643735	578907642	/nfs/dbraw/zinc/90/76/42/578907642.db2.gz	RJOUGAOBGRTJBR-QHCPKHFHSA-N	-1	3	338.393	1.734	20	5		EDBDHM
CC(C)(C)[S@@](=O)CCNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000735643735	578907644	/nfs/dbraw/zinc/90/76/44/578907644.db2.gz	RJOUGAOBGRTJBR-QHCPKHFHSA-N	-1	3	338.393	1.734	20	5		EDBDHM
COC(=O)C1CCC(Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000736907643	579030639	/nfs/dbraw/zinc/03/06/39/579030639.db2.gz	CKYOUVVUCHPPBK-UHFFFAOYSA-N	-1	3	346.347	1.919	20	5		EDBDHM
COC(=O)C1CCC(Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000736907643	579030640	/nfs/dbraw/zinc/03/06/40/579030640.db2.gz	CKYOUVVUCHPPBK-UHFFFAOYSA-N	-1	3	346.347	1.919	20	5		EDBDHM
COc1ccc2c(c1)CCN2c1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000737119047	579049332	/nfs/dbraw/zinc/04/93/32/579049332.db2.gz	LHMFGKQEINJTQM-UHFFFAOYSA-N	-1	3	339.315	1.873	20	5		EDBDHM
COc1ccc2c(c1)CCN2c1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000737119047	579049333	/nfs/dbraw/zinc/04/93/33/579049333.db2.gz	LHMFGKQEINJTQM-UHFFFAOYSA-N	-1	3	339.315	1.873	20	5		EDBDHM
O=C(c1cccc(-c2nnn[n-]2)c1)N1CCc2c1cccc2[N+](=O)[O-]	ZINC000738269674	579180090	/nfs/dbraw/zinc/18/00/90/579180090.db2.gz	PWWVVQXDAZJAIP-UHFFFAOYSA-N	-1	3	336.311	1.978	20	5		EDBDHM
O=C(c1cccc(-c2nn[n-]n2)c1)N1CCc2c1cccc2[N+](=O)[O-]	ZINC000738269674	579180092	/nfs/dbraw/zinc/18/00/92/579180092.db2.gz	PWWVVQXDAZJAIP-UHFFFAOYSA-N	-1	3	336.311	1.978	20	5		EDBDHM
CN1CCN(CCCNc2ccc(/C=C\C(=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000746994130	579621945	/nfs/dbraw/zinc/62/19/45/579621945.db2.gz	BFHWDUJMXBJYAL-XQRVVYSFSA-N	-1	3	348.403	1.742	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1n[n-]c(-c2cccs2)n1	ZINC000748837277	579703263	/nfs/dbraw/zinc/70/32/63/579703263.db2.gz	IALMAPMXFAKRNL-UHFFFAOYSA-N	-1	3	347.360	1.975	20	5		EDBDHM
COC(=O)Cc1n[n-]c(NC(=O)C(C)=Cc2ccc([N+](=O)[O-])cc2)n1	ZINC000755353400	579925825	/nfs/dbraw/zinc/92/58/25/579925825.db2.gz	GQDKMWNRRBEKCV-VQHVLOKHSA-N	-1	3	345.315	1.470	20	5		EDBDHM
COC(=O)Cc1nnc(NC(=O)C(C)=Cc2ccc([N+](=O)[O-])cc2)[n-]1	ZINC000755353400	579925826	/nfs/dbraw/zinc/92/58/26/579925826.db2.gz	GQDKMWNRRBEKCV-VQHVLOKHSA-N	-1	3	345.315	1.470	20	5		EDBDHM
COC(=O)Cc1nc(NC(=O)C(C)=Cc2ccc([N+](=O)[O-])cc2)n[n-]1	ZINC000755353400	579925827	/nfs/dbraw/zinc/92/58/27/579925827.db2.gz	GQDKMWNRRBEKCV-VQHVLOKHSA-N	-1	3	345.315	1.470	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2ccc(OC)c([N+](=O)[O-])c2)n1	ZINC000756746164	579956448	/nfs/dbraw/zinc/95/64/48/579956448.db2.gz	FDSUBPQLPHOENP-UHFFFAOYSA-N	-1	3	335.276	1.980	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CCCC1	ZINC000768806705	580220748	/nfs/dbraw/zinc/22/07/48/580220748.db2.gz	VUZILRKLYQKUJL-UHFFFAOYSA-N	-1	3	334.375	1.420	20	5		EDBDHM
COC(=O)[C@](C)([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C1CC1	ZINC000768831899	580221637	/nfs/dbraw/zinc/22/16/37/580221637.db2.gz	MFVDDBMLLXGNRF-LLVKDONJSA-N	-1	3	334.375	1.276	20	5		EDBDHM
CC(C)[C@H](O)C1(C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000768889071	580223604	/nfs/dbraw/zinc/22/36/04/580223604.db2.gz	RJFJRXPQZPRFMK-NSHDSACASA-N	-1	3	334.419	1.732	20	5		EDBDHM
O=C(NC1CCN(C[C@H]2CCCO2)CC1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000779665030	580494079	/nfs/dbraw/zinc/49/40/79/580494079.db2.gz	PBWSSTVWFFFVPM-CQSZACIVSA-N	-1	3	349.387	1.674	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCN2CCC[C@H]2C)c1C	ZINC000780868256	580536157	/nfs/dbraw/zinc/53/61/57/580536157.db2.gz	RSARVJGQUBLOEI-GFCCVEGCSA-N	-1	3	341.433	1.974	20	5		EDBDHM
COc1c([O-])ccc(CN(C)CCN2CCOCC2)c1[N+](=O)[O-]	ZINC000891905633	590680842	/nfs/dbraw/zinc/68/08/42/590680842.db2.gz	CHYKEYSBGZYGRE-UHFFFAOYSA-N	-1	3	325.365	1.073	20	5		EDBDHM
COc1c([O-])ccc(CN2CC(C)(C)O[C@@H]3COC[C@H]32)c1[N+](=O)[O-]	ZINC000895188663	591648434	/nfs/dbraw/zinc/64/84/34/591648434.db2.gz	LIDKJFBDXMZWED-DGCLKSJQSA-N	-1	3	338.360	1.687	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1[N-]Cc1nnc(C)o1	ZINC000840245771	593489704	/nfs/dbraw/zinc/48/97/04/593489704.db2.gz	TUTNWEMXIPLUES-UHFFFAOYSA-N	-1	3	337.248	1.593	20	5		EDBDHM
CN(C(=O)c1cc(-c2nnn[n-]2)cn1C)c1ccc([N+](=O)[O-])cc1	ZINC000821573586	593866096	/nfs/dbraw/zinc/86/60/96/593866096.db2.gz	WMIJJAOOSZEWFT-UHFFFAOYSA-N	-1	3	327.304	1.390	20	5		EDBDHM
CN(C(=O)c1cc(-c2nn[n-]n2)cn1C)c1ccc([N+](=O)[O-])cc1	ZINC000821573586	593866098	/nfs/dbraw/zinc/86/60/98/593866098.db2.gz	WMIJJAOOSZEWFT-UHFFFAOYSA-N	-1	3	327.304	1.390	20	5		EDBDHM
CCOC(=O)[C@@H]1CCCN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000821337579	594021464	/nfs/dbraw/zinc/02/14/64/594021464.db2.gz	LSEVZXRDPHOEPR-LLVKDONJSA-N	-1	3	346.347	1.554	20	5		EDBDHM
CCOC(=O)[C@@H]1CCCN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1	ZINC000821337579	594021466	/nfs/dbraw/zinc/02/14/66/594021466.db2.gz	LSEVZXRDPHOEPR-LLVKDONJSA-N	-1	3	346.347	1.554	20	5		EDBDHM
Cc1nc(NC(=O)c2cccc(-c3nnn[n-]3)c2)ccc1[N+](=O)[O-]	ZINC000822454137	594051269	/nfs/dbraw/zinc/05/12/69/594051269.db2.gz	ULPLQZNQEQWANN-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cc1nc(NC(=O)c2cccc(-c3nn[n-]n3)c2)ccc1[N+](=O)[O-]	ZINC000822454137	594051271	/nfs/dbraw/zinc/05/12/71/594051271.db2.gz	ULPLQZNQEQWANN-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
NC(=O)[C@H]1CCCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000822860081	594112693	/nfs/dbraw/zinc/11/26/93/594112693.db2.gz	MWFRMCQMPXAZLJ-ONGXEEELSA-N	-1	3	331.336	1.231	20	5		EDBDHM
NC(=O)[C@H]1CCCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000822860081	594112694	/nfs/dbraw/zinc/11/26/94/594112694.db2.gz	MWFRMCQMPXAZLJ-ONGXEEELSA-N	-1	3	331.336	1.231	20	5		EDBDHM
O=[N+]([O-])c1ccc(C=Cc2cnc3ccc(-c4nnn[n-]4)cn23)nc1	ZINC000823635007	594223447	/nfs/dbraw/zinc/22/34/47/594223447.db2.gz	PKJHDKLDDRSERJ-RQOWECAXSA-N	-1	3	334.299	1.988	20	5		EDBDHM
O=[N+]([O-])c1ccc(C=Cc2cnc3ccc(-c4nn[n-]n4)cn23)nc1	ZINC000823635007	594223448	/nfs/dbraw/zinc/22/34/48/594223448.db2.gz	PKJHDKLDDRSERJ-RQOWECAXSA-N	-1	3	334.299	1.988	20	5		EDBDHM
CCN1C[C@H](Nc2c(C(=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000829752864	594255211	/nfs/dbraw/zinc/25/52/11/594255211.db2.gz	LLFDTLWHZILGLV-KWQFWETISA-N	-1	3	338.320	1.953	20	5		EDBDHM
COc1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1-c1nnn[n-]1	ZINC000826208404	594379179	/nfs/dbraw/zinc/37/91/79/594379179.db2.gz	IQQGIMBFLFYYHX-UHFFFAOYSA-N	-1	3	329.320	1.645	20	5		EDBDHM
COc1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1-c1nn[n-]n1	ZINC000826208404	594379180	/nfs/dbraw/zinc/37/91/80/594379180.db2.gz	IQQGIMBFLFYYHX-UHFFFAOYSA-N	-1	3	329.320	1.645	20	5		EDBDHM
O=C1C[C@H](CNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CN1C1CC1	ZINC000826478843	594493659	/nfs/dbraw/zinc/49/36/59/594493659.db2.gz	KJYUMMSAMGFOKG-SECBINFHSA-N	-1	3	343.347	1.198	20	5		EDBDHM
O=C1C[C@H](CNc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CN1C1CC1	ZINC000826478843	594493661	/nfs/dbraw/zinc/49/36/61/594493661.db2.gz	KJYUMMSAMGFOKG-SECBINFHSA-N	-1	3	343.347	1.198	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@@H](O)c2ccncc2)c(-c2nnn[n-]2)c1	ZINC000826498796	594502754	/nfs/dbraw/zinc/50/27/54/594502754.db2.gz	KCKXDVUGWXSDJD-CYBMUJFWSA-N	-1	3	327.304	1.315	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@@H](O)c2ccncc2)c(-c2nn[n-]n2)c1	ZINC000826498796	594502757	/nfs/dbraw/zinc/50/27/57/594502757.db2.gz	KCKXDVUGWXSDJD-CYBMUJFWSA-N	-1	3	327.304	1.315	20	5		EDBDHM
O=C([O-])N1CC[C@@H](CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1	ZINC000831875373	594708655	/nfs/dbraw/zinc/70/86/55/594708655.db2.gz	WOZCEMYBJXBGSV-RYUDHWBXSA-N	-1	3	335.364	1.476	20	5		EDBDHM
Cc1ncsc1CC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000832112014	594727241	/nfs/dbraw/zinc/72/72/41/594727241.db2.gz	RDUCSKJWMXOTTG-UHFFFAOYSA-N	-1	3	333.416	1.942	20	5		EDBDHM
Cc1ncc2c(n1)CCC[C@@H]2[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000845859692	595082349	/nfs/dbraw/zinc/08/23/49/595082349.db2.gz	MDWKXALFXIBPTJ-ZDUSSCGKSA-N	-1	3	349.372	1.444	20	5		EDBDHM
O=C([N-]CC1(O)CCCC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848582291	595408614	/nfs/dbraw/zinc/40/86/14/595408614.db2.gz	KGAFPONQYILOAY-UHFFFAOYSA-N	-1	3	330.287	1.988	20	5		EDBDHM
C[C@H]1OCC[C@@]1(O)C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848589408	595411179	/nfs/dbraw/zinc/41/11/79/595411179.db2.gz	FHZMUBWJWVTOFS-NOZJJQNGSA-N	-1	3	346.286	1.223	20	5		EDBDHM
CN1CC[C@@H]([N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)CC1=O	ZINC000848592117	595411991	/nfs/dbraw/zinc/41/19/91/595411991.db2.gz	XFWHWEXDGGDQED-SECBINFHSA-N	-1	3	343.286	1.303	20	5		EDBDHM
CCON(CC)C(=O)CNCc1cc(OC)c([O-])cc1[N+](=O)[O-]	ZINC000858219529	595733664	/nfs/dbraw/zinc/73/36/64/595733664.db2.gz	QWTWKWGQSKPRJI-UHFFFAOYSA-N	-1	3	327.337	1.199	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2c2nc3ccccn3c2[N+](=O)[O-])nc1=N	ZINC000853660114	595849168	/nfs/dbraw/zinc/84/91/68/595849168.db2.gz	TWDKITOWCXEFLY-VIFPVBQESA-N	-1	3	328.336	1.125	20	5		EDBDHM
O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[N-]OCCN1CCCC1=O	ZINC000856041629	595883133	/nfs/dbraw/zinc/88/31/33/595883133.db2.gz	GDULVOCBHFFIOW-UHFFFAOYSA-N	-1	3	346.343	1.289	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]CC2SCCS2)cs1	ZINC000851832326	595940281	/nfs/dbraw/zinc/94/02/81/595940281.db2.gz	HXACTCIVZYSQAO-UHFFFAOYSA-N	-1	3	326.446	1.741	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H]2CCCN(C)C2)cc1F	ZINC000866753883	596322624	/nfs/dbraw/zinc/32/26/24/596322624.db2.gz	GVVOQGSTTBALQE-NSHDSACASA-N	-1	3	345.396	1.662	20	5		EDBDHM
CC[C@H]1COCCN1CCNCc1cc(OC)c([O-])cc1[N+](=O)[O-]	ZINC000873188452	597222197	/nfs/dbraw/zinc/22/21/97/597222197.db2.gz	GXUSIIBGGWEYCC-ZDUSSCGKSA-N	-1	3	339.392	1.509	20	5		EDBDHM
CNC(=O)c1ccc(N2CCc3nc[n-]c(=O)c3C2)c([N+](=O)[O-])c1	ZINC000357827097	290628547	/nfs/dbraw/zinc/62/85/47/290628547.db2.gz	GHMIWOIVTLSBLU-UHFFFAOYSA-N	-1	3	329.316	1.013	20	5		EDBDHM
Cc1ccc(C(=O)N2CCC[C@@H]2c2nc(=N)n(C)[n-]2)cc1[N+](=O)[O-]	ZINC000559257857	306252248	/nfs/dbraw/zinc/25/22/48/306252248.db2.gz	MFLGAFMGMHUQST-LLVKDONJSA-N	-1	3	330.348	1.422	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H](CO)c2ccccc2)c(F)c1	ZINC000102888542	219238894	/nfs/dbraw/zinc/23/88/94/219238894.db2.gz	YXAGMSIHXVHSCW-CYBMUJFWSA-N	-1	3	340.332	1.746	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2CO[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000564906075	306369401	/nfs/dbraw/zinc/36/94/01/306369401.db2.gz	HSEXZEBDANHHGP-JGVFFNPUSA-N	-1	3	334.325	1.198	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2CCC[C@@H]2O)c(Cl)c1	ZINC000089166151	217774214	/nfs/dbraw/zinc/77/42/14/217774214.db2.gz	MLLPPFPKUGWILF-KCJUWKMLSA-N	-1	3	334.781	1.688	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1ncc(C)o1	ZINC000173981946	533143794	/nfs/dbraw/zinc/14/37/94/533143794.db2.gz	PYEGOIPVESMSLG-UHFFFAOYSA-N	-1	3	327.318	1.378	20	5		EDBDHM
Cc1c([N+](=O)[O-])cc(C(=O)[N-]O[C@H]2CCCCO2)cc1[N+](=O)[O-]	ZINC000263764573	139358725	/nfs/dbraw/zinc/35/87/25/139358725.db2.gz	ZPQBJPAIEYCEKZ-LBPRGKRZSA-N	-1	3	325.277	1.999	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCn1cccc1	ZINC000487139915	255026899	/nfs/dbraw/zinc/02/68/99/255026899.db2.gz	SALDVSBSOGWKAF-UHFFFAOYSA-N	-1	3	325.346	1.383	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]Cc2ccno2)cc1[N+](=O)[O-]	ZINC000493872519	255224024	/nfs/dbraw/zinc/22/40/24/255224024.db2.gz	KWOPDDHZPCYZSL-UHFFFAOYSA-N	-1	3	331.281	1.209	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@]2(C)CCO[C@H]2C)cc1[N+](=O)[O-]	ZINC000493893487	255225174	/nfs/dbraw/zinc/22/51/74/255225174.db2.gz	GOTBFFFQSPVRLI-ISVAXAHUSA-N	-1	3	348.352	1.588	20	5		EDBDHM
CC(C)(C)[S@@](=O)CC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000116902425	221009031	/nfs/dbraw/zinc/00/90/31/221009031.db2.gz	GMOHVAGUOMGRLN-HXUWFJFHSA-N	-1	3	334.419	1.420	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(-c2nccn2C)[n-]n1	ZINC000119739727	221391122	/nfs/dbraw/zinc/39/11/22/221391122.db2.gz	VCQKWPNMUTVDSG-UHFFFAOYSA-N	-1	3	344.335	1.252	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(-c2nccn2C)n[n-]1	ZINC000119739727	221391125	/nfs/dbraw/zinc/39/11/25/221391125.db2.gz	VCQKWPNMUTVDSG-UHFFFAOYSA-N	-1	3	344.335	1.252	20	5		EDBDHM
Cn1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(=O)[n-]c1=O	ZINC000270898174	140193458	/nfs/dbraw/zinc/19/34/58/140193458.db2.gz	NXISUODAEVFYOD-UHFFFAOYSA-N	-1	3	344.327	1.199	20	5		EDBDHM
COC(=O)c1ccc(S(=O)(=O)[N-]CC[C@H](C)F)cc1[N+](=O)[O-]	ZINC000416486484	304323273	/nfs/dbraw/zinc/32/32/73/304323273.db2.gz	FVOMTCTXHFBWSV-QMMMGPOBSA-N	-1	3	334.325	1.408	20	5		EDBDHM
Cc1ncc(CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)c(=O)[n-]1	ZINC000345138500	143056070	/nfs/dbraw/zinc/05/60/70/143056070.db2.gz	XUUHJVRNSQJDPC-UHFFFAOYSA-N	-1	3	328.288	1.205	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CC[C@H](C)O1	ZINC000416526905	304328781	/nfs/dbraw/zinc/32/87/81/304328781.db2.gz	BVGIWPLMLANQPA-GXSJLCMTSA-N	-1	3	330.362	1.449	20	5		EDBDHM
CCn1ccc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)n1	ZINC000416591873	304335340	/nfs/dbraw/zinc/33/53/40/304335340.db2.gz	UTZICEYXBMDAFI-UHFFFAOYSA-N	-1	3	328.325	1.429	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCOC(F)(F)F)c([N+](=O)[O-])c1	ZINC000353788026	292181546	/nfs/dbraw/zinc/18/15/46/292181546.db2.gz	LNWQDGQSPXLKMP-UHFFFAOYSA-N	-1	3	328.268	1.718	20	5		EDBDHM
CN(C)c1cccnc1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000352727307	149132594	/nfs/dbraw/zinc/13/25/94/149132594.db2.gz	FQALTXMPQJSINR-UHFFFAOYSA-N	-1	3	336.373	1.534	20	5		EDBDHM
CCO[C@@H]1COCC[C@@H]1[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000352987722	149242376	/nfs/dbraw/zinc/24/23/76/149242376.db2.gz	UFVSNHUWGRRDQW-UONOGXRCSA-N	-1	3	344.389	1.208	20	5		EDBDHM
Cc1nc(C(C)(C)[N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)no1	ZINC000355405346	150255610	/nfs/dbraw/zinc/25/56/10/150255610.db2.gz	DFHBAIVEUQMPJK-UHFFFAOYSA-N	-1	3	340.361	1.641	20	5		EDBDHM
CCOC(=O)c1nnsc1[N-]C(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000358448951	151379667	/nfs/dbraw/zinc/37/96/67/151379667.db2.gz	FADFMQMUMXJOHX-UHFFFAOYSA-N	-1	3	337.317	1.579	20	5		EDBDHM
Cc1ncc(CNC(=O)NCc2cccc([N+](=O)[O-])c2C)c(=O)[n-]1	ZINC000359544807	151748436	/nfs/dbraw/zinc/74/84/36/151748436.db2.gz	HILOLJNFLRZINI-UHFFFAOYSA-N	-1	3	331.332	1.707	20	5		EDBDHM
Cn1cc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc(Cl)c1=O	ZINC000160253510	225372292	/nfs/dbraw/zinc/37/22/92/225372292.db2.gz	LXHUCEUZASIFDS-UHFFFAOYSA-N	-1	3	343.748	1.748	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCN2CCC[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000123177427	222230764	/nfs/dbraw/zinc/23/07/64/222230764.db2.gz	ROFHDIIHVKKFRK-JTQLQIEISA-N	-1	3	347.462	1.975	20	5		EDBDHM
COc1cc(C(=O)[N-]OC[C@H]2CCOC2)c([N+](=O)[O-])cc1OC	ZINC000276508031	268434746	/nfs/dbraw/zinc/43/47/46/268434746.db2.gz	VWUDFCZVDUYCDY-VIFPVBQESA-N	-1	3	326.305	1.310	20	5		EDBDHM
Cc1nnc([N-]C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)n1C	ZINC000273170532	273031650	/nfs/dbraw/zinc/03/16/50/273031650.db2.gz	LSJLDUKDHHRWGF-UHFFFAOYSA-N	-1	3	327.247	1.885	20	5		EDBDHM
Cc1ccc(-c2noc([C@@H](C)[N-]S(C)(=O)=O)n2)cc1[N+](=O)[O-]	ZINC000273748455	273052518	/nfs/dbraw/zinc/05/25/18/273052518.db2.gz	MDEJISVIICKZBV-MRVPVSSYSA-N	-1	3	326.334	1.563	20	5		EDBDHM
CCOC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(C)C	ZINC000276400505	273164962	/nfs/dbraw/zinc/16/49/62/273164962.db2.gz	ADAUZEVIEKFCBY-LBPRGKRZSA-N	-1	3	346.405	1.943	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CCOC[C@@H]1C	ZINC000278015489	273240812	/nfs/dbraw/zinc/24/08/12/273240812.db2.gz	WEODMAWWNFIXNI-ONGXEEELSA-N	-1	3	330.362	1.307	20	5		EDBDHM
CC[C@H](C)[C@H](O)C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000189999466	287767925	/nfs/dbraw/zinc/76/79/25/287767925.db2.gz	STCIJYCFSGFTNI-JOYOIKCWSA-N	-1	3	330.406	1.897	20	5		EDBDHM
CCn1cc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)cn1	ZINC000285692686	274619910	/nfs/dbraw/zinc/61/99/10/274619910.db2.gz	RWMMTADMILZEEB-UHFFFAOYSA-N	-1	3	342.352	1.737	20	5		EDBDHM
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000261754972	281460490	/nfs/dbraw/zinc/46/04/90/281460490.db2.gz	VBLMGYCIWFRMAT-WNMQOVRZSA-N	-1	3	335.360	1.771	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCCO[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000340885974	301688721	/nfs/dbraw/zinc/68/87/21/301688721.db2.gz	NHHXUSSGEGCUND-GFCCVEGCSA-N	-1	3	344.389	1.377	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@]1(O)CCC[C@H]1C	ZINC000294563266	303124378	/nfs/dbraw/zinc/12/43/78/303124378.db2.gz	LPUCMZFAEBKECN-QMTHXVAHSA-N	-1	3	344.389	1.433	20	5		EDBDHM
Cc1nc(N2CCN(C(=O)c3cccc([O-])c3)CC2)ncc1[N+](=O)[O-]	ZINC000295634600	303245159	/nfs/dbraw/zinc/24/51/59/303245159.db2.gz	XSJRCCCJJVOQAQ-UHFFFAOYSA-N	-1	3	343.343	1.361	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)[C@H](O)C(F)F	ZINC000295712099	303256362	/nfs/dbraw/zinc/25/63/62/303256362.db2.gz	KWWMGECFQZTEKW-MNOVXSKESA-N	-1	3	338.332	1.419	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)n[nH]1	ZINC000296897515	303344709	/nfs/dbraw/zinc/34/47/09/303344709.db2.gz	DNJAVDRLPOKZKS-UHFFFAOYSA-N	-1	3	325.350	1.062	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCC1CC(O)C1	ZINC000432313313	305090963	/nfs/dbraw/zinc/09/09/63/305090963.db2.gz	MVBGKNRFMXQFBO-UHFFFAOYSA-N	-1	3	330.362	1.043	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2C[C@@H]3OCCC[C@H]23)cc1[N+](=O)[O-]	ZINC000439091611	305193742	/nfs/dbraw/zinc/19/37/42/305193742.db2.gz	NHSSLUIGLKRPJK-KKZNHRDASA-N	-1	3	332.403	1.811	20	5		EDBDHM
CCC1([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2C(=O)OC)CC1	ZINC000451689332	305362377	/nfs/dbraw/zinc/36/23/77/305362377.db2.gz	LVGTTZUOIHCOTJ-UHFFFAOYSA-N	-1	3	328.346	1.602	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C)Cc1cnn(C)c1	ZINC000451966146	305374814	/nfs/dbraw/zinc/37/48/14/305374814.db2.gz	LNWLBKICDBOBPV-LLVKDONJSA-N	-1	3	338.389	1.546	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C)C(=O)OC(C)C	ZINC000451981384	305376060	/nfs/dbraw/zinc/37/60/60/305376060.db2.gz	FPGSJOSJKXDARQ-JTQLQIEISA-N	-1	3	330.362	1.522	20	5		EDBDHM
COC1(C[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])CCOCC1	ZINC000610958071	450391895	/nfs/dbraw/zinc/39/18/95/450391895.db2.gz	VMRHYHNHAFHBCS-UHFFFAOYSA-N	-1	3	344.389	1.377	20	5		EDBDHM
COC(=O)[C@](C)([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C1CC1	ZINC000522968257	305806835	/nfs/dbraw/zinc/80/68/35/305806835.db2.gz	HOABLYWLBPPMFV-CYBMUJFWSA-N	-1	3	328.346	1.215	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C(C)(C)c2cnn(C)c2)cc1[N+](=O)[O-]	ZINC000546004660	306089603	/nfs/dbraw/zinc/08/96/03/306089603.db2.gz	MFTWIRDITJUZEP-UHFFFAOYSA-N	-1	3	344.418	1.912	20	5		EDBDHM
COC(=O)N1CCC([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000057484690	441119987	/nfs/dbraw/zinc/11/99/87/441119987.db2.gz	XLHFDWFIPFAMKC-UHFFFAOYSA-N	-1	3	343.361	1.104	20	5		EDBDHM
Cc1cccnc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000104753310	441205153	/nfs/dbraw/zinc/20/51/53/441205153.db2.gz	YPMZWEZUENRQTJ-UHFFFAOYSA-N	-1	3	325.321	1.916	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@H]1CCCN(C)C1	ZINC000108406787	441452452	/nfs/dbraw/zinc/45/24/52/441452452.db2.gz	DBQXUAHZZGVZJP-GFCCVEGCSA-N	-1	3	327.406	1.523	20	5		EDBDHM
O=[N+]([O-])c1c(F)cccc1S(=O)(=O)[N-][C@H]1CCN2CCCC[C@H]12	ZINC000053667188	441534920	/nfs/dbraw/zinc/53/49/20/441534920.db2.gz	GIBWLFBMTWPSOB-NWDGAFQWSA-N	-1	3	343.380	1.639	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCc1ccccn1	ZINC000032402223	441555909	/nfs/dbraw/zinc/55/59/09/441555909.db2.gz	YBGQJEBMBJHASW-UHFFFAOYSA-N	-1	3	337.357	1.519	20	5		EDBDHM
O=C(CC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])Nc1ccccc1	ZINC000113303084	441600894	/nfs/dbraw/zinc/60/08/94/441600894.db2.gz	RXZNVQDTSUFIOL-UHFFFAOYSA-N	-1	3	349.368	1.902	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCOCC(F)(F)F	ZINC000076190377	441607902	/nfs/dbraw/zinc/60/79/02/441607902.db2.gz	DOGDCZVTFAPELQ-UHFFFAOYSA-N	-1	3	342.295	1.760	20	5		EDBDHM
COC(=O)Cn1ccc(NC(=O)c2n[n-]c3ccc([N+](=O)[O-])cc32)n1	ZINC000067924759	441697506	/nfs/dbraw/zinc/69/75/06/441697506.db2.gz	CDPDQMNQQMRKLZ-UHFFFAOYSA-N	-1	3	344.287	1.093	20	5		EDBDHM
COC(=O)CCCC[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000069044208	441882793	/nfs/dbraw/zinc/88/27/93/441882793.db2.gz	AGQVLTKTTOJGEK-UHFFFAOYSA-N	-1	3	346.361	1.225	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H](C)[C@@H](C)CO)cc1[N+](=O)[O-]	ZINC000120494300	442082800	/nfs/dbraw/zinc/08/28/00/442082800.db2.gz	IJJXYHQDBXWZDG-DTWKUNHWSA-N	-1	3	336.797	1.852	20	5		EDBDHM
O=C(NCCNc1ccccc1[N+](=O)[O-])c1cccc2nn[n-]c21	ZINC000163449777	442166752	/nfs/dbraw/zinc/16/67/52/442166752.db2.gz	UZDUDVMOLUBQTK-UHFFFAOYSA-N	-1	3	326.316	1.708	20	5		EDBDHM
O=C(NCCNc1ccccc1[N+](=O)[O-])c1cccc2[n-]nnc21	ZINC000163449777	442166755	/nfs/dbraw/zinc/16/67/55/442166755.db2.gz	UZDUDVMOLUBQTK-UHFFFAOYSA-N	-1	3	326.316	1.708	20	5		EDBDHM
O=C(NCCNc1ccccc1[N+](=O)[O-])c1cccc2n[n-]nc21	ZINC000163449777	442166757	/nfs/dbraw/zinc/16/67/57/442166757.db2.gz	UZDUDVMOLUBQTK-UHFFFAOYSA-N	-1	3	326.316	1.708	20	5		EDBDHM
CCN(C)C(=O)[C@@H](C)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000188461884	442752695	/nfs/dbraw/zinc/75/26/95/442752695.db2.gz	HISRCJKKGUHALB-LLVKDONJSA-N	-1	3	343.405	1.357	20	5		EDBDHM
CC1(C)CC[C@H](C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])O1	ZINC000188748959	442803473	/nfs/dbraw/zinc/80/34/73/442803473.db2.gz	BGLMIVWUVHSOHT-GFCCVEGCSA-N	-1	3	328.390	1.972	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C2CCC(O)CC2)c1[N+](=O)[O-]	ZINC000189788823	443010907	/nfs/dbraw/zinc/01/09/07/443010907.db2.gz	NRISDCPZXJGFGF-UHFFFAOYSA-N	-1	3	328.390	1.793	20	5		EDBDHM
CCN(CC[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C1CC1	ZINC000189934028	443031666	/nfs/dbraw/zinc/03/16/66/443031666.db2.gz	HPKRYSOCKVPQEP-UHFFFAOYSA-N	-1	3	341.433	1.974	20	5		EDBDHM
CCOC(=O)[C@@H](C)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000268773051	443104678	/nfs/dbraw/zinc/10/46/78/443104678.db2.gz	ITQUQNWYFPHEMK-VIFPVBQESA-N	-1	3	346.361	1.081	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCOCC(F)F)cc1C	ZINC000190957462	443214124	/nfs/dbraw/zinc/21/41/24/443214124.db2.gz	MJDSXOQMIMTCHY-UHFFFAOYSA-N	-1	3	338.332	1.772	20	5		EDBDHM
CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1[nH]c(=O)[n-]c(=O)c1N	ZINC000266811898	443251942	/nfs/dbraw/zinc/25/19/42/443251942.db2.gz	GAJFODOFWHVMRO-UHFFFAOYSA-N	-1	3	347.331	1.429	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CCc2nnc[nH]2)c1	ZINC000272564517	443365538	/nfs/dbraw/zinc/36/55/38/443365538.db2.gz	VWMHFPKNRWAEOC-UHFFFAOYSA-N	-1	3	345.768	1.196	20	5		EDBDHM
Cc1ccc([C@@H](O)C[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])o1	ZINC000269733522	443416208	/nfs/dbraw/zinc/41/62/08/443416208.db2.gz	CVTUQWJKRVMJRO-LBPRGKRZSA-N	-1	3	340.357	1.817	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H](O)C(C)(C)C	ZINC000269763161	443430293	/nfs/dbraw/zinc/43/02/93/443430293.db2.gz	KFKAYSWMRRHBSZ-GFCCVEGCSA-N	-1	3	332.378	1.289	20	5		EDBDHM
CN(C)CCn1cc(NC(=O)c2cc([O-])cc([N+](=O)[O-])c2)ccc1=O	ZINC000272676545	443406398	/nfs/dbraw/zinc/40/63/98/443406398.db2.gz	MGTQMUPASGGKRR-UHFFFAOYSA-N	-1	3	346.343	1.276	20	5		EDBDHM
CCOC(=O)[C@H](C)[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000273161090	443553975	/nfs/dbraw/zinc/55/39/75/443553975.db2.gz	ZYALSRWEJUTLMI-BDAKNGLRSA-N	-1	3	348.352	1.600	20	5		EDBDHM
COc1ccc(NC(=O)c2cc(=O)[n-]c(N(C)C)n2)cc1[N+](=O)[O-]	ZINC000434249080	319994607	/nfs/dbraw/zinc/99/46/07/319994607.db2.gz	LOCVSRBQNNMZQT-UHFFFAOYSA-N	-1	3	333.304	1.417	20	5		EDBDHM
Cc1nc(N2CCC[C@@H]2C[C@@]2(C)NC(=O)[N-]C2=O)ccc1[N+](=O)[O-]	ZINC000286196102	443665911	/nfs/dbraw/zinc/66/59/11/443665911.db2.gz	ATPPBSWIRRSAMO-MEBBXXQBSA-N	-1	3	333.348	1.255	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])[C@H](O)C(F)F	ZINC000451716478	320238617	/nfs/dbraw/zinc/23/86/17/320238617.db2.gz	RWLKHUJDXJEMHB-KWQFWETISA-N	-1	3	338.332	1.586	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](C)c2nncn2C)c1[N+](=O)[O-]	ZINC000276827255	443842398	/nfs/dbraw/zinc/84/23/98/443842398.db2.gz	OBHVTIGFVOORHA-SNVBAGLBSA-N	-1	3	339.377	1.380	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])C(=O)N1CCCC1	ZINC000281665438	443973584	/nfs/dbraw/zinc/97/35/84/443973584.db2.gz	XETBIQIDQLSERH-NSHDSACASA-N	-1	3	341.389	1.025	20	5		EDBDHM
CCCCOCC[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000299366711	444029733	/nfs/dbraw/zinc/02/97/33/444029733.db2.gz	XNQRBRHDQSMCHI-UHFFFAOYSA-N	-1	3	332.378	1.698	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1ccc[nH]c1=O	ZINC000557831355	321007744	/nfs/dbraw/zinc/00/77/44/321007744.db2.gz	IQWNJNJTHPBPOV-UHFFFAOYSA-N	-1	3	325.302	1.505	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1c1nc(=N)n(C)[n-]1	ZINC000567474135	321243117	/nfs/dbraw/zinc/24/31/17/321243117.db2.gz	HFEZFWGBUUSDSG-LBPRGKRZSA-N	-1	3	330.348	1.422	20	5		EDBDHM
O=c1nc([C@H]2CCCN(CCOc3ccc([N+](=O)[O-])cc3)C2)[nH][n-]1	ZINC000289541427	444168284	/nfs/dbraw/zinc/16/82/84/444168284.db2.gz	WROLOLUQYKZIIU-NSHDSACASA-N	-1	3	333.348	1.265	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H](O)C1CCC1	ZINC000315973801	444307930	/nfs/dbraw/zinc/30/79/30/444307930.db2.gz	FYCOPUPYNYSJTC-NSHDSACASA-N	-1	3	330.362	1.043	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1	ZINC000578118856	321724164	/nfs/dbraw/zinc/72/41/64/321724164.db2.gz	LZFBNXMPAYRDOQ-GFCCVEGCSA-N	-1	3	348.359	1.624	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CC[C@@H](C)C1	ZINC000323183352	444342383	/nfs/dbraw/zinc/34/23/83/444342383.db2.gz	PWORQBZDWDWDAP-ZJUUUORDSA-N	-1	3	342.373	1.848	20	5		EDBDHM
O=[N+]([O-])c1ccc(-c2nc(CS(=O)(=O)c3nnc[n-]3)co2)cc1	ZINC000340581275	444449024	/nfs/dbraw/zinc/44/90/24/444449024.db2.gz	YXXWRPUPMCOBPX-UHFFFAOYSA-N	-1	3	335.301	1.342	20	5		EDBDHM
CCC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C(=O)OC	ZINC000342531252	444734094	/nfs/dbraw/zinc/73/40/94/444734094.db2.gz	QWZJORYVSSZSTL-MRVPVSSYSA-N	-1	3	336.391	1.585	20	5		EDBDHM
CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCN2C(=O)[N-]C(=O)[C@H]2C1	ZINC000342542249	444737459	/nfs/dbraw/zinc/73/74/59/444737459.db2.gz	SMEALJKQBBUMEJ-CYBMUJFWSA-N	-1	3	348.359	1.118	20	5		EDBDHM
NC(=O)c1ccc(SCC(=O)Nc2ncccc2[O-])c([N+](=O)[O-])c1	ZINC000344188131	444829735	/nfs/dbraw/zinc/82/97/35/444829735.db2.gz	OATDUILBNDDYHP-UHFFFAOYSA-N	-1	3	348.340	1.525	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-]Cc1ccoc1)OCCO2	ZINC000343005204	445001671	/nfs/dbraw/zinc/00/16/71/445001671.db2.gz	BAYRCWAREYYXJB-UHFFFAOYSA-N	-1	3	340.313	1.438	20	5		EDBDHM
CCC[C@@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C(=O)OC	ZINC000358615322	445677105	/nfs/dbraw/zinc/67/71/05/445677105.db2.gz	WGMUIIJGFWPUBW-SNVBAGLBSA-N	-1	3	330.362	1.523	20	5		EDBDHM
O=C([O-])[C@H]1CCCN(CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1	ZINC000361507036	445793681	/nfs/dbraw/zinc/79/36/81/445793681.db2.gz	OVANISMPVNBKIC-NSHDSACASA-N	-1	3	349.343	1.689	20	5		EDBDHM
O=[N+]([O-])c1ccc(CS(=O)(=O)[N-][C@H](CO)c2ccsc2)cc1	ZINC000351575602	446172191	/nfs/dbraw/zinc/17/21/91/446172191.db2.gz	IFAAWTFALWVXKH-CYBMUJFWSA-N	-1	3	342.398	1.809	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@@H](C)N2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)on1	ZINC000369012126	447261488	/nfs/dbraw/zinc/26/14/88/447261488.db2.gz	WQBWEMOYGOUANX-VXGBXAGGSA-N	-1	3	348.363	1.752	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000427135263	447550952	/nfs/dbraw/zinc/55/09/52/447550952.db2.gz	ILSCQAJVVQRQOZ-UHFFFAOYSA-N	-1	3	338.707	1.939	20	5		EDBDHM
C[C@]1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCC(=O)N1	ZINC000416503444	447628608	/nfs/dbraw/zinc/62/86/08/447628608.db2.gz	VRYJZTQAZUQNEY-GFCCVEGCSA-N	-1	3	347.780	1.195	20	5		EDBDHM
COCC[C@H](C)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000416586997	447654593	/nfs/dbraw/zinc/65/45/93/447654593.db2.gz	PJSLAMKLZOFFHN-JTQLQIEISA-N	-1	3	332.378	1.554	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]Cc1nnc(C2CC2)s1	ZINC000416624747	447661658	/nfs/dbraw/zinc/66/16/58/447661658.db2.gz	QJKUJAWVPLTPQO-UHFFFAOYSA-N	-1	3	340.386	1.802	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CC12CCOCC2	ZINC000451886298	447773901	/nfs/dbraw/zinc/77/39/01/447773901.db2.gz	CXCZECSXZSTYJJ-LBPRGKRZSA-N	-1	3	326.374	1.751	20	5		EDBDHM
CCCN1CCC[C@H]1C[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000552120634	447935676	/nfs/dbraw/zinc/93/56/76/447935676.db2.gz	PCBBAIKBVRBMEE-NSHDSACASA-N	-1	3	328.394	1.143	20	5		EDBDHM
O=C(c1cccc2[n-]nnc21)N1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000577457101	448299422	/nfs/dbraw/zinc/29/94/22/448299422.db2.gz	RNKYSIOCEARHOD-UHFFFAOYSA-N	-1	3	339.311	1.901	20	5		EDBDHM
O=C(c1cccc2nn[n-]c21)N1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000577457101	448299428	/nfs/dbraw/zinc/29/94/28/448299428.db2.gz	RNKYSIOCEARHOD-UHFFFAOYSA-N	-1	3	339.311	1.901	20	5		EDBDHM
O=C(c1cccc2n[n-]nc21)N1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000577457101	448299432	/nfs/dbraw/zinc/29/94/32/448299432.db2.gz	RNKYSIOCEARHOD-UHFFFAOYSA-N	-1	3	339.311	1.901	20	5		EDBDHM
CCc1cc(=O)[n-]c(CN2CCN(c3ccc([N+](=O)[O-])nc3)CC2)n1	ZINC000532899436	448330458	/nfs/dbraw/zinc/33/04/58/448330458.db2.gz	IZRQYUGXSVMNHH-UHFFFAOYSA-N	-1	3	344.375	1.370	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1C[C@@H](C)O[C@@H](C)C1	ZINC000536607628	448533454	/nfs/dbraw/zinc/53/34/54/448533454.db2.gz	QBVITSCBZXGLQE-JGPRNRPPSA-N	-1	3	344.389	1.838	20	5		EDBDHM
CC[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(=O)OC	ZINC000592077310	448664545	/nfs/dbraw/zinc/66/45/45/448664545.db2.gz	MVPGDCDIJDLTRB-SECBINFHSA-N	-1	3	346.361	1.081	20	5		EDBDHM
CC(C)c1nc([C@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)n[nH]1	ZINC000593569718	449078713	/nfs/dbraw/zinc/07/87/13/449078713.db2.gz	OJMQYXJOSAIEPY-QMMMGPOBSA-N	-1	3	340.365	1.271	20	5		EDBDHM
C[C@@H]1C[C@H](CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCO1	ZINC000593575368	449083658	/nfs/dbraw/zinc/08/36/58/449083658.db2.gz	KUZVCTIAMPVJPI-GHMZBOCLSA-N	-1	3	329.378	1.473	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H](CO)CCF)c(Cl)c1	ZINC000593655948	449133052	/nfs/dbraw/zinc/13/30/52/449133052.db2.gz	GVVKQSPHZZFLAB-SSDOTTSWSA-N	-1	3	326.733	1.247	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCCC23CCOCC3)nc1	ZINC000593591978	449094970	/nfs/dbraw/zinc/09/49/70/449094970.db2.gz	QOKKSDTWXNUOSD-GFCCVEGCSA-N	-1	3	341.389	1.617	20	5		EDBDHM
CCOC(=O)C(CC)(CC)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593601507	449101464	/nfs/dbraw/zinc/10/14/64/449101464.db2.gz	ULHKEJHWKJRTQX-UHFFFAOYSA-N	-1	3	345.377	1.390	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)c1nccs1	ZINC000593549780	449341007	/nfs/dbraw/zinc/34/10/07/449341007.db2.gz	WXQMRTZZAHYENJ-VIFPVBQESA-N	-1	3	328.375	1.876	20	5		EDBDHM
Cc1nc(CN2CCN(c3cc[n-]c(=O)c3[N+](=O)[O-])CC2)cs1	ZINC000596066387	449343931	/nfs/dbraw/zinc/34/39/31/449343931.db2.gz	OAYCQPUJDLJRAX-UHFFFAOYSA-N	-1	3	335.389	1.783	20	5		EDBDHM
O=c1[n-]ccc(N2CCS(=O)(=O)C3(CCCCC3)C2)c1[N+](=O)[O-]	ZINC000596154612	449387333	/nfs/dbraw/zinc/38/73/33/449387333.db2.gz	DBTTVJUEMNPIKW-UHFFFAOYSA-N	-1	3	341.389	1.633	20	5		EDBDHM
O=[N+]([O-])c1ncccc1S(=O)(=O)[N-][C@H]1CCCN2CCCC[C@H]12	ZINC000594485252	449549572	/nfs/dbraw/zinc/54/95/72/449549572.db2.gz	YEOJQAUFMXYOOK-NWDGAFQWSA-N	-1	3	340.405	1.285	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)[C@H]1CCCCO1	ZINC000594486122	449550851	/nfs/dbraw/zinc/55/08/51/449550851.db2.gz	DHIOMYKJMVCKLO-VXGBXAGGSA-N	-1	3	329.378	1.616	20	5		EDBDHM
Cc1ccnc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)n1	ZINC000598733889	449568925	/nfs/dbraw/zinc/56/89/25/449568925.db2.gz	AURAWSMAZZTGET-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
CC[C@@H](CCO)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594757575	449671633	/nfs/dbraw/zinc/67/16/33/449671633.db2.gz	HSXDKUFRFQEQSI-JTQLQIEISA-N	-1	3	339.373	1.582	20	5		EDBDHM
CC[C@H](CCO)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594757577	449672402	/nfs/dbraw/zinc/67/24/02/449672402.db2.gz	HSXDKUFRFQEQSI-SNVBAGLBSA-N	-1	3	339.373	1.582	20	5		EDBDHM
CO[C@H](C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000594800814	449711350	/nfs/dbraw/zinc/71/13/50/449711350.db2.gz	LIWZKIKDDPNDNL-BXUZGUMPSA-N	-1	3	344.389	1.066	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2C[C@H](O)C23CCC3)c([N+](=O)[O-])c1	ZINC000594866880	449782319	/nfs/dbraw/zinc/78/23/19/449782319.db2.gz	YUOUVZNFQYVKPS-STQMWFEESA-N	-1	3	342.373	1.185	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CC[C@@H]2CCCO2)c(F)cc1[N+](=O)[O-]	ZINC000601297549	449808355	/nfs/dbraw/zinc/80/83/55/449808355.db2.gz	CKZPZDODFMGGKM-JTQLQIEISA-N	-1	3	332.353	1.890	20	5		EDBDHM
CCN1C[C@H]([N-]S(=O)(=O)c2cc(C)sc2[N+](=O)[O-])[C@@H](C)C1	ZINC000601359042	449873613	/nfs/dbraw/zinc/87/36/13/449873613.db2.gz	PXPPYIXTRXIVIH-WPRPVWTQSA-N	-1	3	333.435	1.583	20	5		EDBDHM
Cc1nc(C)c(C[N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)o1	ZINC000599317235	449886062	/nfs/dbraw/zinc/88/60/62/449886062.db2.gz	RIZRQNLIVQJBFM-UHFFFAOYSA-N	-1	3	325.346	1.819	20	5		EDBDHM
NC(=O)c1cc([N+](=O)[O-])cnc1[N-]c1cnn(-c2ccncc2)c1	ZINC000608909456	449949034	/nfs/dbraw/zinc/94/90/34/449949034.db2.gz	QRYFGDXUYSTXKE-UHFFFAOYSA-N	-1	3	325.288	1.413	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CCCOCC2)c(F)cc1[N+](=O)[O-]	ZINC000601386694	449903151	/nfs/dbraw/zinc/90/31/51/449903151.db2.gz	BJLQTEIBZCDITP-JTQLQIEISA-N	-1	3	332.353	1.890	20	5		EDBDHM
CN(C)C1(C[N-]S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1	ZINC000601449156	449972379	/nfs/dbraw/zinc/97/23/79/449972379.db2.gz	UORCOBSXSGFYDJ-UHFFFAOYSA-N	-1	3	333.797	1.621	20	5		EDBDHM
COC(=O)[C@@](C)([N-]S(=O)(=O)C1CC1)c1cccc([N+](=O)[O-])c1	ZINC000599488388	450017826	/nfs/dbraw/zinc/01/78/26/450017826.db2.gz	YNBGWTUZOCUKAU-ZDUSSCGKSA-N	-1	3	328.346	1.065	20	5		EDBDHM
CCCN1CC[C@@H]([N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C1	ZINC000595354052	450068853	/nfs/dbraw/zinc/06/88/53/450068853.db2.gz	MBSYOYBNLMMJNC-CYBMUJFWSA-N	-1	3	341.433	1.974	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC)C(C)C	ZINC000619486801	450487728	/nfs/dbraw/zinc/48/77/28/450487728.db2.gz	YQDVQTIMSNHRJG-SNVBAGLBSA-N	-1	3	332.378	1.553	20	5		EDBDHM
NC(=O)[C@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000152139683	534448307	/nfs/dbraw/zinc/44/83/07/534448307.db2.gz	ZTLQQOBPNXFQHQ-GXSJLCMTSA-N	-1	3	345.352	1.056	20	5		EDBDHM
Cc1nonc1C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000742326173	579448350	/nfs/dbraw/zinc/44/83/50/579448350.db2.gz	NAJBXDFLEPWITO-UHFFFAOYSA-N	-1	3	326.334	1.382	20	5		EDBDHM
CC(C)N(CCC(=O)[O-])Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000736468293	578991375	/nfs/dbraw/zinc/99/13/75/578991375.db2.gz	LMPOVVASBUNJHM-UHFFFAOYSA-N	-1	3	333.348	1.996	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1	ZINC000737612267	579120184	/nfs/dbraw/zinc/12/01/84/579120184.db2.gz	XWIDKQLIIGUGBI-UHFFFAOYSA-N	-1	3	331.267	1.505	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1	ZINC000737612267	579120185	/nfs/dbraw/zinc/12/01/85/579120185.db2.gz	XWIDKQLIIGUGBI-UHFFFAOYSA-N	-1	3	331.267	1.505	20	5		EDBDHM
O=C(NCCOc1ccc(-c2nnn[n-]2)cc1)c1ccc([N+](=O)[O-])o1	ZINC000738088785	579158809	/nfs/dbraw/zinc/15/88/09/579158809.db2.gz	KPHFMSLQWKKYLR-UHFFFAOYSA-N	-1	3	344.287	1.177	20	5		EDBDHM
O=C(NCCOc1ccc(-c2nn[n-]n2)cc1)c1ccc([N+](=O)[O-])o1	ZINC000738088785	579158810	/nfs/dbraw/zinc/15/88/10/579158810.db2.gz	KPHFMSLQWKKYLR-UHFFFAOYSA-N	-1	3	344.287	1.177	20	5		EDBDHM
O=C(OCc1csc([N+](=O)[O-])c1)c1ccc(-c2nnn[n-]2)cn1	ZINC000738244916	579176607	/nfs/dbraw/zinc/17/66/07/579176607.db2.gz	MPAJZMVUTCPCOF-UHFFFAOYSA-N	-1	3	332.301	1.588	20	5		EDBDHM
O=C(OCc1csc([N+](=O)[O-])c1)c1ccc(-c2nn[n-]n2)cn1	ZINC000738244916	579176608	/nfs/dbraw/zinc/17/66/08/579176608.db2.gz	MPAJZMVUTCPCOF-UHFFFAOYSA-N	-1	3	332.301	1.588	20	5		EDBDHM
CN(C)CCN(CC(=O)[O-])C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000739607219	579225449	/nfs/dbraw/zinc/22/54/49/579225449.db2.gz	QECWDAWTVFRFBW-UHFFFAOYSA-N	-1	3	334.332	1.165	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)[C@H](C)CNC(=O)[O-]	ZINC000740153262	579294462	/nfs/dbraw/zinc/29/44/62/579294462.db2.gz	PLILOLBWZAYGNR-LLVKDONJSA-N	-1	3	338.364	1.820	20	5		EDBDHM
Cc1cc2c(cc1[N+](=O)[O-])N(Cc1nc3c(cnn3C)c(=O)[n-]1)CC2	ZINC000754109842	579896796	/nfs/dbraw/zinc/89/67/96/579896796.db2.gz	PDCRJGSVQADVHB-UHFFFAOYSA-N	-1	3	340.343	1.848	20	5		EDBDHM
COC(=O)C[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C1CC1	ZINC000754240290	579899114	/nfs/dbraw/zinc/89/91/14/579899114.db2.gz	RLPIQGRBPMQQRG-JTQLQIEISA-N	-1	3	328.346	1.215	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CCC=CO1	ZINC000780899550	580536971	/nfs/dbraw/zinc/53/69/71/580536971.db2.gz	AZSCZDKKNKSRAD-NSHDSACASA-N	-1	3	328.346	1.574	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@@H]2CCc3n[nH]cc3C2)c(-c2nnn[n-]2)c1	ZINC000738370094	598896097	/nfs/dbraw/zinc/89/60/97/598896097.db2.gz	NJDQQXCYIIZOJU-SECBINFHSA-N	-1	3	326.320	1.467	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@@H]2CCc3n[nH]cc3C2)c(-c2nn[n-]n2)c1	ZINC000738370094	598896098	/nfs/dbraw/zinc/89/60/98/598896098.db2.gz	NJDQQXCYIIZOJU-SECBINFHSA-N	-1	3	326.320	1.467	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCN(C)[C@H](C)C2)cc1F	ZINC000866871503	590781167	/nfs/dbraw/zinc/78/11/67/590781167.db2.gz	OCUOJMPMUANKDR-GHMZBOCLSA-N	-1	3	345.396	1.803	20	5		EDBDHM
COc1c([O-])ccc(CN2CC(=O)N(CC(F)(F)F)C2)c1[N+](=O)[O-]	ZINC000894007536	591162498	/nfs/dbraw/zinc/16/24/98/591162498.db2.gz	GPHMEIHIUMIIHD-UHFFFAOYSA-N	-1	3	349.265	1.473	20	5		EDBDHM
COc1c([O-])ccc(CN2C[C@@H](C)N(CCO)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000894953661	591498559	/nfs/dbraw/zinc/49/85/59/591498559.db2.gz	HDOGLCLPPQDBSE-NEPJUHHUSA-N	-1	3	339.392	1.196	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2COC[C@H]2C2CC2)c1C	ZINC000908409588	592484532	/nfs/dbraw/zinc/48/45/32/592484532.db2.gz	LIMQMUMJOWBBRQ-STQMWFEESA-N	-1	3	340.401	1.915	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2COC[C@@H]2C2CC2)c(Cl)c1	ZINC000908414604	592486636	/nfs/dbraw/zinc/48/66/36/592486636.db2.gz	OYRXJIBEMPQWBK-ZYHUDNBSSA-N	-1	3	346.792	1.952	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@H]2CC[C@@H](C3CC3)O2)cs1	ZINC000907468127	592650278	/nfs/dbraw/zinc/65/02/78/592650278.db2.gz	CWZBABQWLLTJNR-KOLCDFICSA-N	-1	3	332.403	1.892	20	5		EDBDHM
C[C@H](OC(=O)c1cnn[n-]1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000805605514	593111615	/nfs/dbraw/zinc/11/16/15/593111615.db2.gz	JEFCQHMVJOUMLB-ZETCQYMHSA-N	-1	3	330.260	1.681	20	5		EDBDHM
C[C@H](OC(=O)c1c[n-]nn1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000805605514	593111617	/nfs/dbraw/zinc/11/16/17/593111617.db2.gz	JEFCQHMVJOUMLB-ZETCQYMHSA-N	-1	3	330.260	1.681	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCCc2cnn(C)n2)cc1[N+](=O)[O-]	ZINC000815053463	593612389	/nfs/dbraw/zinc/61/23/89/593612389.db2.gz	KBXARPUOPZCOIY-UHFFFAOYSA-N	-1	3	345.406	1.004	20	5		EDBDHM
C[C@@]1(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CCCC[C@@H]1O	ZINC000820623254	593847411	/nfs/dbraw/zinc/84/74/11/593847411.db2.gz	JRGOMYSNUAHRSG-FZMZJTMJSA-N	-1	3	333.352	1.523	20	5		EDBDHM
C[C@@]1(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CCCC[C@@H]1O	ZINC000820623254	593847415	/nfs/dbraw/zinc/84/74/15/593847415.db2.gz	JRGOMYSNUAHRSG-FZMZJTMJSA-N	-1	3	333.352	1.523	20	5		EDBDHM
CC(C)OC(=O)[C@H](C)CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820138563	599078921	/nfs/dbraw/zinc/07/89/21/599078921.db2.gz	XMQXRJMGWSIJHH-SECBINFHSA-N	-1	3	334.336	1.775	20	5		EDBDHM
CC(C)OC(=O)[C@H](C)CNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820138563	599078924	/nfs/dbraw/zinc/07/89/24/599078924.db2.gz	XMQXRJMGWSIJHH-SECBINFHSA-N	-1	3	334.336	1.775	20	5		EDBDHM
Cc1nc2n(n1)CCC[C@H]2Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000822461799	594052255	/nfs/dbraw/zinc/05/22/55/594052255.db2.gz	AJVKQEDDAXLYHQ-GFCCVEGCSA-N	-1	3	341.335	1.622	20	5		EDBDHM
Cc1nc2n(n1)CCC[C@H]2Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000822461799	594052256	/nfs/dbraw/zinc/05/22/56/594052256.db2.gz	AJVKQEDDAXLYHQ-GFCCVEGCSA-N	-1	3	341.335	1.622	20	5		EDBDHM
O=C(OCc1cccc(-c2nnn[n-]2)c1)c1ccc([N+](=O)[O-])cn1	ZINC000823431854	594201310	/nfs/dbraw/zinc/20/13/10/594201310.db2.gz	ZUBMONLRMHVZQB-UHFFFAOYSA-N	-1	3	326.272	1.527	20	5		EDBDHM
O=C(OCc1cccc(-c2nn[n-]n2)c1)c1ccc([N+](=O)[O-])cn1	ZINC000823431854	594201313	/nfs/dbraw/zinc/20/13/13/594201313.db2.gz	ZUBMONLRMHVZQB-UHFFFAOYSA-N	-1	3	326.272	1.527	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC3(C2)CCOCC3)c(-c2nnn[n-]2)c1	ZINC000823647252	594224419	/nfs/dbraw/zinc/22/44/19/594224419.db2.gz	IWEKTVCBPLBCQB-UHFFFAOYSA-N	-1	3	331.336	1.177	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC3(C2)CCOCC3)c(-c2nn[n-]n2)c1	ZINC000823647252	594224420	/nfs/dbraw/zinc/22/44/20/594224420.db2.gz	IWEKTVCBPLBCQB-UHFFFAOYSA-N	-1	3	331.336	1.177	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@H]2c3ccccc3C[C@@H]2O)c(-c2nnn[n-]2)c1	ZINC000823651074	594224691	/nfs/dbraw/zinc/22/46/91/594224691.db2.gz	DOFDXHCKGPINER-STQMWFEESA-N	-1	3	339.315	1.240	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@H]2c3ccccc3C[C@@H]2O)c(-c2nn[n-]n2)c1	ZINC000823651074	594224692	/nfs/dbraw/zinc/22/46/92/594224692.db2.gz	DOFDXHCKGPINER-STQMWFEESA-N	-1	3	339.315	1.240	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@@H]2CCC[C@@H]3OCC[C@H]32)c(-c2nnn[n-]2)c1	ZINC000823651440	594224745	/nfs/dbraw/zinc/22/47/45/594224745.db2.gz	JQKXYMWIEHEPGH-WCQGTBRESA-N	-1	3	331.336	1.539	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@@H]2CCC[C@@H]3OCC[C@H]32)c(-c2nn[n-]n2)c1	ZINC000823651440	594224746	/nfs/dbraw/zinc/22/47/46/594224746.db2.gz	JQKXYMWIEHEPGH-WCQGTBRESA-N	-1	3	331.336	1.539	20	5		EDBDHM
CC(C)(C)c1cc([N-]C(=O)Cn2nc([N+](=O)[O-])cc2[N+](=O)[O-])on1	ZINC000829842701	594274802	/nfs/dbraw/zinc/27/48/02/594274802.db2.gz	QPWXOYUNBIHGPH-UHFFFAOYSA-N	-1	3	338.280	1.624	20	5		EDBDHM
COc1cc(COC(=O)c2cc(-c3nnn[n-]3)c[nH]2)ccc1[N+](=O)[O-]	ZINC000826180146	594364373	/nfs/dbraw/zinc/36/43/73/594364373.db2.gz	UOKHIIIVGUOVPA-UHFFFAOYSA-N	-1	3	344.287	1.469	20	5		EDBDHM
COc1cc(COC(=O)c2cc(-c3nn[n-]n3)c[nH]2)ccc1[N+](=O)[O-]	ZINC000826180146	594364376	/nfs/dbraw/zinc/36/43/76/594364376.db2.gz	UOKHIIIVGUOVPA-UHFFFAOYSA-N	-1	3	344.287	1.469	20	5		EDBDHM
Cc1cc(-c2nnn[n-]2)ccc1COC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000826254108	594400400	/nfs/dbraw/zinc/40/04/00/594400400.db2.gz	UUDNUQPNHFXYPF-UHFFFAOYSA-N	-1	3	343.303	1.023	20	5		EDBDHM
Cc1cc(-c2nn[n-]n2)ccc1COC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000826254108	594400402	/nfs/dbraw/zinc/40/04/02/594400402.db2.gz	UUDNUQPNHFXYPF-UHFFFAOYSA-N	-1	3	343.303	1.023	20	5		EDBDHM
O=C(NCCc1ccc([N+](=O)[O-])cc1)c1c[nH]c(-c2nnn[n-]2)c1	ZINC000826439414	594477381	/nfs/dbraw/zinc/47/73/81/594477381.db2.gz	UEMILYPZUTZRHU-UHFFFAOYSA-N	-1	3	327.304	1.076	20	5		EDBDHM
O=C(NCCc1ccc([N+](=O)[O-])cc1)c1c[nH]c(-c2nn[n-]n2)c1	ZINC000826439414	594477383	/nfs/dbraw/zinc/47/73/83/594477383.db2.gz	UEMILYPZUTZRHU-UHFFFAOYSA-N	-1	3	327.304	1.076	20	5		EDBDHM
O=[N+]([O-])c1cccc([C@H](O)CSc2cc(-c3nnn[n-]3)ccn2)c1	ZINC000826499552	594503356	/nfs/dbraw/zinc/50/33/56/594503356.db2.gz	NCBHDCADMNJZQN-GFCCVEGCSA-N	-1	3	344.356	1.996	20	5		EDBDHM
O=[N+]([O-])c1cccc([C@H](O)CSc2cc(-c3nn[n-]n3)ccn2)c1	ZINC000826499552	594503358	/nfs/dbraw/zinc/50/33/58/594503358.db2.gz	NCBHDCADMNJZQN-GFCCVEGCSA-N	-1	3	344.356	1.996	20	5		EDBDHM
CN1CCN(C2CCN(C(=O)c3ccc([N+](=O)[O-])c([O-])c3)CC2)CC1	ZINC000827468564	594675056	/nfs/dbraw/zinc/67/50/56/594675056.db2.gz	XLQFZYIUFVLYBW-UHFFFAOYSA-N	-1	3	348.403	1.152	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@@H]1CCn2ccnc21	ZINC000831744743	594698481	/nfs/dbraw/zinc/69/84/81/594698481.db2.gz	PBJJFMGNTOHSQG-SECBINFHSA-N	-1	3	342.764	1.868	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2CSCCS2)nc1	ZINC000845893573	595090747	/nfs/dbraw/zinc/09/07/47/595090747.db2.gz	RMUJPQJPWRZXGL-SECBINFHSA-N	-1	3	335.432	1.117	20	5		EDBDHM
CN(C)C1(C[N-]S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1	ZINC000867438685	595314914	/nfs/dbraw/zinc/31/49/14/595314914.db2.gz	HXRQZFMIIKYWKW-UHFFFAOYSA-N	-1	3	333.797	1.621	20	5		EDBDHM
CCNC(=O)[C@@H](C)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848579817	595407775	/nfs/dbraw/zinc/40/77/75/595407775.db2.gz	BPTKGFQGCIAWJI-MRVPVSSYSA-N	-1	3	331.275	1.207	20	5		EDBDHM
Cc1nccn1CC[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848582448	595409124	/nfs/dbraw/zinc/40/91/24/595409124.db2.gz	LKDGYAGFMCHVPB-UHFFFAOYSA-N	-1	3	340.286	1.888	20	5		EDBDHM
O=C([N-][C@H](CCO)C1CC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848583599	595409374	/nfs/dbraw/zinc/40/93/74/595409374.db2.gz	DNQCSIMQGSMNEE-GFCCVEGCSA-N	-1	3	330.287	1.844	20	5		EDBDHM
CC1(C)OC[C@@H](C[N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)O1	ZINC000848584529	595409923	/nfs/dbraw/zinc/40/99/23/595409923.db2.gz	AQSKTYFBPPMRBL-LLVKDONJSA-N	-1	3	346.286	1.834	20	5		EDBDHM
C[C@@H]1CCNC(=O)[C@@H]1[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848589363	595411109	/nfs/dbraw/zinc/41/11/09/595411109.db2.gz	DOPPPZFSBNQSIY-LDYMZIIASA-N	-1	3	343.286	1.207	20	5		EDBDHM
COc1ccc(OC)c2c1CN(c1cc[n-]c(=O)c1[N+](=O)[O-])C[C@H]2O	ZINC000853096227	595663380	/nfs/dbraw/zinc/66/33/80/595663380.db2.gz	TVPSTYSWYGOHCK-LLVKDONJSA-N	-1	3	347.327	1.766	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)NC1CCCCC1	ZINC000119670109	596704489	/nfs/dbraw/zinc/70/44/89/596704489.db2.gz	QYBBXASABOAYSL-UHFFFAOYSA-N	-1	3	347.418	1.384	20	5		EDBDHM
COCCCO[N-]C(=O)Cc1ccc(Br)c([N+](=O)[O-])c1	ZINC000868331105	596788971	/nfs/dbraw/zinc/78/89/71/596788971.db2.gz	WEMNQCOKLROPFL-UHFFFAOYSA-N	-1	3	347.165	1.984	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]C[C@@H]1C[C@H]2CCC[C@H]2O1	ZINC000872557309	596963773	/nfs/dbraw/zinc/96/37/73/596963773.db2.gz	QDOXGTDQEUNKSU-OSAQELSMSA-N	-1	3	340.401	1.972	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@H](CO)Cc2ccccc2)cs1	ZINC000126004416	597235031	/nfs/dbraw/zinc/23/50/31/597235031.db2.gz	VJYAIZOHTLIIPQ-NSHDSACASA-N	-1	3	342.398	1.538	20	5		EDBDHM
CN1CCN(C2CCN(Cc3cc([O-])ccc3[N+](=O)[O-])CC2)CC1	ZINC000877747655	597552994	/nfs/dbraw/zinc/55/29/94/597552994.db2.gz	WGYUJDJQCKMDQT-UHFFFAOYSA-N	-1	3	334.420	1.512	20	5		EDBDHM
O=[N+]([O-])c1ccc(Nc2ccc(OCCO)cc2)c(-c2nnn[n-]2)c1	ZINC000738370861	598678972	/nfs/dbraw/zinc/67/89/72/598678972.db2.gz	RETOBXGKHDJYFF-UHFFFAOYSA-N	-1	3	342.315	1.890	20	5		EDBDHM
O=[N+]([O-])c1ccc(Nc2ccc(OCCO)cc2)c(-c2nn[n-]n2)c1	ZINC000738370861	598678974	/nfs/dbraw/zinc/67/89/74/598678974.db2.gz	RETOBXGKHDJYFF-UHFFFAOYSA-N	-1	3	342.315	1.890	20	5		EDBDHM
COc1cccc(C(=O)NCc2nc(C(F)(F)F)n[n-]2)c1[N+](=O)[O-]	ZINC000444362540	696930884	/nfs/dbraw/zinc/93/08/84/696930884.db2.gz	JHKCEIDVPQYOMI-UHFFFAOYSA-N	-1	3	345.237	1.670	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCCC[C@@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000125073624	138331846	/nfs/dbraw/zinc/33/18/46/138331846.db2.gz	VWFWHMJZCFPHCC-DTWKUNHWSA-N	-1	3	347.418	1.287	20	5		EDBDHM
COCC1(C(=O)[O-])CCN(CCOc2ccccc2[N+](=O)[O-])CC1	ZINC000565837899	306393233	/nfs/dbraw/zinc/39/32/33/306393233.db2.gz	IPSJUWYFLAOKAX-UHFFFAOYSA-N	-1	3	338.360	1.787	20	5		EDBDHM
COC(=O)Cc1n[n-]c(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)n1	ZINC000266004032	248019206	/nfs/dbraw/zinc/01/92/06/248019206.db2.gz	OCPCSCWFTGHJIE-UHFFFAOYSA-N	-1	3	347.331	1.345	20	5		EDBDHM
COC(=O)Cc1nnc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)[n-]1	ZINC000266004032	248019209	/nfs/dbraw/zinc/01/92/09/248019209.db2.gz	OCPCSCWFTGHJIE-UHFFFAOYSA-N	-1	3	347.331	1.345	20	5		EDBDHM
COC(=O)Cc1nc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)n[n-]1	ZINC000266004032	248019211	/nfs/dbraw/zinc/01/92/11/248019211.db2.gz	OCPCSCWFTGHJIE-UHFFFAOYSA-N	-1	3	347.331	1.345	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@H]2CC[C@H](C)O2)cc1[N+](=O)[O-]	ZINC000416536541	251074696	/nfs/dbraw/zinc/07/46/96/251074696.db2.gz	PYSSZIRJHVGCLE-DTWKUNHWSA-N	-1	3	348.352	1.588	20	5		EDBDHM
CC[C@H](C)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC	ZINC000420701704	304775100	/nfs/dbraw/zinc/77/51/00/304775100.db2.gz	FAXBAKHZCUMIAF-VIFPVBQESA-N	-1	3	330.362	1.706	20	5		EDBDHM
COC(=O)Cc1n[n-]c(NC(=O)C=Cc2ccc(F)cc2[N+](=O)[O-])n1	ZINC000491848832	255152189	/nfs/dbraw/zinc/15/21/89/255152189.db2.gz	UNMSZKKKLJPBLE-HWKANZROSA-N	-1	3	349.278	1.219	20	5		EDBDHM
COC(=O)Cc1nnc(NC(=O)C=Cc2ccc(F)cc2[N+](=O)[O-])[n-]1	ZINC000491848832	255152190	/nfs/dbraw/zinc/15/21/90/255152190.db2.gz	UNMSZKKKLJPBLE-HWKANZROSA-N	-1	3	349.278	1.219	20	5		EDBDHM
COC(=O)Cc1nc(NC(=O)C=Cc2ccc(F)cc2[N+](=O)[O-])n[n-]1	ZINC000491848832	255152191	/nfs/dbraw/zinc/15/21/91/255152191.db2.gz	UNMSZKKKLJPBLE-HWKANZROSA-N	-1	3	349.278	1.219	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCn3ccnc3C2)cc1[N+](=O)[O-]	ZINC000491867667	255153354	/nfs/dbraw/zinc/15/33/54/255153354.db2.gz	JLQZDTUAYQDIBX-SECBINFHSA-N	-1	3	342.402	1.455	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]Cc2cc(C(N)=O)co2)cc1[N+](=O)[O-]	ZINC000494368542	255248092	/nfs/dbraw/zinc/24/80/92/255248092.db2.gz	MTOLSVBAVNGSAG-UHFFFAOYSA-N	-1	3	345.358	1.135	20	5		EDBDHM
CO[C@@H]1[C@@H](C)[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1(C)C	ZINC000332447382	141183468	/nfs/dbraw/zinc/18/34/68/141183468.db2.gz	LLVZLCKZMBZRGV-ZWKOPEQDSA-N	-1	3	328.390	1.933	20	5		EDBDHM
O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCc2c(=O)[n-]cnc2C1	ZINC000345210190	143064831	/nfs/dbraw/zinc/06/48/31/143064831.db2.gz	XZIIPKDKCZYNMB-UHFFFAOYSA-N	-1	3	334.719	1.942	20	5		EDBDHM
COc1cc(S(=O)(=O)[N-]CCC(F)(F)F)ccc1[N+](=O)[O-]	ZINC000345326947	143078408	/nfs/dbraw/zinc/07/84/08/143078408.db2.gz	KFJGBPZXMAQXIL-UHFFFAOYSA-N	-1	3	328.268	1.834	20	5		EDBDHM
CCOC(=O)c1ccc(NC(=O)Cn2ccc([N+](=O)[O-])n2)c([O-])c1	ZINC000345379543	143084020	/nfs/dbraw/zinc/08/40/20/143084020.db2.gz	MYMHCEJDEGNDEE-UHFFFAOYSA-N	-1	3	334.288	1.312	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H](C)c2csnn2)cc1[N+](=O)[O-]	ZINC000416637795	304339601	/nfs/dbraw/zinc/33/96/01/304339601.db2.gz	VBVGIXUFKBQZAB-RXMQYKEDSA-N	-1	3	334.404	1.856	20	5		EDBDHM
Cc1nn(C)c(C(=O)Nc2cccc(-c3nnn[n-]3)c2)c1[N+](=O)[O-]	ZINC000352973892	149235546	/nfs/dbraw/zinc/23/55/46/149235546.db2.gz	CLLKTFFPMANSPM-UHFFFAOYSA-N	-1	3	328.292	1.069	20	5		EDBDHM
Cc1nn(C)c(C(=O)Nc2cccc(-c3nn[n-]n3)c2)c1[N+](=O)[O-]	ZINC000352973892	149235548	/nfs/dbraw/zinc/23/55/48/149235548.db2.gz	CLLKTFFPMANSPM-UHFFFAOYSA-N	-1	3	328.292	1.069	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CSC[C@@H]1C	ZINC000352347146	162133378	/nfs/dbraw/zinc/13/33/78/162133378.db2.gz	VGKVTMUONUVWEI-WCBMZHEXSA-N	-1	3	332.403	1.633	20	5		EDBDHM
O=C(Nc1nnc(-c2ccco2)[n-]1)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000352395848	162160924	/nfs/dbraw/zinc/16/09/24/162160924.db2.gz	SAOHAIKVXSWQMO-UHFFFAOYSA-N	-1	3	343.255	1.954	20	5		EDBDHM
O=C(Nc1nc(-c2ccco2)n[n-]1)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000352395848	162160928	/nfs/dbraw/zinc/16/09/28/162160928.db2.gz	SAOHAIKVXSWQMO-UHFFFAOYSA-N	-1	3	343.255	1.954	20	5		EDBDHM
O=C(Nc1n[n-]c(-c2ccco2)n1)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000352395848	162160930	/nfs/dbraw/zinc/16/09/30/162160930.db2.gz	SAOHAIKVXSWQMO-UHFFFAOYSA-N	-1	3	343.255	1.954	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCc2cnn(C)c2)cc1C	ZINC000060505642	287235477	/nfs/dbraw/zinc/23/54/77/287235477.db2.gz	VABWNCFCMHEBFQ-UHFFFAOYSA-N	-1	3	338.389	1.466	20	5		EDBDHM
CC(C)[C@@H](CCO)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000122550949	222111477	/nfs/dbraw/zinc/11/14/77/222111477.db2.gz	WUCGZLGKRSWHBE-SNVBAGLBSA-N	-1	3	336.797	1.934	20	5		EDBDHM
C/C=C/C[C@@H](CO)[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000274637392	268174168	/nfs/dbraw/zinc/17/41/68/268174168.db2.gz	LLALZZLLVNGTFW-FSIBCCDJSA-N	-1	3	330.362	1.209	20	5		EDBDHM
CC(C)N1CCC[C@@H]([N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1	ZINC000274647371	268175331	/nfs/dbraw/zinc/17/53/31/268175331.db2.gz	DPLAPAMXNFURFZ-LLVKDONJSA-N	-1	3	345.396	1.885	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@]2(O)CCO[C@@H]2C)cc1C	ZINC000278681112	268710038	/nfs/dbraw/zinc/71/00/38/268710038.db2.gz	ILQFMRHEWYHBMP-RISCZKNCSA-N	-1	3	344.389	1.030	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2CCO)cc1[N+](=O)[O-]	ZINC000275240034	273108954	/nfs/dbraw/zinc/10/89/54/273108954.db2.gz	XAPZWZQXGOSBBP-ZWNOBZJWSA-N	-1	3	346.380	1.872	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCC[C@@H]1CCO	ZINC000275154970	273103952	/nfs/dbraw/zinc/10/39/52/273103952.db2.gz	HLIQFNNRBWYEPY-ZYHUDNBSSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COc1cc(Cn2cc(Cl)c(=O)[n-]c2=O)c([N+](=O)[O-])cc1F	ZINC000361586640	274095432	/nfs/dbraw/zinc/09/54/32/274095432.db2.gz	HYLWQDMFNYMKTA-UHFFFAOYSA-N	-1	3	329.671	1.707	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H](C)CCCO)c([N+](=O)[O-])c1	ZINC000295464002	303223580	/nfs/dbraw/zinc/22/35/80/303223580.db2.gz	ZXFMWSAQCDFLMC-SNVBAGLBSA-N	-1	3	332.378	1.290	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)n[nH]1	ZINC000297036085	303356260	/nfs/dbraw/zinc/35/62/60/303356260.db2.gz	LGLKEXJIVVKJIG-UHFFFAOYSA-N	-1	3	343.340	1.201	20	5		EDBDHM
COc1ccncc1C[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1C	ZINC000431598214	305080447	/nfs/dbraw/zinc/08/04/47/305080447.db2.gz	BLWMYIMHUMVPOL-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
COc1cccc2c1nc(NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)n2C	ZINC000445208322	305257959	/nfs/dbraw/zinc/25/79/59/305257959.db2.gz	DSGLPZCWUULLBZ-UHFFFAOYSA-N	-1	3	343.299	1.843	20	5		EDBDHM
O=C(NCCCNC(=O)c1ccc([N+](=O)[O-])cn1)c1cccc([O-])c1	ZINC000532679536	305989008	/nfs/dbraw/zinc/98/90/08/305989008.db2.gz	DMELDHCGXJHVPK-UHFFFAOYSA-N	-1	3	344.327	1.245	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCCOCC(C)C)c([N+](=O)[O-])c1	ZINC000023403341	441295878	/nfs/dbraw/zinc/29/58/78/441295878.db2.gz	BHAHAXLFUSCLAG-UHFFFAOYSA-N	-1	3	346.405	1.944	20	5		EDBDHM
Cn1nccc1C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000026822917	441385549	/nfs/dbraw/zinc/38/55/49/441385549.db2.gz	YHAMHEZWZUVGHT-UHFFFAOYSA-N	-1	3	330.753	1.460	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCc2nccs2)c([N+](=O)[O-])c1	ZINC000065268238	441412371	/nfs/dbraw/zinc/41/23/71/441412371.db2.gz	JEFIYLHDDOIFHL-UHFFFAOYSA-N	-1	3	343.386	1.581	20	5		EDBDHM
CNC(=O)c1cccc(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c1	ZINC000028321572	441430358	/nfs/dbraw/zinc/43/03/58/441430358.db2.gz	NEMKWDITEMJHEO-UHFFFAOYSA-N	-1	3	349.368	1.433	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CCC[C@@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000160235427	441868420	/nfs/dbraw/zinc/86/84/20/441868420.db2.gz	SACILFQRKLULFL-MNOVXSKESA-N	-1	3	341.389	1.226	20	5		EDBDHM
CCc1nn(C)c(NCCCNC(=O)c2cccc([O-])c2)c1[N+](=O)[O-]	ZINC000094153725	441908855	/nfs/dbraw/zinc/90/88/55/441908855.db2.gz	AVCAOCXMMQCGRB-UHFFFAOYSA-N	-1	3	347.375	1.828	20	5		EDBDHM
CNC(=O)[C@H](CC(C)C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000119594891	441942021	/nfs/dbraw/zinc/94/20/21/441942021.db2.gz	HSGKACMRNQBYHK-NSHDSACASA-N	-1	3	347.368	1.173	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H]2CCC[C@H]2O)c1C	ZINC000162800030	442123335	/nfs/dbraw/zinc/12/33/35/442123335.db2.gz	AJZAVMRSSNNUMO-WCQYABFASA-N	-1	3	328.390	1.651	20	5		EDBDHM
NC(=O)[C@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000152139796	442171148	/nfs/dbraw/zinc/17/11/48/442171148.db2.gz	ZTLQQOBPNXFQHQ-ONGXEEELSA-N	-1	3	345.352	1.056	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c([N+](=O)[O-])c1	ZINC000153374913	442279181	/nfs/dbraw/zinc/27/91/81/442279181.db2.gz	DVTMAZOFFZZUSE-HONMWMINSA-N	-1	3	340.401	1.995	20	5		EDBDHM
C[C@@H](CN1CCCCC1)[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000180880136	442666825	/nfs/dbraw/zinc/66/68/25/442666825.db2.gz	MBNKOIFVDSLVDW-NSHDSACASA-N	-1	3	345.396	1.887	20	5		EDBDHM
CC(C)Cn1ccnc1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000182416914	442765811	/nfs/dbraw/zinc/76/58/11/442765811.db2.gz	VQFPOXVPKCLCCM-UHFFFAOYSA-N	-1	3	338.389	1.926	20	5		EDBDHM
CCCCOC(=O)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000265454048	442778789	/nfs/dbraw/zinc/77/87/89/442778789.db2.gz	XEOIJJRASHPKER-UHFFFAOYSA-N	-1	3	346.361	1.225	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCC[C@H]2CCO)c(F)c1	ZINC000188933333	442844179	/nfs/dbraw/zinc/84/41/79/442844179.db2.gz	HAQBUXDCHPHRAF-CABZTGNLSA-N	-1	3	332.353	1.563	20	5		EDBDHM
CC(C)N1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CC1=O	ZINC000265659494	442867712	/nfs/dbraw/zinc/86/77/12/442867712.db2.gz	RDUONKGCQVZAFO-SECBINFHSA-N	-1	3	345.352	1.022	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]Cc1nnc(C2CC2)o1	ZINC000189076182	442872101	/nfs/dbraw/zinc/87/21/01/442872101.db2.gz	IHOWNQICYAAQEJ-UHFFFAOYSA-N	-1	3	338.345	1.642	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2C(=O)NCC[C@@H]2C)cc1C	ZINC000195476198	443022213	/nfs/dbraw/zinc/02/22/13/443022213.db2.gz	ZUSBLSSTKQWJON-ISVAXAHUSA-N	-1	3	341.389	1.015	20	5		EDBDHM
C/C=C/C[C@H](CO)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000185275648	443174623	/nfs/dbraw/zinc/17/46/23/443174623.db2.gz	LAQNFUPFLNEGCM-ZYOFXKKJSA-N	-1	3	328.390	1.817	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H](OC)C(C)C	ZINC000266727746	443221263	/nfs/dbraw/zinc/22/12/63/443221263.db2.gz	KYGPUTWJIXNAPK-LBPRGKRZSA-N	-1	3	332.378	1.553	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000269307755	443275729	/nfs/dbraw/zinc/27/57/29/443275729.db2.gz	UVWROVBITDHNJE-BXKDBHETSA-N	-1	3	330.362	1.043	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCCC[C@@H]1O	ZINC000269656739	443382178	/nfs/dbraw/zinc/38/21/78/443382178.db2.gz	ANGZLKWNYPITHC-QWRGUYRKSA-N	-1	3	330.362	1.185	20	5		EDBDHM
Cc1ccnc(N2CCN(C(=O)c3cccc([O-])c3)CC2)c1[N+](=O)[O-]	ZINC000265264524	443588588	/nfs/dbraw/zinc/58/85/88/443588588.db2.gz	SXINATLQXYQDIL-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
O=C(c1c([O-])cccc1O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000436864467	320027071	/nfs/dbraw/zinc/02/70/71/320027071.db2.gz	NPAQBHFKOQTQNN-UHFFFAOYSA-N	-1	3	330.296	1.909	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])N[C@H]1CC=CCC1	ZINC000280954359	443783078	/nfs/dbraw/zinc/78/30/78/443783078.db2.gz	MQXYJRBJYHTTSF-NSHDSACASA-N	-1	3	339.373	1.098	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C1(c2nc[nH]n2)CCC1	ZINC000281177788	443839462	/nfs/dbraw/zinc/83/94/62/443839462.db2.gz	NBPWXAJZGNLIJH-UHFFFAOYSA-N	-1	3	337.361	1.379	20	5		EDBDHM
O=C([N-][C@@]1(CCO)CCOC1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000278111709	444098751	/nfs/dbraw/zinc/09/87/51/444098751.db2.gz	POJZZDBKDSUQEA-ZDUSSCGKSA-N	-1	3	330.287	1.344	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]C[C@@H](O)C1CCC1	ZINC000316165807	444309211	/nfs/dbraw/zinc/30/92/11/444309211.db2.gz	YAMIQHYQPHWTSD-LLVKDONJSA-N	-1	3	334.781	1.688	20	5		EDBDHM
O=C([O-])c1ccc([N+](=O)[O-])c(N2CCN(C3CCOCC3)CC2)c1	ZINC000577757464	321680562	/nfs/dbraw/zinc/68/05/62/321680562.db2.gz	YXHAGTZVMDXJDR-UHFFFAOYSA-N	-1	3	335.360	1.594	20	5		EDBDHM
CCC[C@H](CCO)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000323339839	444342935	/nfs/dbraw/zinc/34/29/35/444342935.db2.gz	WYYABAKAQVCOLD-LLVKDONJSA-N	-1	3	346.405	1.680	20	5		EDBDHM
CCc1nc([C@H](C)[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])n[nH]1	ZINC000342790033	444868686	/nfs/dbraw/zinc/86/86/86/444868686.db2.gz	NQOHKPFTYLFEBJ-VIFPVBQESA-N	-1	3	339.377	1.623	20	5		EDBDHM
CCc1nnc([C@H](C)[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])[nH]1	ZINC000342790033	444868691	/nfs/dbraw/zinc/86/86/91/444868691.db2.gz	NQOHKPFTYLFEBJ-VIFPVBQESA-N	-1	3	339.377	1.623	20	5		EDBDHM
CN(C)c1nc(-c2nc(Cc3ccccc3[N+](=O)[O-])no2)cc(=O)[n-]1	ZINC000345541825	445190066	/nfs/dbraw/zinc/19/00/66/445190066.db2.gz	NESKRXPZWRRQAI-UHFFFAOYSA-N	-1	3	342.315	1.797	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C(C)C)C(C)(C)O	ZINC000360125192	445581835	/nfs/dbraw/zinc/58/18/35/445581835.db2.gz	WJOWWCCGMLPCED-CYBMUJFWSA-N	-1	3	346.405	1.677	20	5		EDBDHM
CCO[C@@H]1COCC[C@@H]1[N-]c1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000353258965	445582861	/nfs/dbraw/zinc/58/28/61/445582861.db2.gz	DGPKJWOQFOIAGJ-QWHCGFSZSA-N	-1	3	334.332	2.251	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCc1ncccc1[O-]	ZINC000360039867	445540360	/nfs/dbraw/zinc/54/03/60/445540360.db2.gz	RQAVULDCIZJCGP-UHFFFAOYSA-N	-1	3	337.357	1.358	20	5		EDBDHM
Cc1noc([C@@H]2CCCN(C(=O)c3cc(C)[n-]c(=O)c3[N+](=O)[O-])C2)n1	ZINC000375101387	446581068	/nfs/dbraw/zinc/58/10/68/446581068.db2.gz	OKFULYLRGPNWAA-SNVBAGLBSA-N	-1	3	347.331	1.715	20	5		EDBDHM
O=C(Nc1ccn(CCC(F)(F)F)n1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000425319495	447113106	/nfs/dbraw/zinc/11/31/06/447113106.db2.gz	CQLPEQCIWZAOBV-UHFFFAOYSA-N	-1	3	345.237	2.097	20	5		EDBDHM
COCC[C@@]1([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCOC1	ZINC000445097857	447170231	/nfs/dbraw/zinc/17/02/31/447170231.db2.gz	YRYZFCGIOXDICA-CYBMUJFWSA-N	-1	3	330.362	1.069	20	5		EDBDHM
CCN1C[C@H]([N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])CC1=O	ZINC000451860693	447765602	/nfs/dbraw/zinc/76/56/02/447765602.db2.gz	BPINZQDXDGRTQG-LLVKDONJSA-N	-1	3	341.389	1.111	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)[C@@H](OC)C1CC1	ZINC000451983112	447795856	/nfs/dbraw/zinc/79/58/56/447795856.db2.gz	GFKMWCRLYDXFAU-YMTOWFKASA-N	-1	3	344.389	1.695	20	5		EDBDHM
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC[C@@H]2N(C)CCCC2(C)C)n1	ZINC000569696895	447869372	/nfs/dbraw/zinc/86/93/72/447869372.db2.gz	DHOIGFUMUWSNKI-LBPRGKRZSA-N	-1	3	336.392	2.529	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCOCC1CCC1	ZINC000572540712	448405121	/nfs/dbraw/zinc/40/51/21/448405121.db2.gz	PFJRKGOFNNTQRQ-UHFFFAOYSA-N	-1	3	328.390	1.998	20	5		EDBDHM
CCOC1CC(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000593581843	449090003	/nfs/dbraw/zinc/09/00/03/449090003.db2.gz	MTKFWUNJOHAOQN-UHFFFAOYSA-N	-1	3	329.378	1.473	20	5		EDBDHM
CCCN1CCC[C@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593594943	449097267	/nfs/dbraw/zinc/09/72/67/449097267.db2.gz	IGMCFFAQBDSFDF-NSHDSACASA-N	-1	3	328.394	1.143	20	5		EDBDHM
CCn1c(=O)[n-]nc1SCc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000593419816	449275266	/nfs/dbraw/zinc/27/52/66/449275266.db2.gz	YLKMQIYIERPDFF-UHFFFAOYSA-N	-1	3	338.345	1.991	20	5		EDBDHM
O=C(NC1CCCCC1)N1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596071255	449348730	/nfs/dbraw/zinc/34/87/30/449348730.db2.gz	NQEIQBKAJBAOAI-UHFFFAOYSA-N	-1	3	349.391	1.860	20	5		EDBDHM
CS(=O)(=O)N[C@@H]1CCCC[C@@H]1CNc1cc[n-]c(=O)c1[N+](=O)[O-]	ZINC000596230863	449428924	/nfs/dbraw/zinc/42/89/24/449428924.db2.gz	CXZAYNWTCACTQW-NXEZZACHSA-N	-1	3	344.393	1.215	20	5		EDBDHM
CC(C)(C(=O)[O-])N1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1	ZINC000600877003	449583121	/nfs/dbraw/zinc/58/31/21/449583121.db2.gz	WSUKAVIHGPWYKA-UHFFFAOYSA-N	-1	3	349.387	1.535	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-])C(C)(C)O	ZINC000594761065	449675458	/nfs/dbraw/zinc/67/54/58/449675458.db2.gz	CJDYHMCCBXMUPI-SECBINFHSA-N	-1	3	339.373	1.581	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2C[C@H](C)n3ncnc32)cc1[N+](=O)[O-]	ZINC000594805727	449717775	/nfs/dbraw/zinc/71/77/75/449717775.db2.gz	CFCHEARZGMCVAY-XPUUQOCRSA-N	-1	3	343.390	1.541	20	5		EDBDHM
C[C@@H](CN1CCC(C)CC1)[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594862681	449774713	/nfs/dbraw/zinc/77/47/13/449774713.db2.gz	PBIJTCAYOZZGQF-LBPRGKRZSA-N	-1	3	342.421	1.389	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@H](C)N(C)C2CC2)c(F)cc1[N+](=O)[O-]	ZINC000601335432	449844688	/nfs/dbraw/zinc/84/46/88/449844688.db2.gz	LUSCLHYUXPPYET-SNVBAGLBSA-N	-1	3	345.396	1.803	20	5		EDBDHM
CCN1C[C@@H](C)[C@@H]([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)C1	ZINC000601358701	449871660	/nfs/dbraw/zinc/87/16/60/449871660.db2.gz	MMMKBJIJHWYQKD-PWSUYJOCSA-N	-1	3	345.396	1.661	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2ccc3c(c2)CCCN3)nc1	ZINC000595111456	449875764	/nfs/dbraw/zinc/87/57/64/449875764.db2.gz	KQGPTFOMDXMDLV-UHFFFAOYSA-N	-1	3	348.384	1.826	20	5		EDBDHM
CC(C)CC[C@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000599410821	449955560	/nfs/dbraw/zinc/95/55/60/449955560.db2.gz	RXQDIBBOUKEBMN-SNVBAGLBSA-N	-1	3	334.369	1.809	20	5		EDBDHM
CCC1(C[N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)COC1	ZINC000601431870	449952355	/nfs/dbraw/zinc/95/23/55/449952355.db2.gz	SBRZLWNLIUBUHZ-UHFFFAOYSA-N	-1	3	332.353	1.747	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CC2=CCN(C)CC2)c(F)cc1[N+](=O)[O-]	ZINC000601387316	449903200	/nfs/dbraw/zinc/90/32/00/449903200.db2.gz	UNMNNQFSUNONRZ-UHFFFAOYSA-N	-1	3	343.380	1.583	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CO[C@H](C2CC2)C1	ZINC000599483205	450011714	/nfs/dbraw/zinc/01/17/14/450011714.db2.gz	SRGQPPNYRQHMEH-PWSUYJOCSA-N	-1	3	342.373	1.449	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2C[C@@H](C)O[C@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000601499718	450019797	/nfs/dbraw/zinc/01/97/97/450019797.db2.gz	RLUIUAGVRLSPCH-WCABBAIRSA-N	-1	3	332.353	1.887	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](C)C1(CO)CC1	ZINC000594825830	486637009	/nfs/dbraw/zinc/63/70/09/486637009.db2.gz	CKLFEWYMGPRBEV-VIFPVBQESA-N	-1	3	330.362	1.043	20	5		EDBDHM
C[C@H](CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)CN1CCOCC1	ZINC000736026540	578947798	/nfs/dbraw/zinc/94/77/98/578947798.db2.gz	PQISSGNDNMVVPG-LLVKDONJSA-N	-1	3	347.379	1.155	20	5		EDBDHM
C[C@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)CN1CCOCC1	ZINC000736026540	578947799	/nfs/dbraw/zinc/94/77/99/578947799.db2.gz	PQISSGNDNMVVPG-LLVKDONJSA-N	-1	3	347.379	1.155	20	5		EDBDHM
Cc1c(COC(=O)c2ccc(-c3nnn[n-]3)cn2)cccc1[N+](=O)[O-]	ZINC000737216631	579057335	/nfs/dbraw/zinc/05/73/35/579057335.db2.gz	USVLGCXVTQKXCE-UHFFFAOYSA-N	-1	3	340.299	1.835	20	5		EDBDHM
Cc1c(COC(=O)c2ccc(-c3nn[n-]n3)cn2)cccc1[N+](=O)[O-]	ZINC000737216631	579057336	/nfs/dbraw/zinc/05/73/36/579057336.db2.gz	USVLGCXVTQKXCE-UHFFFAOYSA-N	-1	3	340.299	1.835	20	5		EDBDHM
O=C(NCc1cccc(-c2nnn[n-]2)c1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000738115540	579161289	/nfs/dbraw/zinc/16/12/89/579161289.db2.gz	DLYQDMAKTVJXRK-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=C(NCc1cccc(-c2nn[n-]n2)c1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000738115540	579161291	/nfs/dbraw/zinc/16/12/91/579161291.db2.gz	DLYQDMAKTVJXRK-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
CCOCCON=C([O-])Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C	ZINC000753132346	579873209	/nfs/dbraw/zinc/87/32/09/579873209.db2.gz	XAFOSKLUGLSNMC-UHFFFAOYSA-N	-1	3	341.320	1.779	20	5		EDBDHM
CCOCCO[N-]C(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C	ZINC000753132346	579873210	/nfs/dbraw/zinc/87/32/10/579873210.db2.gz	XAFOSKLUGLSNMC-UHFFFAOYSA-N	-1	3	341.320	1.779	20	5		EDBDHM
CCCCOC(=O)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000767771302	580199009	/nfs/dbraw/zinc/19/90/09/580199009.db2.gz	OVZDKYVGTIEQDU-UHFFFAOYSA-N	-1	3	336.391	1.586	20	5		EDBDHM
CO[C@@H](CC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C(F)(F)F	ZINC000786876400	580682464	/nfs/dbraw/zinc/68/24/64/580682464.db2.gz	VXLZTEKVDFZZGN-ZETCQYMHSA-N	-1	3	348.324	1.902	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H]2[C@@H]3COC[C@@H]32)cc1[N+](=O)[O-]	ZINC000795301145	580918241	/nfs/dbraw/zinc/91/82/41/580918241.db2.gz	KPKKHQWPRPWNBB-JDICNCQASA-N	-1	3	332.765	1.480	20	5		EDBDHM
CCOc1cc(C(=O)[N-]OCC(C)(C)O)c([N+](=O)[O-])cc1OC	ZINC000816382042	593521894	/nfs/dbraw/zinc/52/18/94/593521894.db2.gz	COEPECZYUQJUCQ-UHFFFAOYSA-N	-1	3	328.321	1.434	20	5		EDBDHM
CC(C)[C@@H]1CN(c2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CCS1	ZINC000820047353	593786146	/nfs/dbraw/zinc/78/61/46/593786146.db2.gz	XVOKSXWDGZVICK-NSHDSACASA-N	-1	3	335.393	1.748	20	5		EDBDHM
CC(C)[C@@H]1CN(c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CCS1	ZINC000820047353	593786147	/nfs/dbraw/zinc/78/61/47/593786147.db2.gz	XVOKSXWDGZVICK-NSHDSACASA-N	-1	3	335.393	1.748	20	5		EDBDHM
C[C@@H](CNc1ccc(-c2nnn[n-]2)c([N+](=O)[O-])c1)CC1(C)OCCO1	ZINC000820273914	593805340	/nfs/dbraw/zinc/80/53/40/593805340.db2.gz	ABCJLZRNJZWDOB-SNVBAGLBSA-N	-1	3	348.363	1.976	20	5		EDBDHM
C[C@@H](CO[C@H]1CCOC1)Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820286815	593806225	/nfs/dbraw/zinc/80/62/25/593806225.db2.gz	FYMJYPVYMKATLD-ONGXEEELSA-N	-1	3	334.336	1.381	20	5		EDBDHM
C[C@@H](CO[C@H]1CCOC1)Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820286815	593806226	/nfs/dbraw/zinc/80/62/26/593806226.db2.gz	FYMJYPVYMKATLD-ONGXEEELSA-N	-1	3	334.336	1.381	20	5		EDBDHM
C[C@H](CO[C@H]1CCOC1)Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000820286979	593806518	/nfs/dbraw/zinc/80/65/18/593806518.db2.gz	HUOIEAUDVCRWFJ-KOLCDFICSA-N	-1	3	334.336	1.381	20	5		EDBDHM
C[C@H](CO[C@H]1CCOC1)Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000820286979	593806519	/nfs/dbraw/zinc/80/65/19/593806519.db2.gz	HUOIEAUDVCRWFJ-KOLCDFICSA-N	-1	3	334.336	1.381	20	5		EDBDHM
C[C@@H](O)CCNc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820474569	593821816	/nfs/dbraw/zinc/82/18/16/593821816.db2.gz	STFPHPRTSDSOPH-MRVPVSSYSA-N	-1	3	329.320	1.506	20	5		EDBDHM
C[C@@H](O)CCNc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820474569	593821817	/nfs/dbraw/zinc/82/18/17/593821817.db2.gz	STFPHPRTSDSOPH-MRVPVSSYSA-N	-1	3	329.320	1.506	20	5		EDBDHM
Cc1cc(=O)n(Cc2cc(-c3nnn[n-]3)ccc2F)cc1[N+](=O)[O-]	ZINC000822161017	594002378	/nfs/dbraw/zinc/00/23/78/594002378.db2.gz	NFKMEBBYTBNPNA-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cc1cc(=O)n(Cc2cc(-c3nn[n-]n3)ccc2F)cc1[N+](=O)[O-]	ZINC000822161017	594002381	/nfs/dbraw/zinc/00/23/81/594002381.db2.gz	NFKMEBBYTBNPNA-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
C[C@H]1CN(c2cc(-c3nnn[n-]3)c3cc([N+](=O)[O-])ccc3n2)C[C@H]1O	ZINC000824995414	594112354	/nfs/dbraw/zinc/11/23/54/594112354.db2.gz	ZMRJKGKKVYNFKB-ISVAXAHUSA-N	-1	3	341.331	1.140	20	5		EDBDHM
C[C@H]1CN(c2cc(-c3nn[n-]n3)c3cc([N+](=O)[O-])ccc3n2)C[C@H]1O	ZINC000824995414	594112356	/nfs/dbraw/zinc/11/23/56/594112356.db2.gz	ZMRJKGKKVYNFKB-ISVAXAHUSA-N	-1	3	341.331	1.140	20	5		EDBDHM
O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(-c2nnn[n-]2)cn1	ZINC000822983972	594131746	/nfs/dbraw/zinc/13/17/46/594131746.db2.gz	ZZWNEQXVEXATKH-UHFFFAOYSA-N	-1	3	339.315	1.741	20	5		EDBDHM
O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(-c2nn[n-]n2)cn1	ZINC000822983972	594131748	/nfs/dbraw/zinc/13/17/48/594131748.db2.gz	ZZWNEQXVEXATKH-UHFFFAOYSA-N	-1	3	339.315	1.741	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCO[C@@H]2CCCC[C@@H]21	ZINC000823630462	594222868	/nfs/dbraw/zinc/22/28/68/594222868.db2.gz	XBRYKCSBPTUVCQ-GXTWGEPZSA-N	-1	3	330.348	1.923	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCO[C@@H]2CCCC[C@@H]21	ZINC000823630462	594222869	/nfs/dbraw/zinc/22/28/69/594222869.db2.gz	XBRYKCSBPTUVCQ-GXTWGEPZSA-N	-1	3	330.348	1.923	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CC[C@@]3(O)CCCC[C@H]3C2)c(-c2nnn[n-]2)c1	ZINC000823639742	594223806	/nfs/dbraw/zinc/22/38/06/594223806.db2.gz	GSVKYYCAWAPJBS-ZBEGNZNMSA-N	-1	3	344.375	1.906	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CC[C@@]3(O)CCCC[C@H]3C2)c(-c2nn[n-]n2)c1	ZINC000823639742	594223807	/nfs/dbraw/zinc/22/38/07/594223807.db2.gz	GSVKYYCAWAPJBS-ZBEGNZNMSA-N	-1	3	344.375	1.906	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@@H]2CCc3c2cccc3O)c(-c2nnn[n-]2)c1	ZINC000823651212	594224634	/nfs/dbraw/zinc/22/46/34/594224634.db2.gz	INFDQNSMFGWTTL-GFCCVEGCSA-N	-1	3	339.315	1.975	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@@H]2CCc3c2cccc3O)c(-c2nn[n-]n2)c1	ZINC000823651212	594224635	/nfs/dbraw/zinc/22/46/35/594224635.db2.gz	INFDQNSMFGWTTL-GFCCVEGCSA-N	-1	3	339.315	1.975	20	5		EDBDHM
COc1cc(F)cc(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)c1	ZINC000826180357	594364551	/nfs/dbraw/zinc/36/45/51/594364551.db2.gz	DHMWKMAIXNLRJG-UHFFFAOYSA-N	-1	3	345.294	1.930	20	5		EDBDHM
COc1cc(F)cc(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)c1	ZINC000826180357	594364554	/nfs/dbraw/zinc/36/45/54/594364554.db2.gz	DHMWKMAIXNLRJG-UHFFFAOYSA-N	-1	3	345.294	1.930	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCn3ccnc32)c1C	ZINC000831739041	594698114	/nfs/dbraw/zinc/69/81/14/594698114.db2.gz	PMNQYGGBYIYJKS-LLVKDONJSA-N	-1	3	336.373	1.831	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]Cc2nnc(C3CC3)[nH]2)cs1	ZINC000831838893	594706455	/nfs/dbraw/zinc/70/64/55/594706455.db2.gz	OEJGMWOKDIBIEN-UHFFFAOYSA-N	-1	3	329.363	1.130	20	5		EDBDHM
CCN1CC[C@H]([N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1=O	ZINC000848592060	595411999	/nfs/dbraw/zinc/41/19/99/595411999.db2.gz	WGKDYOOFDYIDEJ-NSHDSACASA-N	-1	3	343.286	1.303	20	5		EDBDHM
CNC(=O)C[C@@H](C)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848591897	595412100	/nfs/dbraw/zinc/41/21/00/595412100.db2.gz	PRLIWEXQFSNVCD-MRVPVSSYSA-N	-1	3	331.275	1.207	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCOC(=O)N(C)C)cc1C	ZINC000849446268	595528744	/nfs/dbraw/zinc/52/87/44/595528744.db2.gz	PMIZTLLOUXEMCL-UHFFFAOYSA-N	-1	3	345.377	1.188	20	5		EDBDHM
CCOC(=O)[C@]1(F)CN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC12CCC2	ZINC000853760150	595873387	/nfs/dbraw/zinc/87/33/87/595873387.db2.gz	IPMLBUFZZOTGJJ-OAHLLOKOSA-N	-1	3	339.323	1.957	20	5		EDBDHM
CCn1ncc(C[N-]S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)n1	ZINC000859251986	596017564	/nfs/dbraw/zinc/01/75/64/596017564.db2.gz	KSWKTEUJBUVQRY-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
CCOC(=O)C[C@@H](CO)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000854539787	596111306	/nfs/dbraw/zinc/11/13/06/596111306.db2.gz	NXBSDNYTWJGDGU-JTQLQIEISA-N	-1	3	346.286	1.117	20	5		EDBDHM
CCn1nnc(C)c1C[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000862082714	596199379	/nfs/dbraw/zinc/19/93/79/596199379.db2.gz	NGIIGCNNCJPFJI-UHFFFAOYSA-N	-1	3	339.302	1.923	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H]2CCO[C@@H](C3CC3)C2)cs1	ZINC000120324687	596440043	/nfs/dbraw/zinc/44/00/43/596440043.db2.gz	KESZRYZVSLDBOG-MWLCHTKSSA-N	-1	3	332.403	1.892	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C(=O)NC(C)(C)C	ZINC000119646723	596697574	/nfs/dbraw/zinc/69/75/74/596697574.db2.gz	XHPVSWOZSQUWMC-ZETCQYMHSA-N	-1	3	335.407	1.238	20	5		EDBDHM
Cn1cc(CCC[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)cn1	ZINC000119697832	596710572	/nfs/dbraw/zinc/71/05/72/596710572.db2.gz	JLPUFXYLSHSCDE-UHFFFAOYSA-N	-1	3	330.391	1.301	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@@H](O)c2ccccc2F)cs1	ZINC000119810444	596743484	/nfs/dbraw/zinc/74/34/84/596743484.db2.gz	BTVYJZCMFNRGHS-LLVKDONJSA-N	-1	3	346.361	1.807	20	5		EDBDHM
CC1(C)[C@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@@H]2CCO[C@@H]21	ZINC000119843021	596756581	/nfs/dbraw/zinc/75/65/81/596756581.db2.gz	BYNMXDUANUCWFR-GDPRMGEGSA-N	-1	3	332.403	1.748	20	5		EDBDHM
C[C@]1(C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CCCC[C@@H]1O	ZINC000119924074	596796804	/nfs/dbraw/zinc/79/68/04/596796804.db2.gz	XVLXEFDNZIEOGU-CMPLNLGQSA-N	-1	3	334.419	1.876	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCNc3ccccc3C2)c(-c2nnn[n-]2)c1	ZINC000738368101	598499641	/nfs/dbraw/zinc/49/96/41/598499641.db2.gz	FDPQADNDZJKKHR-UHFFFAOYSA-N	-1	3	338.331	1.602	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCNc3ccccc3C2)c(-c2nn[n-]n2)c1	ZINC000738368101	598499642	/nfs/dbraw/zinc/49/96/42/598499642.db2.gz	FDPQADNDZJKKHR-UHFFFAOYSA-N	-1	3	338.331	1.602	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCc2nccs2)c(F)c1	ZINC000051162918	214081873	/nfs/dbraw/zinc/08/18/73/214081873.db2.gz	JCSANAIPQTXYGY-UHFFFAOYSA-N	-1	3	331.350	1.711	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCC[S@@](C)=O)cc1[N+](=O)[O-]	ZINC000124089161	138323769	/nfs/dbraw/zinc/32/37/69/138323769.db2.gz	KLUYLEWBHUAFJA-SFHVURJKSA-N	-1	3	326.421	1.012	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]c2ccc3n[nH]nc3c2)cc1[N+](=O)[O-]	ZINC000176528437	237343911	/nfs/dbraw/zinc/34/39/11/237343911.db2.gz	FWXZRQHQPBLXSF-UHFFFAOYSA-N	-1	3	333.329	1.975	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]c2ccc3[nH]nnc3c2)cc1[N+](=O)[O-]	ZINC000176528437	237343921	/nfs/dbraw/zinc/34/39/21/237343921.db2.gz	FWXZRQHQPBLXSF-UHFFFAOYSA-N	-1	3	333.329	1.975	20	5		EDBDHM
CO[C@H]([C@@H](C)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C1CC1	ZINC000451979660	305375971	/nfs/dbraw/zinc/37/59/71/305375971.db2.gz	CIKYLLUWENJMGC-QMTHXVAHSA-N	-1	3	328.390	1.995	20	5		EDBDHM
O=C([O-])CN1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1	ZINC000238160397	284448708	/nfs/dbraw/zinc/44/87/08/284448708.db2.gz	SUJYZPBRXSMYSI-UHFFFAOYSA-N	-1	3	333.266	1.820	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@H](O)COCC(C)C)c([N+](=O)[O-])c1	ZINC000443389957	254579768	/nfs/dbraw/zinc/57/97/68/254579768.db2.gz	SNOGDSHIQKANTE-LBPRGKRZSA-N	-1	3	346.405	1.215	20	5		EDBDHM
CC[C@@H]1C[C@H]1CNC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000456121595	254864706	/nfs/dbraw/zinc/86/47/06/254864706.db2.gz	XSTGZDIGNFTVIE-MNOVXSKESA-N	-1	3	341.389	1.035	20	5		EDBDHM
C[C@@H]1CN(C2CCN(C(=O)c3cc([O-])cc([N+](=O)[O-])c3)CC2)CCO1	ZINC000332381348	141172260	/nfs/dbraw/zinc/17/22/60/141172260.db2.gz	OKLPMAYZAGGFAV-GFCCVEGCSA-N	-1	3	349.387	1.626	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]CC2(CO)CCC2)cc1[N+](=O)[O-]	ZINC000332492623	141190608	/nfs/dbraw/zinc/19/06/08/141190608.db2.gz	TZWQGUQNBCRMIU-UHFFFAOYSA-N	-1	3	332.353	1.483	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2CCN(C3CC3)C2)c1[N+](=O)[O-]	ZINC000360259245	292087761	/nfs/dbraw/zinc/08/77/61/292087761.db2.gz	UNYGSAXZLHYLDG-LBPRGKRZSA-N	-1	3	339.417	1.727	20	5		EDBDHM
CS(=O)(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)c1	ZINC000345044938	143042951	/nfs/dbraw/zinc/04/29/51/143042951.db2.gz	WOMFQFJVPAKQCA-UHFFFAOYSA-N	-1	3	337.313	1.351	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@]2(C)CCC(=O)N2)cc1C	ZINC000416504105	304325733	/nfs/dbraw/zinc/32/57/33/304325733.db2.gz	ZADDVPARGYZAPM-CQSZACIVSA-N	-1	3	341.389	1.159	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H](C)C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000416625753	304338183	/nfs/dbraw/zinc/33/81/83/304338183.db2.gz	SJUKRHZXGVKCME-ZETCQYMHSA-N	-1	3	335.407	1.156	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-][C@@H]1CCO[C@@H]1C1CC1	ZINC000363977352	153112388	/nfs/dbraw/zinc/11/23/88/153112388.db2.gz	OMRVEVVKNLVWTL-TZMCWYRMSA-N	-1	3	326.374	1.582	20	5		EDBDHM
CS[C@@H](CO)[C@H](C)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276919879	268497203	/nfs/dbraw/zinc/49/72/03/268497203.db2.gz	YRTLXKBHGPHNAO-QWRGUYRKSA-N	-1	3	348.446	1.602	20	5		EDBDHM
Cc1ncc(C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])s1	ZINC000273542313	273042903	/nfs/dbraw/zinc/04/29/03/273042903.db2.gz	XAIOPPADSLBYGM-UHFFFAOYSA-N	-1	3	327.387	1.979	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]Cc2ccoc2)cc1[N+](=O)[O-]	ZINC000186667305	272946239	/nfs/dbraw/zinc/94/62/39/272946239.db2.gz	CZSMVOSEEMGYJC-UHFFFAOYSA-N	-1	3	330.293	1.814	20	5		EDBDHM
COCCCN1CCC(NC(=O)c2cccc([O-])c2[N+](=O)[O-])CC1	ZINC000281056277	273430645	/nfs/dbraw/zinc/43/06/45/273430645.db2.gz	YCUAEOWBIACXMN-UHFFFAOYSA-N	-1	3	337.376	1.531	20	5		EDBDHM
CCN(CC[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C1CC1	ZINC000102184148	276131010	/nfs/dbraw/zinc/13/10/10/276131010.db2.gz	UXZIMQUTLNIQMH-UHFFFAOYSA-N	-1	3	343.405	1.366	20	5		EDBDHM
CN(C)CCN(CC(=O)[O-])C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-]	ZINC000492214209	289133787	/nfs/dbraw/zinc/13/37/87/289133787.db2.gz	NHHWGIYDTGGYHK-XQRVVYSFSA-N	-1	3	339.323	1.222	20	5		EDBDHM
CO[C@@](C)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000291669124	289144687	/nfs/dbraw/zinc/14/46/87/289144687.db2.gz	KEYIZQZKXNHKSG-ZDUSSCGKSA-N	-1	3	332.353	1.827	20	5		EDBDHM
CO[C@H]1CCC[C@H]1C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000341191061	294532215	/nfs/dbraw/zinc/53/22/15/294532215.db2.gz	NCPZCZKNMGTZIC-AAEUAGOBSA-N	-1	3	328.390	1.997	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H]1CCC[C@@H](O)C1	ZINC000121829528	302047514	/nfs/dbraw/zinc/04/75/14/302047514.db2.gz	KXQBGHOXUXZQQX-VXGBXAGGSA-N	-1	3	328.390	1.733	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000293892616	303034760	/nfs/dbraw/zinc/03/47/60/303034760.db2.gz	VIIKPRYURYBFJB-LBPRGKRZSA-N	-1	3	330.362	1.307	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)[C@H](O)C(F)F	ZINC000295712110	303256477	/nfs/dbraw/zinc/25/64/77/303256477.db2.gz	KWWMGECFQZTEKW-QWRGUYRKSA-N	-1	3	338.332	1.419	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])[C@H](O)C(F)F	ZINC000295761450	303263013	/nfs/dbraw/zinc/26/30/13/303263013.db2.gz	PEOQZQSGBSLUNI-WPRPVWTQSA-N	-1	3	338.332	1.586	20	5		EDBDHM
CC[C@@H](C)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC	ZINC000420701703	304775153	/nfs/dbraw/zinc/77/51/53/304775153.db2.gz	FAXBAKHZCUMIAF-SECBINFHSA-N	-1	3	330.362	1.706	20	5		EDBDHM
COc1ccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)cc1NC(N)=O	ZINC000429592201	305032789	/nfs/dbraw/zinc/03/27/89/305032789.db2.gz	LKVOJHWYFDQOIB-UHFFFAOYSA-N	-1	3	347.287	1.447	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1CC(C)(F)C1	ZINC000451634520	305357943	/nfs/dbraw/zinc/35/79/43/305357943.db2.gz	SIUORIIEHSHPSI-UHFFFAOYSA-N	-1	3	346.336	1.550	20	5		EDBDHM
COc1nccc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)n1	ZINC000451644927	305358759	/nfs/dbraw/zinc/35/87/59/305358759.db2.gz	WPTGHSUPYTZHMZ-UHFFFAOYSA-N	-1	3	344.374	1.242	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]Cc2nnc(C3CC3)[nH]2)c([N+](=O)[O-])c1	ZINC000451677023	305361634	/nfs/dbraw/zinc/36/16/34/305361634.db2.gz	HAAIVROGVYRBHV-UHFFFAOYSA-N	-1	3	337.361	1.377	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000535734694	306015637	/nfs/dbraw/zinc/01/56/37/306015637.db2.gz	AEWKIKAHZOEZJD-JTQLQIEISA-N	-1	3	341.327	1.385	20	5		EDBDHM
COCCCCC[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000058509237	441199794	/nfs/dbraw/zinc/19/97/94/441199794.db2.gz	GCLOZQKMBYOXRL-UHFFFAOYSA-N	-1	3	332.378	1.698	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCN(C3CCCC3)C2)s1	ZINC000106891224	441384842	/nfs/dbraw/zinc/38/48/42/441384842.db2.gz	VMWZRGLZDKORGA-SNVBAGLBSA-N	-1	3	345.446	1.952	20	5		EDBDHM
COC(=O)[C@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(C)C	ZINC000034620979	441600291	/nfs/dbraw/zinc/60/02/91/441600291.db2.gz	BVNGMVMZAFESGE-GFCCVEGCSA-N	-1	3	346.361	1.079	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCN3CCCC[C@H]23)c(F)c1	ZINC000055242283	441632941	/nfs/dbraw/zinc/63/29/41/441632941.db2.gz	QPQFOJBMUOPJPP-QWHCGFSZSA-N	-1	3	343.380	1.639	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCN(C(C)C)C1=O	ZINC000114743217	441681587	/nfs/dbraw/zinc/68/15/87/441681587.db2.gz	LEARAGSWHZQPDS-LLVKDONJSA-N	-1	3	341.389	1.191	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCC[N-]S(=O)(=O)c2cccs2)nc1	ZINC000120007014	441992395	/nfs/dbraw/zinc/99/23/95/441992395.db2.gz	URNHEZFGCOTKTA-UHFFFAOYSA-N	-1	3	328.375	1.442	20	5		EDBDHM
O=C(CC[C@H]1NC(=O)[N-]C1=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000610961659	450393351	/nfs/dbraw/zinc/39/33/51/450393351.db2.gz	KJEXHXOJZDAGHF-GFCCVEGCSA-N	-1	3	346.343	1.074	20	5		EDBDHM
CNC(=O)[C@@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(C)C	ZINC000178926512	442528177	/nfs/dbraw/zinc/52/81/77/442528177.db2.gz	NJZQZXLUHCHHTD-LBPRGKRZSA-N	-1	3	343.405	1.261	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CO)C(C)(C)C)c1C	ZINC000180372215	442588699	/nfs/dbraw/zinc/58/86/99/442588699.db2.gz	KUYBUVJMKYTQOE-GFCCVEGCSA-N	-1	3	330.406	1.897	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCNCc1cncs1	ZINC000136162831	442653523	/nfs/dbraw/zinc/65/35/23/442653523.db2.gz	DBTSTFGULDGERG-UHFFFAOYSA-N	-1	3	342.402	1.119	20	5		EDBDHM
CSC[C@H](C)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000265475054	442786386	/nfs/dbraw/zinc/78/63/86/442786386.db2.gz	MQOYKONAFCYXGD-QMMMGPOBSA-N	-1	3	348.402	1.396	20	5		EDBDHM
COC(=O)[C@@H](C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000269284071	443265734	/nfs/dbraw/zinc/26/57/34/443265734.db2.gz	LNMMQVWHHIDASU-ZETCQYMHSA-N	-1	3	336.753	1.336	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CCC[C@@H](C)O)cc1[N+](=O)[O-]	ZINC000278586459	443369043	/nfs/dbraw/zinc/36/90/43/443369043.db2.gz	BAENZFAYCUNEIR-MRVPVSSYSA-N	-1	3	336.341	1.182	20	5		EDBDHM
CCC[C@@H](C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OCC	ZINC000278805577	443445923	/nfs/dbraw/zinc/44/59/23/443445923.db2.gz	RURWFUOFPVGIRW-NSHDSACASA-N	-1	3	344.389	1.853	20	5		EDBDHM
COC[C@H]([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCO1	ZINC000279061141	443505020	/nfs/dbraw/zinc/50/50/20/443505020.db2.gz	AWQAQWNYQPNNRV-STQMWFEESA-N	-1	3	344.314	1.997	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H]2CCCN2C)c1[N+](=O)[O-]	ZINC000276802472	443833645	/nfs/dbraw/zinc/83/36/45/443833645.db2.gz	KWJDRFRGIPJMEC-LBPRGKRZSA-N	-1	3	327.406	1.584	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)c2ncnn2C)cc1C	ZINC000276751076	443812381	/nfs/dbraw/zinc/81/23/81/443812381.db2.gz	SWSUHAJHKUCTQK-SNVBAGLBSA-N	-1	3	339.377	1.380	20	5		EDBDHM
CCN(C)C(=O)[C@H](C)[N-]c1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000276891289	443866616	/nfs/dbraw/zinc/86/66/16/443866616.db2.gz	LHWUVOTUGXFTTH-ZETCQYMHSA-N	-1	3	335.407	1.339	20	5		EDBDHM
C[C@H]1COCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000277663566	444022768	/nfs/dbraw/zinc/02/27/68/444022768.db2.gz	FRMNBPXXSXOUBH-KWQFWETISA-N	-1	3	334.781	1.952	20	5		EDBDHM
O=C([N-][C@]1(CCO)CCOC1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000278111707	444098732	/nfs/dbraw/zinc/09/87/32/444098732.db2.gz	POJZZDBKDSUQEA-CYBMUJFWSA-N	-1	3	330.287	1.344	20	5		EDBDHM
O=C([O-])CCN(CCOc1cccc([N+](=O)[O-])c1)C[C@H]1CCCO1	ZINC000568059661	321274985	/nfs/dbraw/zinc/27/49/85/321274985.db2.gz	HUNZMZXUSQLGET-OAHLLOKOSA-N	-1	3	338.360	1.929	20	5		EDBDHM
O=C(NCCNc1cc(CO)ccc1[N+](=O)[O-])c1ccc([O-])cc1	ZINC000302071527	444203302	/nfs/dbraw/zinc/20/33/02/444203302.db2.gz	VWYYGKPQQNHSQU-UHFFFAOYSA-N	-1	3	331.328	1.635	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCCCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000322346532	444339716	/nfs/dbraw/zinc/33/97/16/444339716.db2.gz	DRFKYTLIGDQGCG-YPMHNXCESA-N	-1	3	344.389	1.575	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)N[C@@H]2CCN3CCCC[C@H]23)ccc1[O-]	ZINC000321396728	444335552	/nfs/dbraw/zinc/33/55/52/444335552.db2.gz	ZCJJSGWOUOXMEJ-VXGBXAGGSA-N	-1	3	341.389	1.206	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C2CCS(=O)CC2)c1[N+](=O)[O-]	ZINC000331086590	444388857	/nfs/dbraw/zinc/38/88/57/444388857.db2.gz	DGQDKTJSIDYBIG-UHFFFAOYSA-N	-1	3	346.430	1.401	20	5		EDBDHM
CO[C@@]1(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)CCOC1	ZINC000342488944	444712874	/nfs/dbraw/zinc/71/28/74/444712874.db2.gz	LQNKORYKRXXHCY-LLVKDONJSA-N	-1	3	336.391	1.049	20	5		EDBDHM
C[C@H](C[C@@H]1CCCO1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000338722703	444820711	/nfs/dbraw/zinc/82/07/11/444820711.db2.gz	BXKJSTCCZQDSPS-KOLCDFICSA-N	-1	3	332.353	1.970	20	5		EDBDHM
C[C@@H]1CCCCN1C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000330626973	445068101	/nfs/dbraw/zinc/06/81/01/445068101.db2.gz	WJLJBNSKQNMEDN-LLVKDONJSA-N	-1	3	341.389	1.274	20	5		EDBDHM
Cc1ccn2c(c1)nnc2NC(=O)c1n[n-]c2ccc([N+](=O)[O-])cc21	ZINC000354837664	445417952	/nfs/dbraw/zinc/41/79/52/445417952.db2.gz	CSYZIHFFUVQHGB-UHFFFAOYSA-N	-1	3	337.299	2.075	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C(C)C)C(C)(C)O)c([N+](=O)[O-])c1	ZINC000360108142	445571463	/nfs/dbraw/zinc/57/14/63/445571463.db2.gz	OEQHZYLMHZMRIW-CYBMUJFWSA-N	-1	3	346.405	1.677	20	5		EDBDHM
CCC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(=O)OC	ZINC000358610435	445674927	/nfs/dbraw/zinc/67/49/27/445674927.db2.gz	LOGNBSUSDNNVGV-SNVBAGLBSA-N	-1	3	346.361	1.223	20	5		EDBDHM
Cc1ccc(NC(=O)[C@@H]([N-]S(C)(=O)=O)C(C)C)cc1[N+](=O)[O-]	ZINC000349822187	445689484	/nfs/dbraw/zinc/68/94/84/445689484.db2.gz	VXZRKGGXFWRDAB-LBPRGKRZSA-N	-1	3	329.378	1.416	20	5		EDBDHM
Cc1nnc([C@H]2CCCCN2C(=O)c2cc(C)[n-]c(=O)c2[N+](=O)[O-])[nH]1	ZINC000368303947	446772168	/nfs/dbraw/zinc/77/21/68/446772168.db2.gz	JERKHKXVQBFNNL-LLVKDONJSA-N	-1	3	346.347	1.798	20	5		EDBDHM
Cc1nc([C@H]2CCCCN2C(=O)c2cc(C)[n-]c(=O)c2[N+](=O)[O-])n[nH]1	ZINC000368303947	446772173	/nfs/dbraw/zinc/77/21/73/446772173.db2.gz	JERKHKXVQBFNNL-LLVKDONJSA-N	-1	3	346.347	1.798	20	5		EDBDHM
CC[C@@H](C)[C@@H](O)C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000443275830	447022604	/nfs/dbraw/zinc/02/26/04/447022604.db2.gz	YFJFCMCJFMSIHT-KCJUWKMLSA-N	-1	3	336.797	1.934	20	5		EDBDHM
O=C(Nc1cccc([C@@H]2CNC(=O)C2)c1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000444963237	447149257	/nfs/dbraw/zinc/14/92/57/447149257.db2.gz	GDKQHVCWCHYOBI-JTQLQIEISA-N	-1	3	342.311	1.551	20	5		EDBDHM
CC[C@H](O)CCC[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000398476081	447557353	/nfs/dbraw/zinc/55/73/53/447557353.db2.gz	AUPHPVMQDGOXBV-NSHDSACASA-N	-1	3	332.378	1.433	20	5		EDBDHM
CC(C)(O)C[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000416451536	447607256	/nfs/dbraw/zinc/60/72/56/447607256.db2.gz	AVNTYINIYNSTCF-UHFFFAOYSA-N	-1	3	342.295	1.663	20	5		EDBDHM
COCC[C@@H](C)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000416586998	447655318	/nfs/dbraw/zinc/65/53/18/447655318.db2.gz	PJSLAMKLZOFFHN-SNVBAGLBSA-N	-1	3	332.378	1.554	20	5		EDBDHM
CC[C@H](C)[C@@H](C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])OC	ZINC000451671197	447745411	/nfs/dbraw/zinc/74/54/11/447745411.db2.gz	FKJKQSYMFWZBIW-GXFFZTMASA-N	-1	3	346.405	1.943	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)NC	ZINC000452085625	447813945	/nfs/dbraw/zinc/81/39/45/447813945.db2.gz	OAESZCBRCBDBFG-VIFPVBQESA-N	-1	3	335.769	1.051	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2CO)c1[N+](=O)[O-]	ZINC000452025998	447802683	/nfs/dbraw/zinc/80/26/83/447802683.db2.gz	ANMBXRSFVOWHGA-VXGBXAGGSA-N	-1	3	328.390	1.651	20	5		EDBDHM
CN1C(=O)CCc2cc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)ccc21	ZINC000530381715	447874712	/nfs/dbraw/zinc/87/47/12/447874712.db2.gz	RYXTWALLKMDOAC-UHFFFAOYSA-N	-1	3	342.311	1.857	20	5		EDBDHM
C[C@@H](CN1CCC[C@H](C)C1)[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000530491838	447898982	/nfs/dbraw/zinc/89/89/82/447898982.db2.gz	CIZZEKFMOKCGGE-RYUDHWBXSA-N	-1	3	342.421	1.389	20	5		EDBDHM
C[C@@H]1CCN(CC[N-]S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1	ZINC000524791028	447955561	/nfs/dbraw/zinc/95/55/61/447955561.db2.gz	QKMMDDOEOPYTRW-SNVBAGLBSA-N	-1	3	347.824	1.868	20	5		EDBDHM
CN1CCN(CCNc2nccc(C(=O)[O-])c2[N+](=O)[O-])CC1(C)C	ZINC000567275351	448656178	/nfs/dbraw/zinc/65/61/78/448656178.db2.gz	GVSXUTGGWBOMGS-UHFFFAOYSA-N	-1	3	337.380	1.126	20	5		EDBDHM
CC[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(=O)OC	ZINC000592077312	448664670	/nfs/dbraw/zinc/66/46/70/448664670.db2.gz	MVPGDCDIJDLTRB-VIFPVBQESA-N	-1	3	346.361	1.081	20	5		EDBDHM
CC[C@@H](C)C[C@H](CO)[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000592085359	448672042	/nfs/dbraw/zinc/67/20/42/448672042.db2.gz	YXYOTPQVCMCZFC-GHMZBOCLSA-N	-1	3	346.405	1.679	20	5		EDBDHM
Cn1cnc(S(=O)(=O)[N-]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)c1	ZINC000588907038	448948750	/nfs/dbraw/zinc/94/87/50/448948750.db2.gz	QHZPZPQWFYEISN-UHFFFAOYSA-N	-1	3	349.372	1.331	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H](c2cccnc2)C2CC2)nc1	ZINC000593570365	449079636	/nfs/dbraw/zinc/07/96/36/449079636.db2.gz	DNIWJGMEHXPEAS-AWEZNQCLSA-N	-1	3	334.357	1.814	20	5		EDBDHM
CCN1C[C@@H](C[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])CC1=O	ZINC000593641798	449125699	/nfs/dbraw/zinc/12/56/99/449125699.db2.gz	SHRHZZQAENWCEX-LLVKDONJSA-N	-1	3	341.389	1.050	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCc2ccccn2)c(F)cc1[N+](=O)[O-]	ZINC000590588973	449203268	/nfs/dbraw/zinc/20/32/68/449203268.db2.gz	FULWOBYJAQMSBC-UHFFFAOYSA-N	-1	3	339.348	1.958	20	5		EDBDHM
C[C@@H](NCc1nc2c(cnn2C)c(=O)[n-]1)c1cccc([N+](=O)[O-])c1	ZINC000611383724	449277479	/nfs/dbraw/zinc/27/74/79/449277479.db2.gz	PZVVNYJWUJGPDM-SECBINFHSA-N	-1	3	328.332	1.828	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H](CCO)C2CCCCC2)nc1	ZINC000593553755	449344187	/nfs/dbraw/zinc/34/41/87/449344187.db2.gz	PDNGJCDGWJDJLE-ZDUSSCGKSA-N	-1	3	343.405	1.599	20	5		EDBDHM
CC[C@H](CO)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594763116	449676486	/nfs/dbraw/zinc/67/64/86/449676486.db2.gz	VZQKXZZZGOGWGN-SECBINFHSA-N	-1	3	325.346	1.192	20	5		EDBDHM
CC[C@](C)(O)C[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594762973	449676747	/nfs/dbraw/zinc/67/67/47/449676747.db2.gz	RMVBOCCDBHAPQE-AWEZNQCLSA-N	-1	3	339.373	1.582	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CCC[C@H](C)O1	ZINC000594849978	449757408	/nfs/dbraw/zinc/75/74/08/449757408.db2.gz	BJSRVXFSPXDLBJ-CMPLNLGQSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN2CC[C@H](C)C2)c([N+](=O)[O-])s1	ZINC000601362883	449876133	/nfs/dbraw/zinc/87/61/33/449876133.db2.gz	XVFCHOWCFDEEPH-VIFPVBQESA-N	-1	3	333.435	1.585	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)CCNc2ccccc2[N+](=O)[O-])[n-]1	ZINC000617872623	449889887	/nfs/dbraw/zinc/88/98/87/449889887.db2.gz	WQNXUZFXLMHRMX-UHFFFAOYSA-N	-1	3	347.331	1.935	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)CCNc2ccccc2[N+](=O)[O-])c[n-]1	ZINC000617872623	449889892	/nfs/dbraw/zinc/88/98/92/449889892.db2.gz	WQNXUZFXLMHRMX-UHFFFAOYSA-N	-1	3	347.331	1.935	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](O)[C@@H]2CCCO2)cc1C	ZINC000599390279	449937967	/nfs/dbraw/zinc/93/79/67/449937967.db2.gz	AHDKEJQSYJKJOO-STQMWFEESA-N	-1	3	344.389	1.030	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCc1nc(CN)cc(=O)[n-]1	ZINC000595232841	449963229	/nfs/dbraw/zinc/96/32/29/449963229.db2.gz	BHNRQRDXFOENNH-UHFFFAOYSA-N	-1	3	346.347	1.488	20	5		EDBDHM
C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000599459381	449992601	/nfs/dbraw/zinc/99/26/01/449992601.db2.gz	IJZJURCFUHFBRH-DYNIEEOBSA-N	-1	3	328.390	1.826	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1[C@H](C)O[C@H](C)[C@H]1C	ZINC000599460559	449994253	/nfs/dbraw/zinc/99/42/53/449994253.db2.gz	ZCLIPAZAIUKTTL-DNJQJEMRSA-N	-1	3	344.389	1.694	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CO[C@@H](C2CC2)C1	ZINC000599484005	450012197	/nfs/dbraw/zinc/01/21/97/450012197.db2.gz	JWVQAZSIYLMAFT-GXFFZTMASA-N	-1	3	342.373	1.449	20	5		EDBDHM
CCCN1CC[C@@H]([N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C1	ZINC000595353376	450067557	/nfs/dbraw/zinc/06/75/57/450067557.db2.gz	HHRGPZLKPTXQJM-CYBMUJFWSA-N	-1	3	341.433	1.974	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000609677767	450084014	/nfs/dbraw/zinc/08/40/14/450084014.db2.gz	MARDMAWSCGKPID-SECBINFHSA-N	-1	3	339.739	1.882	20	5		EDBDHM
COC(=O)[C@H]1C[C@H]([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C1	ZINC000595401272	450115284	/nfs/dbraw/zinc/11/52/84/450115284.db2.gz	DDZWRYXQVQPVMB-ZKCHVHJHSA-N	-1	3	334.375	1.195	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1C[C@@H](O)C1(C)C	ZINC000619498125	450492722	/nfs/dbraw/zinc/49/27/22/450492722.db2.gz	YKIMOALRRPDJQH-WDEREUQCSA-N	-1	3	330.362	1.041	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)[C@@H]1CCCO1	ZINC000339448939	535806999	/nfs/dbraw/zinc/80/69/99/535806999.db2.gz	JLEYQCQGMOPOLI-NEPJUHHUSA-N	-1	3	344.389	1.839	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)c1ccc[nH]1	ZINC000760406950	580030101	/nfs/dbraw/zinc/03/01/01/580030101.db2.gz	VAJVMGVCONHADD-VIFPVBQESA-N	-1	3	325.346	1.971	20	5		EDBDHM
C[C@@H](CNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])CC1(C)OCCO1	ZINC000736025556	578947408	/nfs/dbraw/zinc/94/74/08/578947408.db2.gz	IHCKEEWGALUSOS-SNVBAGLBSA-N	-1	3	348.363	1.976	20	5		EDBDHM
C[C@@H](CNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])CC1(C)OCCO1	ZINC000736025556	578947409	/nfs/dbraw/zinc/94/74/09/578947409.db2.gz	IHCKEEWGALUSOS-SNVBAGLBSA-N	-1	3	348.363	1.976	20	5		EDBDHM
Cc1ccc([C@@H](O)CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])o1	ZINC000737319292	579071469	/nfs/dbraw/zinc/07/14/69/579071469.db2.gz	GYHPQTADIMSOEY-LBPRGKRZSA-N	-1	3	330.304	1.822	20	5		EDBDHM
Cc1ccc([C@@H](O)CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])o1	ZINC000737319292	579071470	/nfs/dbraw/zinc/07/14/70/579071470.db2.gz	GYHPQTADIMSOEY-LBPRGKRZSA-N	-1	3	330.304	1.822	20	5		EDBDHM
O=C([O-])/C=C/c1ccc(NCCCN2CCC(O)CC2)c([N+](=O)[O-])c1	ZINC000739625409	579227915	/nfs/dbraw/zinc/22/79/15/579227915.db2.gz	PNIVYUSILUQLOT-HWKANZROSA-N	-1	3	349.387	1.951	20	5		EDBDHM
COCCO[N-]C(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-]	ZINC000748776479	579699929	/nfs/dbraw/zinc/69/99/29/579699929.db2.gz	LEEWCLIVKHDZOT-UHFFFAOYSA-N	-1	3	336.247	1.513	20	5		EDBDHM
Cn1cnc(S(=O)(=O)[N-]Cc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000757349666	579967107	/nfs/dbraw/zinc/96/71/07/579967107.db2.gz	WPPLAZWEKAQJJF-UHFFFAOYSA-N	-1	3	330.753	1.460	20	5		EDBDHM
CC(C)c1nc(S(=O)(=O)[N-]N=c2[nH]cccc2[N+](=O)[O-])c[nH]1	ZINC000759168595	580000003	/nfs/dbraw/zinc/00/00/03/580000003.db2.gz	GUNWLJJOOLFBHJ-UHFFFAOYSA-N	-1	3	326.338	1.142	20	5		EDBDHM
CC(C)c1nc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])c[nH]1	ZINC000759168595	580000004	/nfs/dbraw/zinc/00/00/04/580000004.db2.gz	GUNWLJJOOLFBHJ-UHFFFAOYSA-N	-1	3	326.338	1.142	20	5		EDBDHM
CCOC(=O)[C@@H](C)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000765169482	580136550	/nfs/dbraw/zinc/13/65/50/580136550.db2.gz	AKPQFSJEBLZLEA-SNVBAGLBSA-N	-1	3	330.362	1.442	20	5		EDBDHM
Cn1nnnc1[N-]C(=O)Cn1c2ccccc2c(=O)c2ccccc21	ZINC000779467524	580486400	/nfs/dbraw/zinc/48/64/00/580486400.db2.gz	SUKULSHPPOZHHG-UHFFFAOYSA-N	-1	3	334.339	1.317	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CCN2CCC2)c1	ZINC000779914554	580502546	/nfs/dbraw/zinc/50/25/46/580502546.db2.gz	CHYBPTMRIOVJSL-UHFFFAOYSA-N	-1	3	333.797	1.541	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CCCCC(N)=O)c1	ZINC000781735302	580556099	/nfs/dbraw/zinc/55/60/99/580556099.db2.gz	DYRYKMAZSSXXJL-UHFFFAOYSA-N	-1	3	349.796	1.491	20	5		EDBDHM
Nc1ccc(N2CCN(C(=O)c3cccc([O-])c3)CC2)c([N+](=O)[O-])c1	ZINC000786789606	580679277	/nfs/dbraw/zinc/67/92/77/580679277.db2.gz	HEBVOTOQHDBPMS-UHFFFAOYSA-N	-1	3	342.355	1.845	20	5		EDBDHM
COc1c([O-])ccc(CN2CC[C@H](N3CCCC3=O)C2)c1[N+](=O)[O-]	ZINC000893982426	591156192	/nfs/dbraw/zinc/15/61/92/591156192.db2.gz	AEKATTWHOCYCJP-LBPRGKRZSA-N	-1	3	335.360	1.506	20	5		EDBDHM
C[C@H]1CC2(CC([N-]S(=O)(=O)c3csc([N+](=O)[O-])c3)C2)CO1	ZINC000907727994	592772958	/nfs/dbraw/zinc/77/29/58/592772958.db2.gz	XCGICFXJKVYPER-QTZUAFFRSA-N	-1	3	332.403	1.892	20	5		EDBDHM
CN(CCCN1CCN(C)CC1)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000910358154	592843357	/nfs/dbraw/zinc/84/33/57/592843357.db2.gz	QWYKLWHTVQJOCC-UHFFFAOYSA-N	-1	3	336.392	1.367	20	5		EDBDHM
CCOC(=O)[C@@H](CC1CC1)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768847541	593442749	/nfs/dbraw/zinc/44/27/49/593442749.db2.gz	PESAWONCFCAEOD-SNVBAGLBSA-N	-1	3	348.402	1.666	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C2(CCO)CC2)c1	ZINC000814280890	593581455	/nfs/dbraw/zinc/58/14/55/593581455.db2.gz	KQOVUZPMDKGHPM-UHFFFAOYSA-N	-1	3	334.781	1.750	20	5		EDBDHM
CC(C)(C)N1C[C@H](Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1=O	ZINC000819913927	593776819	/nfs/dbraw/zinc/77/68/19/593776819.db2.gz	HSWXYJRRQQGEEL-SNVBAGLBSA-N	-1	3	345.363	1.586	20	5		EDBDHM
CC(C)(C)N1C[C@H](Nc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1=O	ZINC000819913927	593776820	/nfs/dbraw/zinc/77/68/20/593776820.db2.gz	HSWXYJRRQQGEEL-SNVBAGLBSA-N	-1	3	345.363	1.586	20	5		EDBDHM
C[C@@H]1CN(C2CC2)C[C@H]1Nc1nccc(-c2nnn[n-]2)c1[N+](=O)[O-]	ZINC000820751927	593881403	/nfs/dbraw/zinc/88/14/03/593881403.db2.gz	IVKXQTUYRLKUIZ-LDYMZIIASA-N	-1	3	330.352	1.065	20	5		EDBDHM
COc1ccc(Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)c(OC)c1	ZINC000821838866	593952169	/nfs/dbraw/zinc/95/21/69/593952169.db2.gz	QSWZYTPHPCVSAK-UHFFFAOYSA-N	-1	3	343.303	1.931	20	5		EDBDHM
COc1ccc(Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)c(OC)c1	ZINC000821838866	593952171	/nfs/dbraw/zinc/95/21/71/593952171.db2.gz	QSWZYTPHPCVSAK-UHFFFAOYSA-N	-1	3	343.303	1.931	20	5		EDBDHM
C[C@@H](OC(=O)c1c([N+](=O)[O-])cnn1C)c1cccc(-c2nnn[n-]2)c1	ZINC000824712861	594060578	/nfs/dbraw/zinc/06/05/78/594060578.db2.gz	DTHDAXXEABIDGR-MRVPVSSYSA-N	-1	3	343.303	1.426	20	5		EDBDHM
C[C@@H](OC(=O)c1c([N+](=O)[O-])cnn1C)c1cccc(-c2nn[n-]n2)c1	ZINC000824712861	594060579	/nfs/dbraw/zinc/06/05/79/594060579.db2.gz	DTHDAXXEABIDGR-MRVPVSSYSA-N	-1	3	343.303	1.426	20	5		EDBDHM
COc1c(I)cc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000826167354	594358667	/nfs/dbraw/zinc/35/86/67/594358667.db2.gz	ZVQGKTJQSKDLRX-UHFFFAOYSA-N	-1	3	347.072	1.388	20	5		EDBDHM
COc1c(I)cc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000826167354	594358669	/nfs/dbraw/zinc/35/86/69/594358669.db2.gz	ZVQGKTJQSKDLRX-UHFFFAOYSA-N	-1	3	347.072	1.388	20	5		EDBDHM
COc1ccc(CN(C)c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)cn1	ZINC000826193127	594371758	/nfs/dbraw/zinc/37/17/58/594371758.db2.gz	QUHCMBGTYZOLHL-UHFFFAOYSA-N	-1	3	341.331	1.815	20	5		EDBDHM
COc1ccc(CN(C)c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)cn1	ZINC000826193127	594371762	/nfs/dbraw/zinc/37/17/62/594371762.db2.gz	QUHCMBGTYZOLHL-UHFFFAOYSA-N	-1	3	341.331	1.815	20	5		EDBDHM
COc1ccc(CNc2cnccc2-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000826203886	594376971	/nfs/dbraw/zinc/37/69/71/594376971.db2.gz	KQSCZJIPERMSPW-UHFFFAOYSA-N	-1	3	327.304	1.791	20	5		EDBDHM
COc1ccc(CNc2cnccc2-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000826203886	594376973	/nfs/dbraw/zinc/37/69/73/594376973.db2.gz	KQSCZJIPERMSPW-UHFFFAOYSA-N	-1	3	327.304	1.791	20	5		EDBDHM
Cc1cc(-c2nnn[n-]2)ccc1C(=O)OCCn1cc([N+](=O)[O-])cn1	ZINC000826252149	594399425	/nfs/dbraw/zinc/39/94/25/594399425.db2.gz	QXFUYJLRHVEOMQ-UHFFFAOYSA-N	-1	3	343.303	1.137	20	5		EDBDHM
Cc1cc(-c2nn[n-]n2)ccc1C(=O)OCCn1cc([N+](=O)[O-])cn1	ZINC000826252149	594399428	/nfs/dbraw/zinc/39/94/28/594399428.db2.gz	QXFUYJLRHVEOMQ-UHFFFAOYSA-N	-1	3	343.303	1.137	20	5		EDBDHM
O=[N+]([O-])c1c(-c2nnn[n-]2)ccnc1NCCCCn1ccnc1	ZINC000826497612	594501898	/nfs/dbraw/zinc/50/18/98/594501898.db2.gz	NIXLLUVGQXCTBB-UHFFFAOYSA-N	-1	3	329.324	1.259	20	5		EDBDHM
O=[N+]([O-])c1c(-c2nn[n-]n2)ccnc1NCCCCn1ccnc1	ZINC000826497612	594501901	/nfs/dbraw/zinc/50/19/01/594501901.db2.gz	NIXLLUVGQXCTBB-UHFFFAOYSA-N	-1	3	329.324	1.259	20	5		EDBDHM
O=[N+]([O-])c1ccc([C@@H](O)COc2cccc(-c3nnn[n-]3)c2)cc1	ZINC000826498204	594502590	/nfs/dbraw/zinc/50/25/90/594502590.db2.gz	LGQLTRNDXQSUEE-AWEZNQCLSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1ccc([C@@H](O)COc2cccc(-c3nn[n-]n3)c2)cc1	ZINC000826498204	594502593	/nfs/dbraw/zinc/50/25/93/594502593.db2.gz	LGQLTRNDXQSUEE-AWEZNQCLSA-N	-1	3	327.300	1.887	20	5		EDBDHM
Cc1n[nH]cc1CCC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000831539652	594681811	/nfs/dbraw/zinc/68/18/11/594681811.db2.gz	TVZGKVSGSIHHAQ-UHFFFAOYSA-N	-1	3	330.391	1.599	20	5		EDBDHM
O=C([O-])N1CC[C@@H](CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1	ZINC000831875371	594708700	/nfs/dbraw/zinc/70/87/00/594708700.db2.gz	WOZCEMYBJXBGSV-NWDGAFQWSA-N	-1	3	335.364	1.476	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl)[C@@H](C)O	ZINC000832308736	594741812	/nfs/dbraw/zinc/74/18/12/594741812.db2.gz	CTLCCEQBNOBASD-RKDXNWHRSA-N	-1	3	336.797	1.994	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)NCC(C)(C)C(=O)[O-]	ZINC000832482065	594753539	/nfs/dbraw/zinc/75/35/39/594753539.db2.gz	WQDDEZBLBZDXFR-VIFPVBQESA-N	-1	3	339.348	1.631	20	5		EDBDHM
CCOC(=O)c1cc(C(=O)OCCn2cc([N+](=O)[O-])cn2)[n-]c1C	ZINC000837874933	595217152	/nfs/dbraw/zinc/21/71/52/595217152.db2.gz	HWSSOFCAYHFUQR-UHFFFAOYSA-N	-1	3	336.304	1.462	20	5		EDBDHM
COC(=O)CC1([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000844799652	595398007	/nfs/dbraw/zinc/39/80/07/595398007.db2.gz	JTCAFNMAFGPHKS-UHFFFAOYSA-N	-1	3	328.271	1.899	20	5		EDBDHM
CC(C)(C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1)C(N)=O	ZINC000848580828	595408048	/nfs/dbraw/zinc/40/80/48/595408048.db2.gz	FZOZOIUFQJNCPA-UHFFFAOYSA-N	-1	3	331.275	1.194	20	5		EDBDHM
COC(=O)C1(C[N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)CC1	ZINC000848587755	595410589	/nfs/dbraw/zinc/41/05/89/595410589.db2.gz	LAUDOJLSDVQAQV-UHFFFAOYSA-N	-1	3	344.270	1.636	20	5		EDBDHM
C[C@H]([N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)C(=O)N(C)C	ZINC000848592007	595411862	/nfs/dbraw/zinc/41/18/62/595411862.db2.gz	FSVVJMMZFGRBJR-QMMMGPOBSA-N	-1	3	331.275	1.159	20	5		EDBDHM
Nc1nccc(C(=O)OCc2cc(=O)[n-]c(C3CC3)n2)c1[N+](=O)[O-]	ZINC000848790485	595448518	/nfs/dbraw/zinc/44/85/18/595448518.db2.gz	OZIYGHWZYMKPNT-UHFFFAOYSA-N	-1	3	331.288	1.302	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1C=CCC1	ZINC000849428485	595524959	/nfs/dbraw/zinc/52/49/59/595524959.db2.gz	RZHASBFLDZBULA-VIFPVBQESA-N	-1	3	326.330	1.378	20	5		EDBDHM
CC(C)(COC(=O)c1ccc(F)c([N-]S(C)(=O)=O)c1)[N+](=O)[O-]	ZINC000851127796	595736644	/nfs/dbraw/zinc/73/66/44/595736644.db2.gz	WNEZIPXEKNEUNE-UHFFFAOYSA-N	-1	3	334.325	1.409	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C2([C@@H](C)O)CC2)cc1[N+](=O)[O-]	ZINC000851831084	595939933	/nfs/dbraw/zinc/93/99/33/595939933.db2.gz	LLCVBAFTUOFTJT-MRVPVSSYSA-N	-1	3	334.781	1.748	20	5		EDBDHM
CC(=CC(=O)NCCCc1cc(=O)[nH][n-]1)c1ccc([N+](=O)[O-])cc1	ZINC000854485994	596095047	/nfs/dbraw/zinc/09/50/47/596095047.db2.gz	ISINFHKEMHOZEL-PKNBQFBNSA-N	-1	3	330.344	1.770	20	5		EDBDHM
CCOC1CC2(C[C@@H]2[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000872654573	597012358	/nfs/dbraw/zinc/01/23/58/597012358.db2.gz	XABJNYQEJIKNIS-AWAWDMARSA-N	-1	3	344.364	1.970	20	5		EDBDHM
CCOC(=O)CC[C@@H](C)Nc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825507241	608018871	/nfs/dbraw/zinc/01/88/71/608018871.db2.gz	PLRQJSAZKYURPI-MRVPVSSYSA-N	-1	3	335.324	1.314	20	5		EDBDHM
CCOC(=O)CC[C@@H](C)Nc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825507241	608018872	/nfs/dbraw/zinc/01/88/72/608018872.db2.gz	PLRQJSAZKYURPI-MRVPVSSYSA-N	-1	3	335.324	1.314	20	5		EDBDHM
O=C([N-]OCc1cccnc1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21	ZINC000153246221	695586282	/nfs/dbraw/zinc/58/62/82/695586282.db2.gz	LPFDTPAJKITCIS-UHFFFAOYSA-N	-1	3	340.295	1.693	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1cscn1	ZINC000051159715	214080793	/nfs/dbraw/zinc/08/07/93/214080793.db2.gz	XXBXFTSBKQGZOP-UHFFFAOYSA-N	-1	3	329.359	1.538	20	5		EDBDHM
Cn1cnc([N-]C(=O)c2cc([N+](=O)[O-])ccc2Sc2nc[nH]n2)n1	ZINC000558353142	306237037	/nfs/dbraw/zinc/23/70/37/306237037.db2.gz	OXEJCPAAGWMJRN-UHFFFAOYSA-N	-1	3	346.332	1.245	20	5		EDBDHM
CCCN1CCC([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000055221483	138146385	/nfs/dbraw/zinc/14/63/85/138146385.db2.gz	ZGYILXWLRLVWOQ-UHFFFAOYSA-N	-1	3	345.396	1.887	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@@]2(C)CCOC2)cc1[N+](=O)[O-]	ZINC000491611050	255132153	/nfs/dbraw/zinc/13/21/53/255132153.db2.gz	WWSQMPLZMXNCDR-CYBMUJFWSA-N	-1	3	348.352	1.447	20	5		EDBDHM
COCC[C@H](C)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000263983934	139373976	/nfs/dbraw/zinc/37/39/76/139373976.db2.gz	HEQOXTFXKGNEHV-VIFPVBQESA-N	-1	3	346.361	1.069	20	5		EDBDHM
C[S@](=O)CCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000116901897	221009160	/nfs/dbraw/zinc/00/91/60/221009160.db2.gz	JFUDGMIUPBCHFM-LJQANCHMSA-N	-1	3	340.810	1.295	20	5		EDBDHM
C[S@](=O)CCC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000116901540	221009635	/nfs/dbraw/zinc/00/96/35/221009635.db2.gz	XKWSYZRHXXJHQO-LJQANCHMSA-N	-1	3	340.810	1.295	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@](C)(O)C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000270485282	140109221	/nfs/dbraw/zinc/10/92/21/140109221.db2.gz	KEFUZQZYDJRBCM-JTQLQIEISA-N	-1	3	342.295	1.495	20	5		EDBDHM
COC(=O)c1cncc([N-]C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])c1	ZINC000271146790	140245838	/nfs/dbraw/zinc/24/58/38/140245838.db2.gz	RQVUQLMQCNYIPP-UHFFFAOYSA-N	-1	3	333.304	1.875	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC(C)(C)CCCO	ZINC000271642604	140325712	/nfs/dbraw/zinc/32/57/12/140325712.db2.gz	GRZCWUHTXNHJDF-UHFFFAOYSA-N	-1	3	330.406	1.980	20	5		EDBDHM
CC[C@H](CO)[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000416459263	304322201	/nfs/dbraw/zinc/32/22/01/304322201.db2.gz	RPUKIBGMFBKEAT-MRVPVSSYSA-N	-1	3	342.295	1.663	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H](CO)C(C)C	ZINC000344837709	143018082	/nfs/dbraw/zinc/01/80/82/143018082.db2.gz	VWRZSQFWSGLTNJ-SNVBAGLBSA-N	-1	3	332.378	1.146	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ccn(C)n1	ZINC000416560597	304331699	/nfs/dbraw/zinc/33/16/99/304331699.db2.gz	NHXCNLCOXXQKKI-QMMMGPOBSA-N	-1	3	328.325	1.507	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@](C)(C(N)=O)C(C)C)c([N+](=O)[O-])c1	ZINC000352595648	292185378	/nfs/dbraw/zinc/18/53/78/292185378.db2.gz	BKIDPGRXDRTMGM-ZDUSSCGKSA-N	-1	3	329.378	1.082	20	5		EDBDHM
CN(C)c1cccnc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000352728356	149132454	/nfs/dbraw/zinc/13/24/54/149132454.db2.gz	HRTJFINKNQBRCS-UHFFFAOYSA-N	-1	3	342.402	1.596	20	5		EDBDHM
COCC(COC)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000451893728	292205867	/nfs/dbraw/zinc/20/58/67/292205867.db2.gz	YCGPIMWWAKMMNK-UHFFFAOYSA-N	-1	3	332.378	1.151	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCC1CCOCC1	ZINC000358415276	151367272	/nfs/dbraw/zinc/36/72/72/151367272.db2.gz	SSSFVPAQJUMAHE-UHFFFAOYSA-N	-1	3	344.389	1.698	20	5		EDBDHM
CCn1ncnc1C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000360375288	152010999	/nfs/dbraw/zinc/01/09/99/152010999.db2.gz	DSMWHUSQVUKEEJ-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
Cc1c(CNC(=O)c2ccc3c(c2)C(=O)[N-]C3=O)cccc1[N+](=O)[O-]	ZINC000360524325	152079739	/nfs/dbraw/zinc/07/97/39/152079739.db2.gz	GPNDTAZOHUUTQU-UHFFFAOYSA-N	-1	3	339.307	1.717	20	5		EDBDHM
O=C1C[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@H]2CCCCN12	ZINC000367184710	154033865	/nfs/dbraw/zinc/03/38/65/154033865.db2.gz	HECLUVAPCWFOOG-WDEREUQCSA-N	-1	3	339.373	1.027	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@H]2CCOC[C@H]2C)cc1[N+](=O)[O-]	ZINC000352320796	162115497	/nfs/dbraw/zinc/11/54/97/162115497.db2.gz	SYVFWNWYXIDLIP-PSASIEDQSA-N	-1	3	334.419	1.916	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCN2CCSCC2)c([N+](=O)[O-])c1	ZINC000352469544	162199434	/nfs/dbraw/zinc/19/94/34/162199434.db2.gz	DGNJPJXPMIRAFJ-UHFFFAOYSA-N	-1	3	345.446	1.230	20	5		EDBDHM
CCCN1CCC[C@@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000352501729	162215609	/nfs/dbraw/zinc/21/56/09/162215609.db2.gz	WVWNOLWELFEKAQ-GFCCVEGCSA-N	-1	3	345.396	1.887	20	5		EDBDHM
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NCc1ncccc1[O-]	ZINC000352518357	162226004	/nfs/dbraw/zinc/22/60/04/162226004.db2.gz	XAZROTBYCVTHMI-UHFFFAOYSA-N	-1	3	344.327	1.132	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CO)CC(C)C)c1C	ZINC000158401510	225007529	/nfs/dbraw/zinc/00/75/29/225007529.db2.gz	COOZWFIBLFDOFW-LBPRGKRZSA-N	-1	3	330.406	1.897	20	5		EDBDHM
NC(=O)c1ccc([N-]S(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1	ZINC000133392436	287538761	/nfs/dbraw/zinc/53/87/61/287538761.db2.gz	PDYMPUXALBAMMU-UHFFFAOYSA-N	-1	3	349.368	1.678	20	5		EDBDHM
COCC[C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC	ZINC000273608581	268064524	/nfs/dbraw/zinc/06/45/24/268064524.db2.gz	SRQHZYBUNBHUCJ-SECBINFHSA-N	-1	3	346.361	1.085	20	5		EDBDHM
CCOC(=O)N1CC[C@H](NCc2cc(OC)c([O-])cc2[N+](=O)[O-])C1	ZINC000274619188	268170202	/nfs/dbraw/zinc/17/02/02/268170202.db2.gz	VUNJDRZZDVZCRO-NSHDSACASA-N	-1	3	339.348	1.629	20	5		EDBDHM
CN(C)[C@@]1(CNC(=O)c2ccc([N+](=O)[O-])cc2[O-])CCSC1	ZINC000274732185	268193520	/nfs/dbraw/zinc/19/35/20/268193520.db2.gz	WVBWAZQERKNEDN-CQSZACIVSA-N	-1	3	325.390	1.468	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCOC[C@@H]1C	ZINC000278065871	273245826	/nfs/dbraw/zinc/24/58/26/273245826.db2.gz	YZBBVWWTPDPKEO-GXSJLCMTSA-N	-1	3	330.362	1.307	20	5		EDBDHM
CCN(CC(C)C)C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000280702692	273387604	/nfs/dbraw/zinc/38/76/04/273387604.db2.gz	FNLJEAOZRLLLMV-UHFFFAOYSA-N	-1	3	343.405	1.378	20	5		EDBDHM
COC(=O)c1cc(C)nc(N2CCc3nc[n-]c(=O)c3C2)c1[N+](=O)[O-]	ZINC000283958121	274026243	/nfs/dbraw/zinc/02/62/43/274026243.db2.gz	YRVJJYYPNLDBQG-UHFFFAOYSA-N	-1	3	345.315	1.143	20	5		EDBDHM
COC(=O)C(C)(C)CCNCc1cc(OC)c([O-])cc1[N+](=O)[O-]	ZINC000285400370	274529527	/nfs/dbraw/zinc/52/95/27/274529527.db2.gz	FCBYDRROLCLKNI-UHFFFAOYSA-N	-1	3	326.349	1.988	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCCCC[C@H]1O	ZINC000287484452	288248069	/nfs/dbraw/zinc/24/80/69/288248069.db2.gz	QPNQLJVUWSLIGW-VXGBXAGGSA-N	-1	3	344.389	1.575	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@H](C)C(=O)OC(C)C	ZINC000266853304	302047443	/nfs/dbraw/zinc/04/74/43/302047443.db2.gz	SELCXJRSHRNXCQ-NSHDSACASA-N	-1	3	344.389	1.769	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1Cc2ccccc2[C@H]1O	ZINC000178715379	302050219	/nfs/dbraw/zinc/05/02/19/302050219.db2.gz	CXKIHVYYWUXMFZ-DZGCQCFKSA-N	-1	3	348.380	1.840	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@]1(O)CCC[C@H]1C	ZINC000294367438	303097712	/nfs/dbraw/zinc/09/77/12/303097712.db2.gz	AXVJSEHUZPMVBO-RISCZKNCSA-N	-1	3	328.390	1.733	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000427167739	304986281	/nfs/dbraw/zinc/98/62/81/304986281.db2.gz	QMOSYYDNJCHKON-UHFFFAOYSA-N	-1	3	333.304	1.179	20	5		EDBDHM
O=C(NCCNC(=O)c1ccc([O-])cc1)c1ccc([N+](=O)[O-])s1	ZINC000436641958	305163297	/nfs/dbraw/zinc/16/32/97/305163297.db2.gz	FDQCZHFCLCEEIL-UHFFFAOYSA-N	-1	3	335.341	1.522	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])[C@@H](O)C(F)F	ZINC000451706964	305363682	/nfs/dbraw/zinc/36/36/82/305363682.db2.gz	HJMCBTZWAFAONR-GXSJLCMTSA-N	-1	3	338.332	1.419	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@]2(C)CCCOC2)cc1[N+](=O)[O-]	ZINC000493737761	305625016	/nfs/dbraw/zinc/62/50/16/305625016.db2.gz	NQWWREKQPHRKGR-CYBMUJFWSA-N	-1	3	348.352	1.590	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000535734695	306015654	/nfs/dbraw/zinc/01/56/54/306015654.db2.gz	AEWKIKAHZOEZJD-SNVBAGLBSA-N	-1	3	341.327	1.385	20	5		EDBDHM
CN1CCC[C@H](N2CCN(C(=O)c3cccc([N+](=O)[O-])c3[O-])CC2)C1	ZINC000378177233	447405759	/nfs/dbraw/zinc/40/57/59/447405759.db2.gz	SKIMUQMBSPRIFN-ZDUSSCGKSA-N	-1	3	348.403	1.152	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCCOC(C)C)c([N+](=O)[O-])c1	ZINC000023391854	441294682	/nfs/dbraw/zinc/29/46/82/441294682.db2.gz	AWRRLWNTEKUZFF-UHFFFAOYSA-N	-1	3	332.378	1.697	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000083979015	441379662	/nfs/dbraw/zinc/37/96/62/441379662.db2.gz	IRQUXDFVIMQGJB-UHFFFAOYSA-N	-1	3	347.824	1.929	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCCOC[C@@H]1CCCO1	ZINC000030498863	441494372	/nfs/dbraw/zinc/49/43/72/441494372.db2.gz	XMSOVNXGLBZSBL-LBPRGKRZSA-N	-1	3	344.389	1.459	20	5		EDBDHM
Cc1nc(C)c(CC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c(=O)[n-]1	ZINC000031371428	441523763	/nfs/dbraw/zinc/52/37/63/441523763.db2.gz	MPDRPCYSUQBKRZ-UHFFFAOYSA-N	-1	3	345.359	1.066	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](C)C[C@@H](C)O)c1C	ZINC000120703281	442119572	/nfs/dbraw/zinc/11/95/72/442119572.db2.gz	INZVOVDRYMHSDV-MWLCHTKSSA-N	-1	3	330.406	1.897	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](C)C[C@@H](C)O)cc1C	ZINC000120778710	442131495	/nfs/dbraw/zinc/13/14/95/442131495.db2.gz	WWCROLIZEMXERN-BXKDBHETSA-N	-1	3	330.406	1.897	20	5		EDBDHM
O=C(Nc1nnc(C(F)(F)F)s1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000127961973	442236490	/nfs/dbraw/zinc/23/64/90/442236490.db2.gz	PBRKIKPICMHEDY-UHFFFAOYSA-N	-1	3	335.223	1.818	20	5		EDBDHM
O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCc2nc[n-]c(=O)c2C1	ZINC000179065593	442563595	/nfs/dbraw/zinc/56/35/95/442563595.db2.gz	XGUOYPBXYBUNTQ-UHFFFAOYSA-N	-1	3	334.719	1.530	20	5		EDBDHM
COc1nnc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)[n-]1	ZINC000179374711	442634436	/nfs/dbraw/zinc/63/44/36/442634436.db2.gz	WPAAUEVXAMZKHQ-UHFFFAOYSA-N	-1	3	332.320	1.574	20	5		EDBDHM
COc1nc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)n[n-]1	ZINC000179374711	442634439	/nfs/dbraw/zinc/63/44/39/442634439.db2.gz	WPAAUEVXAMZKHQ-UHFFFAOYSA-N	-1	3	332.320	1.574	20	5		EDBDHM
COc1n[n-]c(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)n1	ZINC000179374711	442634443	/nfs/dbraw/zinc/63/44/43/442634443.db2.gz	WPAAUEVXAMZKHQ-UHFFFAOYSA-N	-1	3	332.320	1.574	20	5		EDBDHM
Cc1nn(C)c(C)c1CC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000192677091	442675615	/nfs/dbraw/zinc/67/56/15/442675615.db2.gz	ACZDWRVLYPNITF-UHFFFAOYSA-N	-1	3	338.389	1.466	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCOC1	ZINC000266132758	443028683	/nfs/dbraw/zinc/02/86/83/443028683.db2.gz	BGNZBAMHMLXZKY-RKDXNWHRSA-N	-1	3	334.781	1.952	20	5		EDBDHM
CO[C@@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000266132726	443028733	/nfs/dbraw/zinc/02/87/33/443028733.db2.gz	BFXXUICHZWQJGU-VXGBXAGGSA-N	-1	3	332.353	1.970	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)c1cnn(C)c1	ZINC000266245066	443072674	/nfs/dbraw/zinc/07/26/74/443072674.db2.gz	WSPYTLQDUBKGSL-VIFPVBQESA-N	-1	3	340.361	1.376	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCCOCC2)cc1[N+](=O)[O-]	ZINC000185690782	443239084	/nfs/dbraw/zinc/23/90/84/443239084.db2.gz	IESZBLGNJWOJQM-SNVBAGLBSA-N	-1	3	332.353	1.890	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCOCC(F)F)c(Cl)c1	ZINC000190957372	443213906	/nfs/dbraw/zinc/21/39/06/443213906.db2.gz	KVHONOTXHXQZAN-UHFFFAOYSA-N	-1	3	344.723	1.808	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC(C)(C)C[C@H](C)O	ZINC000272164779	443545334	/nfs/dbraw/zinc/54/53/34/443545334.db2.gz	ZWPYUEHBWBKGJH-JTQLQIEISA-N	-1	3	346.405	1.679	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]Cc2nnc(C3CC3)o2)c([N+](=O)[O-])c1	ZINC000440076678	320061987	/nfs/dbraw/zinc/06/19/87/320061987.db2.gz	KCWDUBRNTAKSOE-UHFFFAOYSA-N	-1	3	338.345	1.642	20	5		EDBDHM
COc1cncc(C(=O)[N-]c2cc3c(cc2[N+](=O)[O-])OCCCO3)n1	ZINC000276800502	443832313	/nfs/dbraw/zinc/83/23/13/443832313.db2.gz	WGVHYLZILWXRRF-UHFFFAOYSA-N	-1	3	346.299	1.807	20	5		EDBDHM
CCOCC(C)(C)[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000292863398	443862925	/nfs/dbraw/zinc/86/29/25/443862925.db2.gz	RSRMRUIBLRIRPX-UHFFFAOYSA-N	-1	3	332.378	1.697	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCO)c([N-]S(=O)(=O)CCCCF)c1	ZINC000294254257	444107162	/nfs/dbraw/zinc/10/71/62/444107162.db2.gz	QFGJQLIHNQPJHU-UHFFFAOYSA-N	-1	3	335.357	1.490	20	5		EDBDHM
O=C([N-]C[C@H]1CCCN(CCn2cc([N+](=O)[O-])cn2)C1)C(F)(F)F	ZINC000289553616	444170361	/nfs/dbraw/zinc/17/03/61/444170361.db2.gz	UONHKHRXVYAROR-SNVBAGLBSA-N	-1	3	349.313	1.182	20	5		EDBDHM
COC(=O)C1CCC([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000322679059	444340875	/nfs/dbraw/zinc/34/08/75/444340875.db2.gz	JJVNUTWBRZNQHC-UHFFFAOYSA-N	-1	3	342.373	1.605	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2ccc(O)cc2)c([N+](=O)[O-])c1	ZINC000322925750	444341561	/nfs/dbraw/zinc/34/15/61/444341561.db2.gz	JCCZROMZKNXBOK-UHFFFAOYSA-N	-1	3	338.341	1.788	20	5		EDBDHM
CCN1CCC[C@H](C[N-]S(=O)(=O)c2cccnc2[N+](=O)[O-])C1	ZINC000547439250	322127171	/nfs/dbraw/zinc/12/71/71/322127171.db2.gz	RCXXCUCIDHSNAS-LLVKDONJSA-N	-1	3	328.394	1.000	20	5		EDBDHM
CC1(C)CCCN1CC[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000581648698	322202896	/nfs/dbraw/zinc/20/28/96/322202896.db2.gz	VIEKCKWIBJQRBB-UHFFFAOYSA-N	-1	3	328.394	1.143	20	5		EDBDHM
COC(=O)c1c(F)cc([N-]C(=O)c2nn(C)cc2[N+](=O)[O-])cc1F	ZINC000338104989	444518068	/nfs/dbraw/zinc/51/80/68/444518068.db2.gz	HDTAFSHBAFHEOX-UHFFFAOYSA-N	-1	3	340.242	1.645	20	5		EDBDHM
COC(=O)[C@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C1CC1	ZINC000342308286	444622276	/nfs/dbraw/zinc/62/22/76/444622276.db2.gz	VXOUIDAKVLVRLD-GFCCVEGCSA-N	-1	3	328.346	1.133	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)C[C@@H]2CCCO2)c([N+](=O)[O-])c1	ZINC000338725073	444821440	/nfs/dbraw/zinc/82/14/40/444821440.db2.gz	FYMBOUXNOCAXEK-PWSUYJOCSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CN(C)S(=O)(=O)c1ccc([N-]C(=O)c2ccc([N+](=O)[O-])o2)nc1	ZINC000344230858	444853077	/nfs/dbraw/zinc/85/30/77/444853077.db2.gz	YIXRNCHOCASULO-UHFFFAOYSA-N	-1	3	340.317	1.085	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]Cc1nc(CO)cs1	ZINC000352062725	445466533	/nfs/dbraw/zinc/46/65/33/445466533.db2.gz	LDQOYNRTBJQRKN-UHFFFAOYSA-N	-1	3	329.359	1.022	20	5		EDBDHM
O=C(CCc1cccc([N+](=O)[O-])c1)N1CCc2nc[n-]c(=O)c2C1	ZINC000357265022	445515353	/nfs/dbraw/zinc/51/53/53/445515353.db2.gz	CAUPFYNYRBHOBU-UHFFFAOYSA-N	-1	3	328.328	1.608	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCSC2)cc1[N+](=O)[O-]	ZINC000360020739	445532439	/nfs/dbraw/zinc/53/24/39/445532439.db2.gz	BPHXTNCCFLVLPF-SSDOTTSWSA-N	-1	3	336.366	1.526	20	5		EDBDHM
CCc1nnc(C[N-]S(=O)(=O)CCc2ccccc2[N+](=O)[O-])o1	ZINC000357236898	445498984	/nfs/dbraw/zinc/49/89/84/445498984.db2.gz	VGQGSUZLZNWCDW-UHFFFAOYSA-N	-1	3	340.361	1.202	20	5		EDBDHM
CCN1CC[C@H]([N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C1	ZINC000360219711	445636322	/nfs/dbraw/zinc/63/63/22/445636322.db2.gz	LVGBRHSRKMDADA-LBPRGKRZSA-N	-1	3	327.406	1.584	20	5		EDBDHM
Cc1nnc(CC[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)s1	ZINC000349809898	445685640	/nfs/dbraw/zinc/68/56/40/445685640.db2.gz	KKROAIYFKWOHLT-UHFFFAOYSA-N	-1	3	348.431	1.646	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CCN(C)[C@@H](C)C1	ZINC000360653044	445719497	/nfs/dbraw/zinc/71/94/97/445719497.db2.gz	NTMLZHMLVSKLNV-RYUDHWBXSA-N	-1	3	327.406	1.664	20	5		EDBDHM
COc1cc(CN[C@@H]2CC(=O)N([C@H]3C[C@H]3C)C2)c([N+](=O)[O-])cc1[O-]	ZINC000363414617	445794592	/nfs/dbraw/zinc/79/45/92/445794592.db2.gz	PMNUEGNZQREDMO-JLLWLGSASA-N	-1	3	335.360	1.408	20	5		EDBDHM
C[C@@H]1C[C@@H]1CC(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000354430620	446199325	/nfs/dbraw/zinc/19/93/25/446199325.db2.gz	LZPGJXFIYKZMNH-GHMZBOCLSA-N	-1	3	341.389	1.035	20	5		EDBDHM
COC(=O)c1cc([N-]C(=O)c2cncc(OC)n2)cc([N+](=O)[O-])c1	ZINC000359489932	446254372	/nfs/dbraw/zinc/25/43/72/446254372.db2.gz	IHUOVDDFIIMEDU-UHFFFAOYSA-N	-1	3	332.272	1.432	20	5		EDBDHM
CCc1[nH]n(C)c2nnc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)c1-2	ZINC000362364020	446335481	/nfs/dbraw/zinc/33/54/81/446335481.db2.gz	FEQHWIXBEQBQPT-UHFFFAOYSA-N	-1	3	331.292	1.120	20	5		EDBDHM
COC(=O)c1cc([N-]C(=O)c2cc3n(n2)CCCO3)cc([N+](=O)[O-])c1	ZINC000431847384	446437889	/nfs/dbraw/zinc/43/78/89/446437889.db2.gz	LGFKEMDNLVPMOL-UHFFFAOYSA-N	-1	3	346.299	1.613	20	5		EDBDHM
CCOc1ccc(C(=O)Nc2c(C)[nH]c(=O)[n-]c2=O)cc1[N+](=O)[O-]	ZINC000427140318	447551329	/nfs/dbraw/zinc/55/13/29/447551329.db2.gz	PTKJCKJKOWXRDT-UHFFFAOYSA-N	-1	3	334.288	1.755	20	5		EDBDHM
Cn1cnc(CC[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000416528809	447636179	/nfs/dbraw/zinc/63/61/79/447636179.db2.gz	DKTGKTBCWQRVJQ-UHFFFAOYSA-N	-1	3	344.780	1.503	20	5		EDBDHM
CCc1n[nH]c([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)n1	ZINC000451021601	447654092	/nfs/dbraw/zinc/65/40/92/447654092.db2.gz	AWNFRWWDQSXUIC-UHFFFAOYSA-N	-1	3	325.350	1.693	20	5		EDBDHM
C[C@@H](C(=O)Nc1cc(-c2nccn2C)[n-]n1)c1cccc([N+](=O)[O-])c1	ZINC000517272948	448568645	/nfs/dbraw/zinc/56/86/45/448568645.db2.gz	AMSCNAXWNZNWPI-SNVBAGLBSA-N	-1	3	340.343	2.461	20	5		EDBDHM
C[C@@H](C(=O)Nc1cc(-c2nccn2C)n[n-]1)c1cccc([N+](=O)[O-])c1	ZINC000517272948	448568656	/nfs/dbraw/zinc/56/86/56/448568656.db2.gz	AMSCNAXWNZNWPI-SNVBAGLBSA-N	-1	3	340.343	2.461	20	5		EDBDHM
Cn1ccc(S(=O)(=O)[N-]CCCCc2ccc([N+](=O)[O-])cc2)n1	ZINC000584717710	448607143	/nfs/dbraw/zinc/60/71/43/448607143.db2.gz	KMWIYJDRFYBGDL-UHFFFAOYSA-N	-1	3	338.389	1.630	20	5		EDBDHM
C[C@H](C(=O)N1CCC[C@H]1c1nc(=N)n(C)[n-]1)c1cccc([N+](=O)[O-])c1	ZINC000574405460	448867491	/nfs/dbraw/zinc/86/74/91/448867491.db2.gz	DIHVZNMHMSCGIR-GWCFXTLKSA-N	-1	3	344.375	1.603	20	5		EDBDHM
CS[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(=O)[O-])c2)C[C@H]1N(C)C	ZINC000574813769	448963162	/nfs/dbraw/zinc/96/31/62/448963162.db2.gz	JTHYBINULSGPQV-CHWSQXEVSA-N	-1	3	325.390	1.775	20	5		EDBDHM
C[C@@H](CN1CCC[C@H](C)C1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593583153	449089854	/nfs/dbraw/zinc/08/98/54/449089854.db2.gz	ZLPZJXRJFDJNFM-RYUDHWBXSA-N	-1	3	342.421	1.389	20	5		EDBDHM
O=C(c1ccc([N+](=O)[O-])c([O-])c1)N1CCC(N2CCCOCC2)CC1	ZINC000600007454	449146481	/nfs/dbraw/zinc/14/64/81/449146481.db2.gz	RYMHFDYGENJISB-UHFFFAOYSA-N	-1	3	349.387	1.627	20	5		EDBDHM
O=C1C[C@@]2(CCSC2)C(=O)[N-]N1c1ccc([N+](=O)[O-])cc1F	ZINC000601938418	449236173	/nfs/dbraw/zinc/23/61/73/449236173.db2.gz	HKYAWZUVABKOKF-CYBMUJFWSA-N	-1	3	325.321	1.625	20	5		EDBDHM
CCc1nsc(N2CCN(c3cc[n-]c(=O)c3[N+](=O)[O-])CC2)n1	ZINC000596144020	449383604	/nfs/dbraw/zinc/38/36/04/449383604.db2.gz	ZZTOROXITAMYSQ-UHFFFAOYSA-N	-1	3	336.377	1.436	20	5		EDBDHM
CCOCCC[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594744610	449662336	/nfs/dbraw/zinc/66/23/36/449662336.db2.gz	MHSQXESOHVVWRO-UHFFFAOYSA-N	-1	3	339.373	1.848	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])N1CCC[C@@H](C)C1	ZINC000594749364	449665504	/nfs/dbraw/zinc/66/55/04/449665504.db2.gz	SNVCILCEGVZFLW-NEPJUHHUSA-N	-1	3	342.421	1.389	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])CN1CCCCC1	ZINC000594755084	449669729	/nfs/dbraw/zinc/66/97/29/449669729.db2.gz	HYLMZCCPKDMKAF-LBPRGKRZSA-N	-1	3	342.421	1.390	20	5		EDBDHM
C[C@H](CN1CCC[C@H](C)C1)[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594770450	449683507	/nfs/dbraw/zinc/68/35/07/449683507.db2.gz	HHYGBXYJNPHKHH-NWDGAFQWSA-N	-1	3	342.421	1.389	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCC1CC(OC)C1	ZINC000594790671	449700702	/nfs/dbraw/zinc/70/07/02/449700702.db2.gz	WIKAIXQCPCVFCN-UHFFFAOYSA-N	-1	3	344.389	1.697	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-][C@@]13C[C@@H]1CCC3)OCCO2	ZINC000594806202	449718482	/nfs/dbraw/zinc/71/84/82/449718482.db2.gz	ZAOUOROAWGSBOQ-XPTSAGLGSA-N	-1	3	340.357	1.587	20	5		EDBDHM
O=C1[N-]C(=O)[C@]2(CCCN(c3ccc4cnccc4c3[N+](=O)[O-])C2)N1	ZINC000599081707	449721417	/nfs/dbraw/zinc/72/14/17/449721417.db2.gz	UHFGULZLPNYCJE-MRXNPFEDSA-N	-1	3	341.327	1.321	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](C)C2(CO)CC2)c1[N+](=O)[O-]	ZINC000594827580	449734247	/nfs/dbraw/zinc/73/42/47/449734247.db2.gz	QOVHJSMHKNLPIL-LLVKDONJSA-N	-1	3	328.390	1.651	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCCOC(F)F)c([N+](=O)[O-])s1	ZINC000601411496	449927385	/nfs/dbraw/zinc/92/73/85/449927385.db2.gz	CKIMJNVOPUKUEO-UHFFFAOYSA-N	-1	3	330.334	1.872	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CO[C@@H](C3CC3)C2)c(F)cc1[N+](=O)[O-]	ZINC000601474423	449997722	/nfs/dbraw/zinc/99/77/22/449997722.db2.gz	QEERENNSLROAMS-ZWNOBZJWSA-N	-1	3	344.364	1.888	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1[C@@H](C)[C@H](C)O[C@H]1C	ZINC000599460164	449993605	/nfs/dbraw/zinc/99/36/05/449993605.db2.gz	UDGMIOINBICJCM-ZPFDUUQYSA-N	-1	3	328.390	1.993	20	5		EDBDHM
COC(=O)[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000595399040	450112762	/nfs/dbraw/zinc/11/27/62/450112762.db2.gz	YNXSKLMZVSRZDT-XWEPSHTISA-N	-1	3	348.764	1.478	20	5		EDBDHM
COC(=O)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(C)(C)C	ZINC000610087876	450137947	/nfs/dbraw/zinc/13/79/47/450137947.db2.gz	MBOOTLSTCATJKN-LLVKDONJSA-N	-1	3	348.352	1.600	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1C[C@@H](OC)C1(C)C	ZINC000619490064	450489065	/nfs/dbraw/zinc/48/90/65/450489065.db2.gz	QAANAPSBKKRQIP-NWDGAFQWSA-N	-1	3	344.389	1.695	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@]1(C)CCCOC1	ZINC000619494864	450491080	/nfs/dbraw/zinc/49/10/80/450491080.db2.gz	QXQQIGOPVXJOQW-CYBMUJFWSA-N	-1	3	330.362	1.451	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCOC1CCC1	ZINC000742335789	579448840	/nfs/dbraw/zinc/44/88/40/579448840.db2.gz	BFQCEOFWAVLQSP-UHFFFAOYSA-N	-1	3	330.362	1.451	20	5		EDBDHM
CCCCS(=O)(=O)[N-]CC(=O)O[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000760691868	580036510	/nfs/dbraw/zinc/03/65/10/580036510.db2.gz	RZDUBGMHTCDCCJ-LLVKDONJSA-N	-1	3	344.389	1.919	20	5		EDBDHM
CC(C)(C)[S@](=O)CCNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000735643734	578907727	/nfs/dbraw/zinc/90/77/27/578907727.db2.gz	RJOUGAOBGRTJBR-HSZRJFAPSA-N	-1	3	338.393	1.734	20	5		EDBDHM
CC(C)(C)[S@](=O)CCNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000735643734	578907728	/nfs/dbraw/zinc/90/77/28/578907728.db2.gz	RJOUGAOBGRTJBR-HSZRJFAPSA-N	-1	3	338.393	1.734	20	5		EDBDHM
C[C@@H]1CN2CCCC[C@H]2CN1c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000736292063	578974565	/nfs/dbraw/zinc/97/45/65/578974565.db2.gz	HXOGKFZTCMWVJL-YPMHNXCESA-N	-1	3	343.391	1.838	20	5		EDBDHM
CNc1nc(CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])cs1	ZINC000736886789	579030251	/nfs/dbraw/zinc/03/02/51/579030251.db2.gz	LBESYOHSFMVDBI-UHFFFAOYSA-N	-1	3	332.349	1.885	20	5		EDBDHM
CNc1nc(CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])cs1	ZINC000736886789	579030252	/nfs/dbraw/zinc/03/02/52/579030252.db2.gz	LBESYOHSFMVDBI-UHFFFAOYSA-N	-1	3	332.349	1.885	20	5		EDBDHM
O=C([O-])/C=C\c1ccc(N2CCCN(CCO)CC2)c([N+](=O)[O-])c1	ZINC000739625694	579227927	/nfs/dbraw/zinc/22/79/27/579227927.db2.gz	RADVBPGGMRGEHL-HYXAFXHYSA-N	-1	3	335.360	1.197	20	5		EDBDHM
COc1ccc(OCCOC(=O)c2cncc([O-])c2)c([N+](=O)[O-])c1	ZINC000745001646	579533722	/nfs/dbraw/zinc/53/37/22/579533722.db2.gz	DCYWGERSBJFQAJ-UHFFFAOYSA-N	-1	3	334.284	1.940	20	5		EDBDHM
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1CCc2nc[n-]c(=O)c2C1	ZINC000750628919	579773649	/nfs/dbraw/zinc/77/36/49/579773649.db2.gz	XHMLLAWLIAXFJK-UHFFFAOYSA-N	-1	3	348.290	1.193	20	5		EDBDHM
O=C([N-]Cc1ccoc1)c1c2c(cc([N+](=O)[O-])c1[N+](=O)[O-])OCCO2	ZINC000751278128	579800148	/nfs/dbraw/zinc/80/01/48/579800148.db2.gz	PPZJKRONBRGZNY-UHFFFAOYSA-N	-1	3	349.255	1.797	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@H](CCO)C1CC1	ZINC000751441602	579806953	/nfs/dbraw/zinc/80/69/53/579806953.db2.gz	GFUKRMAOJJLABW-SNVBAGLBSA-N	-1	3	334.781	1.688	20	5		EDBDHM
Cc1ccc([C@H](O)C[N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)o1	ZINC000751996292	579832481	/nfs/dbraw/zinc/83/24/81/579832481.db2.gz	CFUJUGFNDLFNOI-CYBMUJFWSA-N	-1	3	340.357	1.649	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1COC(C)(C)OC1	ZINC000758632648	579988256	/nfs/dbraw/zinc/98/82/56/579988256.db2.gz	VNEVOELNTMWNDI-UHFFFAOYSA-N	-1	3	346.361	1.033	20	5		EDBDHM
CCOC(=O)c1cc([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)n[nH]1	ZINC000768865339	580222949	/nfs/dbraw/zinc/22/29/49/580222949.db2.gz	HQLROXYBQFKZBR-UHFFFAOYSA-N	-1	3	346.346	1.357	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H](CO)c2ccsc2)cs1	ZINC000770277204	580257117	/nfs/dbraw/zinc/25/71/17/580257117.db2.gz	VCDATZCLSMONEO-VIFPVBQESA-N	-1	3	334.400	1.730	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H]2CCOC2=O)c1	ZINC000779866915	580500259	/nfs/dbraw/zinc/50/02/59/580500259.db2.gz	MWJXJPWEYITURA-ZETCQYMHSA-N	-1	3	334.737	1.150	20	5		EDBDHM
CCC[C@H](C)OC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000796272593	580949805	/nfs/dbraw/zinc/94/98/05/580949805.db2.gz	DWFPBYSCOOCTCU-JTQLQIEISA-N	-1	3	330.362	1.605	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])O[C@@H]1C=CCCC1	ZINC000796273689	580949822	/nfs/dbraw/zinc/94/98/22/580949822.db2.gz	FDBMYLUIRTWMHX-LLVKDONJSA-N	-1	3	340.357	1.525	20	5		EDBDHM
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NCc1nnc(C(F)(F)F)[n-]1	ZINC000801952804	581088907	/nfs/dbraw/zinc/08/89/07/581088907.db2.gz	FPQYPJYGQMUENO-UHFFFAOYSA-N	-1	3	348.216	1.383	20	5		EDBDHM
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NCc1n[n-]c(C(F)(F)F)n1	ZINC000801952804	581088908	/nfs/dbraw/zinc/08/89/08/581088908.db2.gz	FPQYPJYGQMUENO-UHFFFAOYSA-N	-1	3	348.216	1.383	20	5		EDBDHM
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NCc1nc(C(F)(F)F)n[n-]1	ZINC000801952804	581088909	/nfs/dbraw/zinc/08/89/09/581088909.db2.gz	FPQYPJYGQMUENO-UHFFFAOYSA-N	-1	3	348.216	1.383	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCOc2cccnc2)c(-c2nnn[n-]2)c1	ZINC000738373810	598914683	/nfs/dbraw/zinc/91/46/83/598914683.db2.gz	HDFCTLVXQZMVFP-UHFFFAOYSA-N	-1	3	328.292	1.056	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCOc2cccnc2)c(-c2nn[n-]n2)c1	ZINC000738373810	598914684	/nfs/dbraw/zinc/91/46/84/598914684.db2.gz	HDFCTLVXQZMVFP-UHFFFAOYSA-N	-1	3	328.292	1.056	20	5		EDBDHM
COc1c([O-])ccc(CN2CCC[C@H](N3CCCC3=O)C2)c1[N+](=O)[O-]	ZINC000891994845	590733066	/nfs/dbraw/zinc/73/30/66/590733066.db2.gz	CRZGYGLWEBRUQS-ZDUSSCGKSA-N	-1	3	349.387	1.896	20	5		EDBDHM
O=C(CNC(=O)c1ccc([O-])cc1)OCc1ccccc1[N+](=O)[O-]	ZINC000727539579	591759503	/nfs/dbraw/zinc/75/95/03/591759503.db2.gz	SBHWNIOJLONWKH-UHFFFAOYSA-N	-1	3	330.296	1.774	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@]12C[C@H]1COC21CCC1	ZINC000908109067	592324922	/nfs/dbraw/zinc/32/49/22/592324922.db2.gz	MQBLEYLXMWTQGE-SMDDNHRTSA-N	-1	3	338.385	1.832	20	5		EDBDHM
CO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C12CCC2	ZINC000841549119	593297083	/nfs/dbraw/zinc/29/70/83/593297083.db2.gz	LENLOSILABBKIV-NXEZZACHSA-N	-1	3	332.403	1.892	20	5		EDBDHM
CN(CCC(=O)OC(C)(C)C)c1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000821599201	593875777	/nfs/dbraw/zinc/87/57/77/593875777.db2.gz	JUJGJBDZUCPHIW-UHFFFAOYSA-N	-1	3	349.351	1.338	20	5		EDBDHM
CN(CCC(=O)OC(C)(C)C)c1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000821599201	593875779	/nfs/dbraw/zinc/87/57/79/593875779.db2.gz	JUJGJBDZUCPHIW-UHFFFAOYSA-N	-1	3	349.351	1.338	20	5		EDBDHM
Cc1c(OC(=O)c2cc(-c3nnn[n-]3)cn2C)cccc1[N+](=O)[O-]	ZINC000822129777	593997914	/nfs/dbraw/zinc/99/79/14/593997914.db2.gz	OMXQFUSMKDMAIT-UHFFFAOYSA-N	-1	3	328.288	1.641	20	5		EDBDHM
Cc1c(OC(=O)c2cc(-c3nn[n-]n3)cn2C)cccc1[N+](=O)[O-]	ZINC000822129777	593997916	/nfs/dbraw/zinc/99/79/16/593997916.db2.gz	OMXQFUSMKDMAIT-UHFFFAOYSA-N	-1	3	328.288	1.641	20	5		EDBDHM
C[C@]1(CCCO)CCCN1c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000824816281	594078841	/nfs/dbraw/zinc/07/88/41/594078841.db2.gz	AIYYAGJNVBRLJZ-OAHLLOKOSA-N	-1	3	332.364	1.906	20	5		EDBDHM
C[C@]1(CCCO)CCCN1c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000824816281	594078842	/nfs/dbraw/zinc/07/88/42/594078842.db2.gz	AIYYAGJNVBRLJZ-OAHLLOKOSA-N	-1	3	332.364	1.906	20	5		EDBDHM
NC(=O)[C@@H]1CCCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000822860079	594112670	/nfs/dbraw/zinc/11/26/70/594112670.db2.gz	MWFRMCQMPXAZLJ-KOLCDFICSA-N	-1	3	331.336	1.231	20	5		EDBDHM
NC(=O)[C@@H]1CCCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000822860079	594112671	/nfs/dbraw/zinc/11/26/71/594112671.db2.gz	MWFRMCQMPXAZLJ-KOLCDFICSA-N	-1	3	331.336	1.231	20	5		EDBDHM
CC[C@H](Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@H](O)C(F)(F)F	ZINC000825146313	594136207	/nfs/dbraw/zinc/13/62/07/594136207.db2.gz	CCKHTWVJRWWZJV-XVKPBYJWSA-N	-1	3	346.269	1.889	20	5		EDBDHM
CC[C@H](Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])[C@H](O)C(F)(F)F	ZINC000825146313	594136208	/nfs/dbraw/zinc/13/62/08/594136208.db2.gz	CCKHTWVJRWWZJV-XVKPBYJWSA-N	-1	3	346.269	1.889	20	5		EDBDHM
O=C(OCc1cc(F)ccc1-c1nnn[n-]1)c1ccc([N+](=O)[O-])o1	ZINC000823418702	594199765	/nfs/dbraw/zinc/19/97/65/594199765.db2.gz	UPOANRZQSPYODE-UHFFFAOYSA-N	-1	3	333.235	1.864	20	5		EDBDHM
O=C(OCc1cc(F)ccc1-c1nn[n-]n1)c1ccc([N+](=O)[O-])o1	ZINC000823418702	594199767	/nfs/dbraw/zinc/19/97/67/594199767.db2.gz	UPOANRZQSPYODE-UHFFFAOYSA-N	-1	3	333.235	1.864	20	5		EDBDHM
Cc1c([C@@H](C)NCCN2CCN(C(=O)[O-])CC2)cccc1[N+](=O)[O-]	ZINC000829859253	594277843	/nfs/dbraw/zinc/27/78/43/594277843.db2.gz	KOWUNXRLZRCJHI-CYBMUJFWSA-N	-1	3	336.392	1.849	20	5		EDBDHM
CN(C)CCn1nccc1[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000829957211	594301006	/nfs/dbraw/zinc/30/10/06/594301006.db2.gz	ACLVFQWTSJYKME-UHFFFAOYSA-N	-1	3	345.406	1.215	20	5		EDBDHM
CN(C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCN(C(=O)[O-])C1	ZINC000828167634	594356141	/nfs/dbraw/zinc/35/61/41/594356141.db2.gz	ARUMHQSGEMZCMP-STQMWFEESA-N	-1	3	339.348	1.019	20	5		EDBDHM
Cc1nnc(NCCc2cccc([N+](=O)[O-])c2)c(-c2nnn[n-]2)c1C	ZINC000826336818	594432275	/nfs/dbraw/zinc/43/22/75/594432275.db2.gz	OTKVHKORNJLVBZ-UHFFFAOYSA-N	-1	3	340.347	1.836	20	5		EDBDHM
Cc1nnc(NCCc2cccc([N+](=O)[O-])c2)c(-c2nn[n-]n2)c1C	ZINC000826336818	594432276	/nfs/dbraw/zinc/43/22/76/594432276.db2.gz	OTKVHKORNJLVBZ-UHFFFAOYSA-N	-1	3	340.347	1.836	20	5		EDBDHM
O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CCc2c1cccc2[N+](=O)[O-]	ZINC000826471505	594489651	/nfs/dbraw/zinc/48/96/51/594489651.db2.gz	BVFWFYCRDDKRDE-UHFFFAOYSA-N	-1	3	325.288	1.306	20	5		EDBDHM
O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CCc2c1cccc2[N+](=O)[O-]	ZINC000826471505	594489653	/nfs/dbraw/zinc/48/96/53/594489653.db2.gz	BVFWFYCRDDKRDE-UHFFFAOYSA-N	-1	3	325.288	1.306	20	5		EDBDHM
O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1OC[C@@H](O)Cc1ccccc1	ZINC000826499279	594502643	/nfs/dbraw/zinc/50/26/43/594502643.db2.gz	CHMXJCUNUSQWDZ-LBPRGKRZSA-N	-1	3	341.327	1.757	20	5		EDBDHM
O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1OC[C@@H](O)Cc1ccccc1	ZINC000826499279	594502645	/nfs/dbraw/zinc/50/26/45/594502645.db2.gz	CHMXJCUNUSQWDZ-LBPRGKRZSA-N	-1	3	341.327	1.757	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCn3ccnc32)c(F)c1	ZINC000831738317	594697952	/nfs/dbraw/zinc/69/79/52/594697952.db2.gz	KQAATSXYVXWHRT-JTQLQIEISA-N	-1	3	326.309	1.354	20	5		EDBDHM
CC(C)(CC(=O)[O-])NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000833456237	594851133	/nfs/dbraw/zinc/85/11/33/594851133.db2.gz	PDGUPLFIISSVBN-UHFFFAOYSA-N	-1	3	330.362	1.211	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN2CCC[C@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000867148186	594892880	/nfs/dbraw/zinc/89/28/80/594892880.db2.gz	OLXGYQQJEDIFMC-LLVKDONJSA-N	-1	3	345.396	1.805	20	5		EDBDHM
CCOc1cc([N+](=O)[O-])c(C(=O)[N-]O[C@@H](CO)C(C)C)cc1OC	ZINC000836902714	595013104	/nfs/dbraw/zinc/01/31/04/595013104.db2.gz	UAESYHCSDTZDSI-AWEZNQCLSA-N	-1	3	342.348	1.680	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@]2(O)CCc3ccccc32)nc1	ZINC000845902210	595092309	/nfs/dbraw/zinc/09/23/09/595092309.db2.gz	LUMBFSAHNRYNRT-OAHLLOKOSA-N	-1	3	349.368	1.102	20	5		EDBDHM
O=C([O-])Cc1ccc(NC[C@@H]2CN3CCC[C@H]3CO2)c([N+](=O)[O-])c1	ZINC000844207742	595302138	/nfs/dbraw/zinc/30/21/38/595302138.db2.gz	DUMQINLUHPMSFB-QWHCGFSZSA-N	-1	3	335.360	1.497	20	5		EDBDHM
O=C([N-]C[C@H](O)C1CCC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848592656	595412511	/nfs/dbraw/zinc/41/25/11/595412511.db2.gz	WTHOIKRWVNAILF-LBPRGKRZSA-N	-1	3	330.287	1.844	20	5		EDBDHM
CC(C)(COC(=O)CC[N-]S(=O)(=O)c1ccccc1F)[N+](=O)[O-]	ZINC000851126043	595736369	/nfs/dbraw/zinc/73/63/69/595736369.db2.gz	KXZDOWWGFKBSSB-UHFFFAOYSA-N	-1	3	348.352	1.093	20	5		EDBDHM
CCn1ncc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)n1	ZINC000859252297	596018442	/nfs/dbraw/zinc/01/84/42/596018442.db2.gz	OVPQAAXRUKJADP-UHFFFAOYSA-N	-1	3	343.340	1.132	20	5		EDBDHM
COC(=O)C1=CC[C@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000859285462	596032746	/nfs/dbraw/zinc/03/27/46/596032746.db2.gz	AKZMTYKVRWWFMH-QMMMGPOBSA-N	-1	3	332.359	1.196	20	5		EDBDHM
C[C@H]1C[C@@H]1COC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000859677239	596164365	/nfs/dbraw/zinc/16/43/65/596164365.db2.gz	HBWPOXWVHLWUGO-VHSXEESVSA-N	-1	3	328.346	1.072	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]CCc2ccc(CO)cc2)cs1	ZINC000120263528	596387725	/nfs/dbraw/zinc/38/77/25/596387725.db2.gz	PLHIGAJJXZZZFC-UHFFFAOYSA-N	-1	3	342.398	1.670	20	5		EDBDHM
COC[C@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000882698708	598025401	/nfs/dbraw/zinc/02/54/01/598025401.db2.gz	MOCUGRWNUHWFKE-DTORHVGOSA-N	-1	3	334.781	1.952	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCC[C@H](n2ccnc2)C1	ZINC000738357131	598673161	/nfs/dbraw/zinc/67/31/61/598673161.db2.gz	CGJIXLOBPWQXTB-LBPRGKRZSA-N	-1	3	340.347	1.813	20	5		EDBDHM
CS[C@H](CO)[C@H](C)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000230193127	295665070	/nfs/dbraw/zinc/66/50/70/295665070.db2.gz	YPGJPOAJNREPNL-GXSJLCMTSA-N	-1	3	334.419	1.294	20	5		EDBDHM
CN(CCNC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)Cc1ccccc1	ZINC000187004488	529917005	/nfs/dbraw/zinc/91/70/05/529917005.db2.gz	NQDYHUSNNUUALT-UHFFFAOYSA-N	-1	3	330.344	1.557	20	5		EDBDHM
CN(C)c1nc(C(=O)N(C)CCc2ccccc2[N+](=O)[O-])cc(=O)[n-]1	ZINC000359130459	282314574	/nfs/dbraw/zinc/31/45/74/282314574.db2.gz	MVNBMJOHKFNXRX-UHFFFAOYSA-N	-1	3	345.359	1.471	20	5		EDBDHM
CC(C)C[C@H](CO)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000040794324	213387117	/nfs/dbraw/zinc/38/71/17/213387117.db2.gz	SYYUPIFYXIMHHO-SNVBAGLBSA-N	-1	3	336.797	1.934	20	5		EDBDHM
C[C@H](CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[S@@](C)=O	ZINC000124133413	138324040	/nfs/dbraw/zinc/32/40/40/138324040.db2.gz	DAEXUZVWGJRPIF-SQFXPLBJSA-N	-1	3	338.382	1.169	20	5		EDBDHM
Cc1nn(C)c(NCCCNC(=O)c2cccc([O-])c2)c1[N+](=O)[O-]	ZINC000078727551	217110248	/nfs/dbraw/zinc/11/02/48/217110248.db2.gz	RGPHYUOPKRMQSP-UHFFFAOYSA-N	-1	3	333.348	1.574	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CC1(O)Cc2ccccc2C1	ZINC000238881620	139070141	/nfs/dbraw/zinc/07/01/41/139070141.db2.gz	PJQIPDHSKNFAFA-UHFFFAOYSA-N	-1	3	348.380	1.403	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1C(=O)Nc1nnc(C(F)(F)F)[n-]1	ZINC000248116689	139158357	/nfs/dbraw/zinc/15/83/57/139158357.db2.gz	BONKEFGCJRYXQK-UHFFFAOYSA-N	-1	3	331.210	1.993	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(C(F)(F)F)n[n-]1	ZINC000248116689	139158358	/nfs/dbraw/zinc/15/83/58/139158358.db2.gz	BONKEFGCJRYXQK-UHFFFAOYSA-N	-1	3	331.210	1.993	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CC[C@@H](C)O1	ZINC000416536401	251075266	/nfs/dbraw/zinc/07/52/66/251075266.db2.gz	PTWDUMDEVLGYAH-KOLCDFICSA-N	-1	3	330.362	1.449	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCc2cn(C)cn2)cc1C	ZINC000416536387	251074574	/nfs/dbraw/zinc/07/45/74/251074574.db2.gz	PSCDCELKYSWJDQ-UHFFFAOYSA-N	-1	3	338.389	1.466	20	5		EDBDHM
CSC[C@H](CCO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000443257289	254573698	/nfs/dbraw/zinc/57/36/98/254573698.db2.gz	ZQNRNYIXKXPLRZ-QMMMGPOBSA-N	-1	3	338.382	1.126	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCCC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000266155916	139517973	/nfs/dbraw/zinc/51/79/73/139517973.db2.gz	GLIBUNGVUSIGQN-WCQYABFASA-N	-1	3	344.389	1.839	20	5		EDBDHM
C[C@@H]1CN(C2CCOCC2)CCN1C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000332401321	141175687	/nfs/dbraw/zinc/17/56/87/141175687.db2.gz	SVVNFGHLOWHSKA-GFCCVEGCSA-N	-1	3	349.387	1.626	20	5		EDBDHM
O=C(c1cc(=O)[n-]c(C2CC2)n1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000572301384	306585291	/nfs/dbraw/zinc/58/52/91/306585291.db2.gz	CPBQAMMULOTRAF-UHFFFAOYSA-N	-1	3	341.327	1.561	20	5		EDBDHM
Cc1noc([C@@H](C)[N-]S(=O)(=O)CCc2ccccc2[N+](=O)[O-])n1	ZINC000347025284	143273130	/nfs/dbraw/zinc/27/31/30/143273130.db2.gz	PANIRDJRWOYUJP-SECBINFHSA-N	-1	3	340.361	1.509	20	5		EDBDHM
COC(=O)[C@H](CC1CC1)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000416581021	304333678	/nfs/dbraw/zinc/33/36/78/304333678.db2.gz	JCPZSCJXACHJHF-JTQLQIEISA-N	-1	3	328.346	1.215	20	5		EDBDHM
CCO[C@H]1COCC[C@H]1[N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000353001265	149247610	/nfs/dbraw/zinc/24/76/10/149247610.db2.gz	HIRNRFSBXBAFBJ-KGLIPLIRSA-N	-1	3	344.389	1.208	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000355327551	150219104	/nfs/dbraw/zinc/21/91/04/150219104.db2.gz	RCLIWWRJHNCHMW-IUCAKERBSA-N	-1	3	334.781	1.952	20	5		EDBDHM
Cc1c(C(=O)NCc2nnc(C(F)(F)F)[n-]2)cccc1[N+](=O)[O-]	ZINC000360843125	152227434	/nfs/dbraw/zinc/22/74/34/152227434.db2.gz	ZMZIMZKRABKAKU-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1c(C(=O)NCc2n[n-]c(C(F)(F)F)n2)cccc1[N+](=O)[O-]	ZINC000360843125	152227436	/nfs/dbraw/zinc/22/74/36/152227436.db2.gz	ZMZIMZKRABKAKU-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1c(C(=O)NCc2nc(C(F)(F)F)n[n-]2)cccc1[N+](=O)[O-]	ZINC000360843125	152227439	/nfs/dbraw/zinc/22/74/39/152227439.db2.gz	ZMZIMZKRABKAKU-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
COc1ccc(C(=O)NCc2nnc(C(F)(F)F)[n-]2)cc1[N+](=O)[O-]	ZINC000360992631	152272585	/nfs/dbraw/zinc/27/25/85/152272585.db2.gz	JSIGHTFRVBXFDQ-UHFFFAOYSA-N	-1	3	345.237	1.670	20	5		EDBDHM
COc1ccc(C(=O)NCc2n[n-]c(C(F)(F)F)n2)cc1[N+](=O)[O-]	ZINC000360992631	152272589	/nfs/dbraw/zinc/27/25/89/152272589.db2.gz	JSIGHTFRVBXFDQ-UHFFFAOYSA-N	-1	3	345.237	1.670	20	5		EDBDHM
COc1ccc(C(=O)NCc2nc(C(F)(F)F)n[n-]2)cc1[N+](=O)[O-]	ZINC000360992631	152272591	/nfs/dbraw/zinc/27/25/91/152272591.db2.gz	JSIGHTFRVBXFDQ-UHFFFAOYSA-N	-1	3	345.237	1.670	20	5		EDBDHM
COc1cc(C(=O)NCc2ncccc2[O-])cc([N+](=O)[O-])c1OC	ZINC000352517814	162226403	/nfs/dbraw/zinc/22/64/03/162226403.db2.gz	SLQBWKUDMGEKLB-UHFFFAOYSA-N	-1	3	333.300	1.643	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CO)CC(C)C)c1C	ZINC000158401668	225007286	/nfs/dbraw/zinc/00/72/86/225007286.db2.gz	COOZWFIBLFDOFW-GFCCVEGCSA-N	-1	3	330.406	1.897	20	5		EDBDHM
CC(C)[C@H](CCO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000122530116	222106875	/nfs/dbraw/zinc/10/68/75/222106875.db2.gz	STUQSORUWUBIBE-NSHDSACASA-N	-1	3	336.797	1.934	20	5		EDBDHM
C[C@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CN1C1CC1	ZINC000124085758	222373516	/nfs/dbraw/zinc/37/35/16/222373516.db2.gz	PZWWNXJCVOHQCM-VHSXEESVSA-N	-1	3	343.380	1.637	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1C[C@H](O)C1(C)C	ZINC000275377069	268333132	/nfs/dbraw/zinc/33/31/32/268333132.db2.gz	LTRZFUSXQCRVCX-NEPJUHHUSA-N	-1	3	330.362	1.041	20	5		EDBDHM
CCC1([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2C(=O)OC)CCC1	ZINC000276086037	268395423	/nfs/dbraw/zinc/39/54/23/268395423.db2.gz	HBPOPYGUSUKICM-UHFFFAOYSA-N	-1	3	342.373	1.992	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H](C)SC	ZINC000273587057	273046946	/nfs/dbraw/zinc/04/69/46/273046946.db2.gz	PZCFCUHGSACDNY-MRVPVSSYSA-N	-1	3	348.402	1.411	20	5		EDBDHM
C[C@H]1CN(C2CCOCC2)CCN1C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000279240447	273287422	/nfs/dbraw/zinc/28/74/22/273287422.db2.gz	SVVNFGHLOWHSKA-LBPRGKRZSA-N	-1	3	349.387	1.626	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1cc(C)nn1C	ZINC000284094670	274077808	/nfs/dbraw/zinc/07/78/08/274077808.db2.gz	AUCGSLOSJKKGSA-UHFFFAOYSA-N	-1	3	340.361	1.124	20	5		EDBDHM
CC(C)c1ccc(C(=O)N2CCN3C(=O)[N-]C(=O)[C@H]3C2)cc1[N+](=O)[O-]	ZINC000332578090	278024543	/nfs/dbraw/zinc/02/45/43/278024543.db2.gz	AIHQVTARVKBXHW-CYBMUJFWSA-N	-1	3	346.343	1.094	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCC1(C)C	ZINC000286783741	288086061	/nfs/dbraw/zinc/08/60/61/288086061.db2.gz	RMJZYNWPCQPOAV-LBPRGKRZSA-N	-1	3	342.373	1.848	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCCC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000266155908	295198923	/nfs/dbraw/zinc/19/89/23/295198923.db2.gz	GLIBUNGVUSIGQN-DGCLKSJQSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](C(N)=O)C(C)(C)C)c1[N+](=O)[O-]	ZINC000189953030	301557304	/nfs/dbraw/zinc/55/73/04/301557304.db2.gz	IJYTWGYAHDTWCA-GFCCVEGCSA-N	-1	3	343.405	1.390	20	5		EDBDHM
CCn1ccnc1C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000295406988	303214858	/nfs/dbraw/zinc/21/48/58/303214858.db2.gz	HKJCPBOLFGZSEJ-UHFFFAOYSA-N	-1	3	340.361	1.298	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H](C)CCCO)c1[N+](=O)[O-]	ZINC000295432702	303218452	/nfs/dbraw/zinc/21/84/52/303218452.db2.gz	XTYZHBDHYUJCQB-SNVBAGLBSA-N	-1	3	330.406	1.899	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCC1(CO)CC1	ZINC000396006359	303854564	/nfs/dbraw/zinc/85/45/64/303854564.db2.gz	RQWNTOIZJZSWST-UHFFFAOYSA-N	-1	3	330.362	1.044	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H]1CCOC2(CCC2)C1	ZINC000268985602	304810442	/nfs/dbraw/zinc/81/04/42/304810442.db2.gz	QORITLUDAFAVBF-NSHDSACASA-N	-1	3	326.374	1.975	20	5		EDBDHM
NC(=O)N1CCc2ccc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)cc21	ZINC000428022533	305003998	/nfs/dbraw/zinc/00/39/98/305003998.db2.gz	MQGXFRIBRRFGEG-UHFFFAOYSA-N	-1	3	343.299	1.389	20	5		EDBDHM
O=C(Nc1cccc([C@H]2CNC(=O)C2)c1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000435900939	305149102	/nfs/dbraw/zinc/14/91/02/305149102.db2.gz	GTQUSPUZPGJGJD-SNVBAGLBSA-N	-1	3	342.311	1.551	20	5		EDBDHM
O=C(NCCNc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc([O-])cc1	ZINC000436823034	305167916	/nfs/dbraw/zinc/16/79/16/305167916.db2.gz	SDEFRBCLBUOHOX-UHFFFAOYSA-N	-1	3	341.327	1.441	20	5		EDBDHM
CSCC[C@H](CO)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000443505855	305238985	/nfs/dbraw/zinc/23/89/85/305238985.db2.gz	AYVGTYMXVNZHDZ-LLVKDONJSA-N	-1	3	348.446	1.604	20	5		EDBDHM
O=C(Nc1ncccc1OC(F)F)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000445186462	305257607	/nfs/dbraw/zinc/25/76/07/305257607.db2.gz	GRHBVPLBBKOBDT-UHFFFAOYSA-N	-1	3	326.215	1.944	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C2(CF)CCOCC2)c([N+](=O)[O-])c1	ZINC000451733766	305365740	/nfs/dbraw/zinc/36/57/40/305365740.db2.gz	HGEFIMWTBLVTGB-UHFFFAOYSA-N	-1	3	348.352	1.400	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](C)Cc2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000451971318	305375084	/nfs/dbraw/zinc/37/50/84/305375084.db2.gz	URHCNRQDTHKKJG-LLVKDONJSA-N	-1	3	338.389	1.546	20	5		EDBDHM
COCC1(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000514860153	305707930	/nfs/dbraw/zinc/70/79/30/305707930.db2.gz	VQEPVQJVEXCSIY-UHFFFAOYSA-N	-1	3	332.353	1.829	20	5		EDBDHM
CS(=O)(=O)c1ccc(C(=O)Nc2ccccc2[O-])cc1[N+](=O)[O-]	ZINC000014337706	441183640	/nfs/dbraw/zinc/18/36/40/441183640.db2.gz	UATQOWWWZKYYTR-UHFFFAOYSA-N	-1	3	336.325	1.956	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@@H]1CCCC[C@@H]1O	ZINC000052003424	441430622	/nfs/dbraw/zinc/43/06/22/441430622.db2.gz	UQBBIAGVUSRNHJ-KOLCDFICSA-N	-1	3	334.781	1.830	20	5		EDBDHM
O=C(Nc1ccc2c(c1)NC(=O)CS2)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000029773007	441472635	/nfs/dbraw/zinc/47/26/35/441472635.db2.gz	NDXFABUIADIKRH-UHFFFAOYSA-N	-1	3	346.324	1.580	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2CCC[C@H]2O)c(Cl)c1	ZINC000089166153	441527839	/nfs/dbraw/zinc/52/78/39/441527839.db2.gz	MLLPPFPKUGWILF-LDYMZIIASA-N	-1	3	334.781	1.688	20	5		EDBDHM
CCOC(=O)C(C)(C)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000066937823	441590561	/nfs/dbraw/zinc/59/05/61/441590561.db2.gz	KRTHUMFDMTZLIM-UHFFFAOYSA-N	-1	3	344.389	1.832	20	5		EDBDHM
COCCOCCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000055221683	441631259	/nfs/dbraw/zinc/63/12/59/441631259.db2.gz	UGPFROWGWXQCCR-UHFFFAOYSA-N	-1	3	336.341	1.065	20	5		EDBDHM
Cc1nn2c(nnc2SCc2c(F)cccc2[N+](=O)[O-])[n-]c1=O	ZINC000114860487	441691942	/nfs/dbraw/zinc/69/19/42/441691942.db2.gz	HIBQRZACLMSWBO-UHFFFAOYSA-N	-1	3	336.308	1.873	20	5		EDBDHM
CC(C)Cn1cnc(S(=O)(=O)[N-]Cc2ccc([N+](=O)[O-])cc2)c1	ZINC000174982871	441991818	/nfs/dbraw/zinc/99/18/18/441991818.db2.gz	PSZMYQXQRDMFNL-UHFFFAOYSA-N	-1	3	338.389	1.926	20	5		EDBDHM
CCNC(=O)C(C)(C)C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000120465027	442078476	/nfs/dbraw/zinc/07/84/76/442078476.db2.gz	JYZCROPTMXMDQE-UHFFFAOYSA-N	-1	3	343.405	1.344	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H](C)C[S@@](C)=O)cc1[N+](=O)[O-]	ZINC000127054651	442166449	/nfs/dbraw/zinc/16/64/49/442166449.db2.gz	OWFQKJFYMNKGIU-DMWPKQFHSA-N	-1	3	326.421	1.010	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]CCn2ccnc2)cc1[N+](=O)[O-]	ZINC000176638895	442243050	/nfs/dbraw/zinc/24/30/50/442243050.db2.gz	CDEMVVQTNVTMEN-UHFFFAOYSA-N	-1	3	344.780	1.732	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](CO)CC(C)(C)C)c([N+](=O)[O-])c1	ZINC000128814403	442289886	/nfs/dbraw/zinc/28/98/86/442289886.db2.gz	FIPNLWNIFJIWOF-NSHDSACASA-N	-1	3	330.406	1.979	20	5		EDBDHM
O=C(NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C1CCCC1	ZINC000129420738	442316131	/nfs/dbraw/zinc/31/61/31/442316131.db2.gz	PXWBRZWDVZSUAX-UHFFFAOYSA-N	-1	3	341.389	1.180	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-][C@H](C)[C@H]2CCCO2)cc1[N+](=O)[O-]	ZINC000133310499	442412349	/nfs/dbraw/zinc/41/23/49/442412349.db2.gz	BSJFZZULUSQICV-NOZJJQNGSA-N	-1	3	332.353	1.888	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H]2CCCN(C)C2)c1[N+](=O)[O-]	ZINC000189958334	443038284	/nfs/dbraw/zinc/03/82/84/443038284.db2.gz	JMRQIQZOJXKBIQ-CYBMUJFWSA-N	-1	3	341.433	1.832	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC[C@H]1CCCCO1	ZINC000272450473	443322986	/nfs/dbraw/zinc/32/29/86/443322986.db2.gz	SPYQGYGSTBOCPF-GFCCVEGCSA-N	-1	3	344.389	1.841	20	5		EDBDHM
C[C@H]1CN(CCCNC(=O)c2cccc([N+](=O)[O-])c2[O-])CCCO1	ZINC000278460703	443339186	/nfs/dbraw/zinc/33/91/86/443339186.db2.gz	JAVAUXQZUUMRLZ-LBPRGKRZSA-N	-1	3	337.376	1.531	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@]2(O)CCO[C@@H]2C)c1C	ZINC000278784581	443438242	/nfs/dbraw/zinc/43/82/42/443438242.db2.gz	PWWYGXOXXQQTSY-RISCZKNCSA-N	-1	3	344.389	1.030	20	5		EDBDHM
CC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCOCC1	ZINC000267815281	443585689	/nfs/dbraw/zinc/58/56/89/443585689.db2.gz	OWIJXGXHBHXVFE-UHFFFAOYSA-N	-1	3	332.353	1.829	20	5		EDBDHM
Nc1c(C(=O)NCCNC(=O)c2ccc([O-])cc2)cccc1[N+](=O)[O-]	ZINC000436732149	320020500	/nfs/dbraw/zinc/02/05/00/320020500.db2.gz	SJFGPTUGLLZMJC-UHFFFAOYSA-N	-1	3	344.327	1.042	20	5		EDBDHM
COCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br	ZINC000446970427	320138192	/nfs/dbraw/zinc/13/81/92/320138192.db2.gz	APPZBILNWOATJH-UHFFFAOYSA-N	-1	3	339.167	1.282	20	5		EDBDHM
COCCOCCC[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276775063	443822515	/nfs/dbraw/zinc/82/25/15/443822515.db2.gz	HSRCUOMYUYNHPD-UHFFFAOYSA-N	-1	3	346.405	1.543	20	5		EDBDHM
CCn1cc(C[N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])cn1	ZINC000285515568	444013430	/nfs/dbraw/zinc/01/34/30/444013430.db2.gz	GHUWMBSMMHAOPF-UHFFFAOYSA-N	-1	3	340.361	1.298	20	5		EDBDHM
CC[C@](C)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(=O)OC	ZINC000299624022	444098790	/nfs/dbraw/zinc/09/87/90/444098790.db2.gz	LZHCXTUROVLGMO-ZDUSSCGKSA-N	-1	3	346.361	1.223	20	5		EDBDHM
CCOc1cc(CN2CCC[C@H](c3nc(=O)[n-][nH]3)C2)ccc1[N+](=O)[O-]	ZINC000289358366	444117096	/nfs/dbraw/zinc/11/70/96/444117096.db2.gz	GYAXRDXMOYCCKW-LBPRGKRZSA-N	-1	3	347.375	1.785	20	5		EDBDHM
CC(C)(CO)[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000289730681	444196103	/nfs/dbraw/zinc/19/61/03/444196103.db2.gz	ZQFDBDPUTWFHIV-CYBMUJFWSA-N	-1	3	346.380	1.809	20	5		EDBDHM
O=C(CCc1cccc([N+](=O)[O-])c1)Nc1[n-]nnc1C(=O)NC1CC1	ZINC000297870431	444343883	/nfs/dbraw/zinc/34/38/83/444343883.db2.gz	ZNLQRSHKZDHENI-UHFFFAOYSA-N	-1	3	344.331	1.176	20	5		EDBDHM
O=C(CCc1cccc([N+](=O)[O-])c1)Nc1nn[n-]c1C(=O)NC1CC1	ZINC000297870431	444343885	/nfs/dbraw/zinc/34/38/85/444343885.db2.gz	ZNLQRSHKZDHENI-UHFFFAOYSA-N	-1	3	344.331	1.176	20	5		EDBDHM
O=C(CCc1cccc([N+](=O)[O-])c1)Nc1n[n-]nc1C(=O)NC1CC1	ZINC000297870431	444343887	/nfs/dbraw/zinc/34/38/87/444343887.db2.gz	ZNLQRSHKZDHENI-UHFFFAOYSA-N	-1	3	344.331	1.176	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)nc(C)n1	ZINC000340767370	444503912	/nfs/dbraw/zinc/50/39/12/444503912.db2.gz	JQBRWLFTPRUFLN-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
CS[C@@H](CO)[C@H](C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000342493963	444715868	/nfs/dbraw/zinc/71/58/68/444715868.db2.gz	SISAPWVKFXMVQO-RCOVLWMOSA-N	-1	3	340.448	1.355	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2CCC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000341221296	444736578	/nfs/dbraw/zinc/73/65/78/444736578.db2.gz	USMQKDZYJULUJI-GXFFZTMASA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cc1noc([C@H](C)[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])n1	ZINC000338901141	444921490	/nfs/dbraw/zinc/92/14/90/444921490.db2.gz	GWZVNLOFAVDOFM-QMMMGPOBSA-N	-1	3	326.334	1.634	20	5		EDBDHM
O=[N+]([O-])c1ccc(C[N-]S(=O)(=O)Cc2ccon2)c(Cl)c1	ZINC000341636219	444927969	/nfs/dbraw/zinc/92/79/69/444927969.db2.gz	KOWCGDYTQKLZHB-UHFFFAOYSA-N	-1	3	331.737	1.856	20	5		EDBDHM
CC(=O)N1CCC([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])CC1	ZINC000330435285	444979988	/nfs/dbraw/zinc/97/99/88/444979988.db2.gz	YGMQCYCCMJCXLA-UHFFFAOYSA-N	-1	3	341.389	1.192	20	5		EDBDHM
CCC[C@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)OC	ZINC000358602454	445670165	/nfs/dbraw/zinc/67/01/65/445670165.db2.gz	RGNFXEOTUSTCJP-JTQLQIEISA-N	-1	3	330.362	1.523	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2CC[C@H](OC)C2)cc1[N+](=O)[O-]	ZINC000349971531	445739048	/nfs/dbraw/zinc/73/90/48/445739048.db2.gz	UWGLCFDZIPBYDC-IUCAKERBSA-N	-1	3	348.352	1.588	20	5		EDBDHM
COCC(C)(C)N1CCN(c2ccc([N+](=O)[O-])c(C(=O)[O-])c2)CC1	ZINC000583265046	326038485	/nfs/dbraw/zinc/03/84/85/326038485.db2.gz	CYBKRKYMEIGOAC-UHFFFAOYSA-N	-1	3	337.376	1.840	20	5		EDBDHM
CN1CCC(n2ccc(NC(=O)c3ccc([N+](=O)[O-])c([O-])c3)n2)CC1	ZINC000373255405	446127917	/nfs/dbraw/zinc/12/79/17/446127917.db2.gz	LIBXRMGMTWFVSJ-UHFFFAOYSA-N	-1	3	345.359	2.016	20	5		EDBDHM
Cc1ccc(-c2cc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)[nH]n2)o1	ZINC000447800186	447292062	/nfs/dbraw/zinc/29/20/62/447292062.db2.gz	QJGQZFMSKBDQGN-UHFFFAOYSA-N	-1	3	329.272	2.239	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1C[C@@H](OC(C)C)C1	ZINC000416531797	447638100	/nfs/dbraw/zinc/63/81/00/447638100.db2.gz	VNRCZCBOMYBJES-KLPPZKSPSA-N	-1	3	344.389	1.838	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]Cc2cnc(C)o2)cc1[N+](=O)[O-]	ZINC000416540279	447639824	/nfs/dbraw/zinc/63/98/24/447639824.db2.gz	ABVVHMGQXOBJQV-UHFFFAOYSA-N	-1	3	345.308	1.517	20	5		EDBDHM
O=C([N-]c1nc2ccccn2n1)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000539518088	448613717	/nfs/dbraw/zinc/61/37/17/448613717.db2.gz	FHCRNNNJXFFZKN-UHFFFAOYSA-N	-1	3	341.283	1.661	20	5		EDBDHM
CCc1[nH]nc(C(=O)[N-]c2nncn2Cc2ccccc2)c1[N+](=O)[O-]	ZINC000579769148	448872399	/nfs/dbraw/zinc/87/23/99/448872399.db2.gz	JYAISXZBLPAEDH-UHFFFAOYSA-N	-1	3	341.331	1.772	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C(C)(C)C(=O)N(C)C	ZINC000520832704	448935478	/nfs/dbraw/zinc/93/54/78/448935478.db2.gz	PBOWQDXAVVGZEG-UHFFFAOYSA-N	-1	3	329.378	1.048	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCc2cnc(C3CC3)nc2)nc1	ZINC000593568675	449077318	/nfs/dbraw/zinc/07/73/18/449077318.db2.gz	XXXVAHQPKKNVAI-UHFFFAOYSA-N	-1	3	349.372	1.178	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCO[C@@H](C3CC3)C2)nc1	ZINC000593578276	449086140	/nfs/dbraw/zinc/08/61/40/449086140.db2.gz	RDPSUZABYWXOBW-ZYHUDNBSSA-N	-1	3	327.362	1.226	20	5		EDBDHM
CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000590398954	449148099	/nfs/dbraw/zinc/14/80/99/449148099.db2.gz	AXQGFDWOLLKIKD-JSGCOSHPSA-N	-1	3	335.360	1.236	20	5		EDBDHM
Nc1ccc(N2CCN(C(=O)c3ccccc3[O-])CC2)nc1[N+](=O)[O-]	ZINC000590572148	449197395	/nfs/dbraw/zinc/19/73/95/449197395.db2.gz	HEAXHUDBRRJFRO-UHFFFAOYSA-N	-1	3	343.343	1.240	20	5		EDBDHM
CC(C)(CN1CCCC1)[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000590765567	449285865	/nfs/dbraw/zinc/28/58/65/449285865.db2.gz	GPVHWLKOWMTQGG-UHFFFAOYSA-N	-1	3	328.394	1.143	20	5		EDBDHM
C[C@H]1CCCN(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000593529458	449326948	/nfs/dbraw/zinc/32/69/48/449326948.db2.gz	BEZNVMZPUWXALU-NSHDSACASA-N	-1	3	328.394	1.000	20	5		EDBDHM
CN1CCN(c2ccc(CNc3cc[n-]c(=O)c3[N+](=O)[O-])cn2)CC1	ZINC000596069078	449346760	/nfs/dbraw/zinc/34/67/60/449346760.db2.gz	JQOHLIDBQZCHKF-UHFFFAOYSA-N	-1	3	344.375	1.454	20	5		EDBDHM
O=c1[n-]ccc(N2CCC[C@@H](c3nnc4n3CCC4)C2)c1[N+](=O)[O-]	ZINC000596116831	449369956	/nfs/dbraw/zinc/36/99/56/449369956.db2.gz	PVCWFHHDMLJSGX-SNVBAGLBSA-N	-1	3	330.348	1.617	20	5		EDBDHM
O=c1[n-]ccc(N2CCN(Cc3cccc(F)c3)C(=O)C2)c1[N+](=O)[O-]	ZINC000596148004	449385745	/nfs/dbraw/zinc/38/57/45/449385745.db2.gz	XXZAITWZQNAEQC-UHFFFAOYSA-N	-1	3	346.318	1.683	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)[N-]c2cc(C(=O)OC(C)(C)C)ccn2)n1	ZINC000598745888	449578607	/nfs/dbraw/zinc/57/86/07/449578607.db2.gz	KZXMULFYWPVEJV-UHFFFAOYSA-N	-1	3	347.331	1.931	20	5		EDBDHM
CC(C)(C(=O)[O-])N1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000600876142	449581913	/nfs/dbraw/zinc/58/19/13/449581913.db2.gz	RSPGXHOKHQAUOG-UHFFFAOYSA-N	-1	3	335.360	1.145	20	5		EDBDHM
COc1cc(CNc2ccc3c(n2)OCCO3)c([N+](=O)[O-])cc1[O-]	ZINC000594741970	449661062	/nfs/dbraw/zinc/66/10/62/449661062.db2.gz	HFWHUQYLFWITBQ-UHFFFAOYSA-N	-1	3	333.300	2.087	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCc2cncc(C)n2)cc1[N+](=O)[O-]	ZINC000594870356	449786175	/nfs/dbraw/zinc/78/61/75/449786175.db2.gz	AFRQXUPUGGRVMZ-UHFFFAOYSA-N	-1	3	342.402	1.584	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2(N(C)C)CC2)c1C	ZINC000601450404	449973382	/nfs/dbraw/zinc/97/33/82/449973382.db2.gz	VXPPRDHHCWHHIY-UHFFFAOYSA-N	-1	3	327.406	1.584	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H]1CCN1C1CCCC1	ZINC000599464800	449996346	/nfs/dbraw/zinc/99/63/46/449996346.db2.gz	TWQDKYDSCRSKHL-ZDUSSCGKSA-N	-1	3	339.417	1.890	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)on1	ZINC000610161325	450149207	/nfs/dbraw/zinc/14/92/07/450149207.db2.gz	BMEWUTJYZVFEIG-UHFFFAOYSA-N	-1	3	325.346	1.765	20	5		EDBDHM
C[C@@H](C(=O)Nc1ncccc1[O-])[C@H](C)NC(=O)c1ccc([N+](=O)[O-])[nH]1	ZINC000597654043	450172802	/nfs/dbraw/zinc/17/28/02/450172802.db2.gz	SIEDZQPSWABMDZ-BDAKNGLRSA-N	-1	3	347.331	1.417	20	5		EDBDHM
COC(=O)c1ccc(OCC(=O)[N-]c2cc(C)no2)cc1[N+](=O)[O-]	ZINC000618454374	491003969	/nfs/dbraw/zinc/00/39/69/491003969.db2.gz	JIGUZOVRHFMKHF-UHFFFAOYSA-N	-1	3	335.272	1.695	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCCC(C)(C)CO)c([N+](=O)[O-])c1	ZINC000269821484	536875049	/nfs/dbraw/zinc/87/50/49/536875049.db2.gz	WEGYPHUPTGMMHU-UHFFFAOYSA-N	-1	3	346.405	1.680	20	5		EDBDHM
CC(C)C[C@@H](CNC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)N(C)C	ZINC000736404595	578985441	/nfs/dbraw/zinc/98/54/41/578985441.db2.gz	VOTFPATWMWYBTH-AWEZNQCLSA-N	-1	3	337.376	1.999	20	5		EDBDHM
C[C@@H]1C[C@H](N(C)C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CCN1C	ZINC000736758214	579018053	/nfs/dbraw/zinc/01/80/53/579018053.db2.gz	BZBWJYCFGOLORS-ZWNOBZJWSA-N	-1	3	335.360	1.848	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2nnn[n-]2)cn1	ZINC000737116011	579049066	/nfs/dbraw/zinc/04/90/66/579049066.db2.gz	QVDGSDNFJQINFG-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2nn[n-]n2)cn1	ZINC000737116011	579049067	/nfs/dbraw/zinc/04/90/67/579049067.db2.gz	QVDGSDNFJQINFG-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
CCN1CCCC[C@@H]1CNC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000737116087	579049070	/nfs/dbraw/zinc/04/90/70/579049070.db2.gz	SRVCANLEMNYLIP-CYBMUJFWSA-N	-1	3	335.360	1.897	20	5		EDBDHM
CN1CCc2ncnc(Oc3ccc([N+](=O)[O-])c(C(=O)[O-])c3)c2C1	ZINC000737529416	579105248	/nfs/dbraw/zinc/10/52/48/579105248.db2.gz	ILFYRAUDSNDECH-UHFFFAOYSA-N	-1	3	330.300	1.863	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](O)c2ccco2)cc1C	ZINC000751204524	579797014	/nfs/dbraw/zinc/79/70/14/579797014.db2.gz	FTSVVRHMHNVJOK-GFCCVEGCSA-N	-1	3	340.357	1.817	20	5		EDBDHM
CCOC(=O)[C@H](CC1CC1)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000751982595	579831769	/nfs/dbraw/zinc/83/17/69/579831769.db2.gz	NVSIFQQUVXMWGX-NSHDSACASA-N	-1	3	342.373	1.605	20	5		EDBDHM
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCc2c(nc[n-]c2=O)C1	ZINC000752784232	579865701	/nfs/dbraw/zinc/86/57/01/579865701.db2.gz	OXWCMFMQCIVKON-UHFFFAOYSA-N	-1	3	343.343	1.355	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C1COC(C)(C)OC1	ZINC000758632751	579988262	/nfs/dbraw/zinc/98/82/62/579988262.db2.gz	YUPSGPFJLLHKKY-UHFFFAOYSA-N	-1	3	330.362	1.333	20	5		EDBDHM
COc1cc[nH]c(=N[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)n1	ZINC000767453518	580190187	/nfs/dbraw/zinc/19/01/87/580190187.db2.gz	GLJNPHIYRWFHNG-UHFFFAOYSA-N	-1	3	345.362	1.069	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc2n[n-]nc2cc1F	ZINC000781906862	580559868	/nfs/dbraw/zinc/55/98/68/580559868.db2.gz	FDWCNXDNXYAFLJ-UHFFFAOYSA-N	-1	3	345.290	1.944	20	5		EDBDHM
Cc1c(Br)cc(C(=O)[N-]N2CN=NC2=O)cc1[N+](=O)[O-]	ZINC000782127329	580566902	/nfs/dbraw/zinc/56/69/02/580566902.db2.gz	OTOLEYGISZEHLA-UHFFFAOYSA-N	-1	3	342.109	1.347	20	5		EDBDHM
O=C([N-]OCCO)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-]	ZINC000787534442	580697205	/nfs/dbraw/zinc/69/72/05/580697205.db2.gz	RZDDXKMMMSNTRR-UHFFFAOYSA-N	-1	3	332.312	1.828	20	5		EDBDHM
C[C@]1(c2ccccc2)NC(=O)N([N-]C(=O)c2ccc([N+](=O)[O-])[nH]2)C1=O	ZINC000790891204	580780787	/nfs/dbraw/zinc/78/07/87/580780787.db2.gz	YPUURLMYGQHDPT-OAHLLOKOSA-N	-1	3	343.299	1.035	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1n[n-]nc1C	ZINC000791043481	580783346	/nfs/dbraw/zinc/78/33/46/580783346.db2.gz	AMPUDQOMKXABHY-QMMMGPOBSA-N	-1	3	349.303	1.214	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOc2cccnc2)c(-c2nnn[n-]2)c1	ZINC000738370200	598914945	/nfs/dbraw/zinc/91/49/45/598914945.db2.gz	OBLXXOSKCHRTMO-UHFFFAOYSA-N	-1	3	327.304	1.661	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOc2cccnc2)c(-c2nn[n-]n2)c1	ZINC000738370200	598914947	/nfs/dbraw/zinc/91/49/47/598914947.db2.gz	OBLXXOSKCHRTMO-UHFFFAOYSA-N	-1	3	327.304	1.661	20	5		EDBDHM
COCCOC[C@@H]1CCN(Cc2ccc([O-])c(OC)c2[N+](=O)[O-])C1	ZINC000892133256	590815961	/nfs/dbraw/zinc/81/59/61/590815961.db2.gz	MUUCNDDUNZQCBY-GFCCVEGCSA-N	-1	3	340.376	1.794	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC(=O)OC(C)C)c1C	ZINC000765186727	593433874	/nfs/dbraw/zinc/43/38/74/593433874.db2.gz	NKCJLBSQDXPNCL-UHFFFAOYSA-N	-1	3	330.362	1.442	20	5		EDBDHM
C[C@@H](C(=O)OC(C)(C)C)N(C)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000819882509	593773661	/nfs/dbraw/zinc/77/36/61/593773661.db2.gz	ATMNGHXRPPDYBL-VIFPVBQESA-N	-1	3	348.363	1.941	20	5		EDBDHM
C[C@@H](C(=O)OC(C)(C)C)N(C)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000819882509	593773662	/nfs/dbraw/zinc/77/36/62/593773662.db2.gz	ATMNGHXRPPDYBL-VIFPVBQESA-N	-1	3	348.363	1.941	20	5		EDBDHM
COc1ccc(C(=O)OC[C@H]2CCCN2CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000820819628	593897186	/nfs/dbraw/zinc/89/71/86/593897186.db2.gz	BTROHMMKRXNDHY-LLVKDONJSA-N	-1	3	338.316	1.309	20	5		EDBDHM
CC(C)[C@H](O)C1(CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1	ZINC000824199013	593953677	/nfs/dbraw/zinc/95/36/77/593953677.db2.gz	GBMDGHTWEHSCJI-ZDUSSCGKSA-N	-1	3	332.364	1.984	20	5		EDBDHM
CC(C)[C@H](O)C1(CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1	ZINC000824199013	593953679	/nfs/dbraw/zinc/95/36/79/593953679.db2.gz	GBMDGHTWEHSCJI-ZDUSSCGKSA-N	-1	3	332.364	1.984	20	5		EDBDHM
C[C@@H](NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000824514588	594028536	/nfs/dbraw/zinc/02/85/36/594028536.db2.gz	OYYVBEIMIVPSEZ-MRVPVSSYSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@@H](NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000824514588	594028538	/nfs/dbraw/zinc/02/85/38/594028538.db2.gz	OYYVBEIMIVPSEZ-MRVPVSSYSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@@H]1CN(c2cc(-c3nnn[n-]3)c3cc([N+](=O)[O-])ccc3n2)C[C@@H]1O	ZINC000824995419	594112506	/nfs/dbraw/zinc/11/25/06/594112506.db2.gz	ZMRJKGKKVYNFKB-OQPBUACISA-N	-1	3	341.331	1.140	20	5		EDBDHM
C[C@@H]1CN(c2cc(-c3nn[n-]n3)c3cc([N+](=O)[O-])ccc3n2)C[C@@H]1O	ZINC000824995419	594112508	/nfs/dbraw/zinc/11/25/08/594112508.db2.gz	ZMRJKGKKVYNFKB-OQPBUACISA-N	-1	3	341.331	1.140	20	5		EDBDHM
Nc1c(C(=O)OCc2cccc(-c3nnn[n-]3)c2)cccc1[N+](=O)[O-]	ZINC000822903644	594119804	/nfs/dbraw/zinc/11/98/04/594119804.db2.gz	MMUWCORPSCAFBJ-UHFFFAOYSA-N	-1	3	340.299	1.714	20	5		EDBDHM
Nc1c(C(=O)OCc2cccc(-c3nn[n-]n3)c2)cccc1[N+](=O)[O-]	ZINC000822903644	594119805	/nfs/dbraw/zinc/11/98/05/594119805.db2.gz	MMUWCORPSCAFBJ-UHFFFAOYSA-N	-1	3	340.299	1.714	20	5		EDBDHM
O=C(Cc1cccc(-c2nnn[n-]2)c1)NCc1ccc([N+](=O)[O-])cc1	ZINC000823097802	594153301	/nfs/dbraw/zinc/15/33/01/594153301.db2.gz	BYONOHIQQLTOEF-UHFFFAOYSA-N	-1	3	338.327	1.634	20	5		EDBDHM
O=C(Cc1cccc(-c2nn[n-]n2)c1)NCc1ccc([N+](=O)[O-])cc1	ZINC000823097802	594153303	/nfs/dbraw/zinc/15/33/03/594153303.db2.gz	BYONOHIQQLTOEF-UHFFFAOYSA-N	-1	3	338.327	1.634	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H]2CC2(Cl)Cl)c(-c2nn[n-]n2)c1	ZINC000823651151	594224717	/nfs/dbraw/zinc/22/47/17/594224717.db2.gz	GZUDSUGONPKZFS-RXMQYKEDSA-N	-1	3	330.135	1.776	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H]2CC2(Cl)Cl)c(-c2nnn[n-]2)c1	ZINC000823651151	594224716	/nfs/dbraw/zinc/22/47/16/594224716.db2.gz	GZUDSUGONPKZFS-RXMQYKEDSA-N	-1	3	330.135	1.776	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H]2CSCCS2)c(-c2nnn[n-]2)c1	ZINC000823651159	594224777	/nfs/dbraw/zinc/22/47/77/594224777.db2.gz	HHZFKPCMYMXARF-QMMMGPOBSA-N	-1	3	339.406	1.430	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H]2CSCCS2)c(-c2nn[n-]n2)c1	ZINC000823651159	594224778	/nfs/dbraw/zinc/22/47/78/594224778.db2.gz	HHZFKPCMYMXARF-QMMMGPOBSA-N	-1	3	339.406	1.430	20	5		EDBDHM
Cc1cc(COC(=O)c2ccc(-c3nnn[n-]3)[nH]2)ccc1[N+](=O)[O-]	ZINC000826267730	594404517	/nfs/dbraw/zinc/40/45/17/594404517.db2.gz	STJXEWHKHWCCQA-UHFFFAOYSA-N	-1	3	328.288	1.768	20	5		EDBDHM
Cc1ccc(OC(=O)c2cc(-c3nnn[n-]3)cn2C)cc1[N+](=O)[O-]	ZINC000826291851	594412734	/nfs/dbraw/zinc/41/27/34/594412734.db2.gz	YXVTZUDOTHCYCY-UHFFFAOYSA-N	-1	3	328.288	1.641	20	5		EDBDHM
Cc1ccc(OC(=O)c2cc(-c3nn[n-]n3)cn2C)cc1[N+](=O)[O-]	ZINC000826291851	594412736	/nfs/dbraw/zinc/41/27/36/594412736.db2.gz	YXVTZUDOTHCYCY-UHFFFAOYSA-N	-1	3	328.288	1.641	20	5		EDBDHM
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000828424674	594416333	/nfs/dbraw/zinc/41/63/33/594416333.db2.gz	RUGIFTOHQXYBLO-YGRLFVJLSA-N	-1	3	335.360	1.752	20	5		EDBDHM
Cc1nn(C)c(N2CCc3ccc(-c4nnn[n-]4)cc32)c1[N+](=O)[O-]	ZINC000826334020	594430987	/nfs/dbraw/zinc/43/09/87/594430987.db2.gz	DVUCYQSODJJTGS-UHFFFAOYSA-N	-1	3	326.320	1.511	20	5		EDBDHM
Cc1nn(C)c(N2CCc3ccc(-c4nn[n-]n4)cc32)c1[N+](=O)[O-]	ZINC000826334020	594430989	/nfs/dbraw/zinc/43/09/89/594430989.db2.gz	DVUCYQSODJJTGS-UHFFFAOYSA-N	-1	3	326.320	1.511	20	5		EDBDHM
O=[N+]([O-])c1ccc([C@H](O)CSc2cc(-c3nnn[n-]3)ccn2)cc1	ZINC000826498069	594502955	/nfs/dbraw/zinc/50/29/55/594502955.db2.gz	GRYYZPANFBTTDR-GFCCVEGCSA-N	-1	3	344.356	1.996	20	5		EDBDHM
O=[N+]([O-])c1ccc([C@H](O)CSc2cc(-c3nn[n-]n3)ccn2)cc1	ZINC000826498069	594502956	/nfs/dbraw/zinc/50/29/56/594502956.db2.gz	GRYYZPANFBTTDR-GFCCVEGCSA-N	-1	3	344.356	1.996	20	5		EDBDHM
O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1cccc(-c2nnn[n-]2)c1	ZINC000826501531	594504211	/nfs/dbraw/zinc/50/42/11/594504211.db2.gz	UVXVIPJXYZAFSE-UHFFFAOYSA-N	-1	3	349.310	1.533	20	5		EDBDHM
O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1cccc(-c2nn[n-]n2)c1	ZINC000826501531	594504213	/nfs/dbraw/zinc/50/42/13/594504213.db2.gz	UVXVIPJXYZAFSE-UHFFFAOYSA-N	-1	3	349.310	1.533	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)[C@H](O)C(F)F	ZINC000831894972	594709740	/nfs/dbraw/zinc/70/97/40/594709740.db2.gz	IVJJQNIGXFWIIA-XPUUQOCRSA-N	-1	3	330.334	1.339	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H]2C[C@@H](C(N)=O)C2)cc1[N+](=O)[O-]	ZINC000845987006	595114683	/nfs/dbraw/zinc/11/46/83/595114683.db2.gz	SPCNNUFVJLHVCY-OCAPTIKFSA-N	-1	3	347.780	1.099	20	5		EDBDHM
C[C@@]1(C[N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)CCC(=O)N1	ZINC000848592704	595412612	/nfs/dbraw/zinc/41/26/12/595412612.db2.gz	YAYNNNFGVJGPMG-ZDUSSCGKSA-N	-1	3	343.286	1.351	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(OC)OC	ZINC000849406304	595521177	/nfs/dbraw/zinc/52/11/77/595521177.db2.gz	IECOJLQAKVIGOT-LLVKDONJSA-N	-1	3	346.405	1.887	20	5		EDBDHM
CCn1cc(C[N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)nn1	ZINC000855613353	595771140	/nfs/dbraw/zinc/77/11/40/595771140.db2.gz	UOKCGRHDVVJQSM-UHFFFAOYSA-N	-1	3	325.275	1.614	20	5		EDBDHM
COCOCCC[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000859383442	596074355	/nfs/dbraw/zinc/07/43/55/596074355.db2.gz	QIUVQHKWCCATQP-UHFFFAOYSA-N	-1	3	332.378	1.501	20	5		EDBDHM
CC[C@]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)(C(N)=O)C(C)C	ZINC000120311695	596422656	/nfs/dbraw/zinc/42/26/56/596422656.db2.gz	CVASONPYKOZKFQ-LLVKDONJSA-N	-1	3	335.407	1.225	20	5		EDBDHM
CC1(C)CO[C@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000872549034	596960127	/nfs/dbraw/zinc/96/01/27/596960127.db2.gz	JSMAFCFYJYHCKT-JTQLQIEISA-N	-1	3	332.353	1.827	20	5		EDBDHM
O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCc2c(=O)[n-]cnc2C1	ZINC000558258465	306236588	/nfs/dbraw/zinc/23/65/88/306236588.db2.gz	DIBWOCDPWVVVAO-UHFFFAOYSA-N	-1	3	348.746	1.871	20	5		EDBDHM
CCn1cnnc1C[N-]S(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1C	ZINC000056066579	214356033	/nfs/dbraw/zinc/35/60/33/214356033.db2.gz	LXPXESZWZOACQT-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC[C@H](C)[S@](C)=O	ZINC000124088432	138323675	/nfs/dbraw/zinc/32/36/75/138323675.db2.gz	PSJBVZAWWUZNQU-WVDJIFEKSA-N	-1	3	334.419	1.339	20	5		EDBDHM
O=[N+]([O-])c1cccc(CS(=O)(=O)[N-][C@@H]2Cc3ccccc3[C@H]2O)c1	ZINC000178717492	138744837	/nfs/dbraw/zinc/74/48/37/138744837.db2.gz	UXJWQXORQCPCAC-HZPDHXFCSA-N	-1	3	348.380	1.673	20	5		EDBDHM
Cc1c(Cl)cc(S(=O)(=O)[N-]C[C@@H](O)C(F)F)cc1[N+](=O)[O-]	ZINC000228619460	139023299	/nfs/dbraw/zinc/02/32/99/139023299.db2.gz	UPDWANCQBYAAMM-SECBINFHSA-N	-1	3	344.723	1.461	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1c2ccccc2C[C@H]1O	ZINC000097271942	219008201	/nfs/dbraw/zinc/00/82/01/219008201.db2.gz	DCOWDHYMRFYOCQ-CABCVRRESA-N	-1	3	348.380	1.840	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCCCNC2=O)c1C	ZINC000119609445	221358429	/nfs/dbraw/zinc/35/84/29/221358429.db2.gz	LCTLESXSNQHMER-LLVKDONJSA-N	-1	3	341.389	1.159	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCOC(C)(C)C1	ZINC000269898856	140015125	/nfs/dbraw/zinc/01/51/25/140015125.db2.gz	FENLNQNZZXMSSL-SNVBAGLBSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(=O)OC	ZINC000270541327	140119928	/nfs/dbraw/zinc/11/99/28/140119928.db2.gz	YCDUWCFXLFVWJA-SNVBAGLBSA-N	-1	3	330.362	1.442	20	5		EDBDHM
COC(=O)CCc1csc([N-]C(=O)c2n[nH]cc2[N+](=O)[O-])n1	ZINC000270845114	140181013	/nfs/dbraw/zinc/18/10/13/140181013.db2.gz	IRVHFEAZOOMZBZ-UHFFFAOYSA-N	-1	3	325.306	1.132	20	5		EDBDHM
Cc1ncc(CNC(=O)CSc2ccc([N+](=O)[O-])cc2)c(=O)[n-]1	ZINC000345107713	143051340	/nfs/dbraw/zinc/05/13/40/143051340.db2.gz	LVSZIOOPVBHMJG-UHFFFAOYSA-N	-1	3	334.357	1.807	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1[N-]C(=O)c1c(OC)ncnc1OC	ZINC000346735201	143239564	/nfs/dbraw/zinc/23/95/64/143239564.db2.gz	ZUFPPFLFDJQICX-UHFFFAOYSA-N	-1	3	334.288	1.663	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](C)c2csnn2)c([N+](=O)[O-])c1	ZINC000416642322	304340626	/nfs/dbraw/zinc/34/06/26/304340626.db2.gz	ZRBLFRLTIJQHDN-MRVPVSSYSA-N	-1	3	328.375	1.794	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H](CO)CC2CCC2)cc1[N+](=O)[O-]	ZINC000360362120	152007082	/nfs/dbraw/zinc/00/70/82/152007082.db2.gz	OEXMCSHYWWQKSY-SNVBAGLBSA-N	-1	3	334.419	1.794	20	5		EDBDHM
Cn1nc([N+](=O)[O-])cc1C(=O)[N-]c1nnc(CC(F)(F)F)s1	ZINC000360751410	152186192	/nfs/dbraw/zinc/18/61/92/152186192.db2.gz	ARALFUGVQGYFBP-UHFFFAOYSA-N	-1	3	336.255	1.537	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)N1C[C@@H](C)OC[C@H]1C	ZINC000361133857	152317120	/nfs/dbraw/zinc/31/71/20/152317120.db2.gz	ZZCGCEQLUCJRNJ-NXEZZACHSA-N	-1	3	345.377	1.369	20	5		EDBDHM
Cc1sc(C(=O)NCCNC(=O)c2ccc([O-])cc2)cc1[N+](=O)[O-]	ZINC000053742408	287225698	/nfs/dbraw/zinc/22/56/98/287225698.db2.gz	LZFPDSKHPVGIOT-UHFFFAOYSA-N	-1	3	349.368	1.830	20	5		EDBDHM
C[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CN1C1CC1	ZINC000124085117	222374480	/nfs/dbraw/zinc/37/44/80/222374480.db2.gz	PZWWNXJCVOHQCM-ZJUUUORDSA-N	-1	3	343.380	1.637	20	5		EDBDHM
CN(C)[C@H](CNC(=O)c1cc([N+](=O)[O-])c[n-]c1=O)c1cccs1	ZINC000027678047	267380982	/nfs/dbraw/zinc/38/09/82/267380982.db2.gz	RXFVLEUYJPXOKI-LLVKDONJSA-N	-1	3	336.373	1.377	20	5		EDBDHM
O=C(CCNc1ccccc1[N+](=O)[O-])N1CCc2c(=O)[n-]cnc2C1	ZINC000273198868	267996938	/nfs/dbraw/zinc/99/69/38/267996938.db2.gz	HZKZPDRWKVGRMC-UHFFFAOYSA-N	-1	3	343.343	1.477	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2C[C@@H](O)C2(C)C)cc1[N+](=O)[O-]	ZINC000275404590	268338028	/nfs/dbraw/zinc/33/80/28/268338028.db2.gz	ONQLPJGEWIDVFJ-GHMZBOCLSA-N	-1	3	348.352	1.180	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)C(C)C	ZINC000276088574	268395706	/nfs/dbraw/zinc/39/57/06/268395706.db2.gz	HJFWJFHBKJCRRY-VIFPVBQESA-N	-1	3	330.362	1.704	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1C[C@@H]1C	ZINC000276240512	268411558	/nfs/dbraw/zinc/41/15/58/268411558.db2.gz	QHGQNKXXDZTQFF-DTWKUNHWSA-N	-1	3	328.346	1.316	20	5		EDBDHM
Cn1nc([C@@H]2CCCO2)cc1NC(=O)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000279652221	268867546	/nfs/dbraw/zinc/86/75/46/268867546.db2.gz	HQAJGXBZNJZZKT-NSHDSACASA-N	-1	3	333.304	1.533	20	5		EDBDHM
CCN1CCC([N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])CC1	ZINC000276995762	273174846	/nfs/dbraw/zinc/17/48/46/273174846.db2.gz	XXFBSICZDZASFT-UHFFFAOYSA-N	-1	3	341.433	1.974	20	5		EDBDHM
CCC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl)C(N)=O	ZINC000285437962	274542616	/nfs/dbraw/zinc/54/26/16/274542616.db2.gz	RORVSJZLNBCOMM-VIFPVBQESA-N	-1	3	349.796	1.489	20	5		EDBDHM
Cc1ccc(N2CCC[C@@H]2C[C@]2(C)NC(=O)[N-]C2=O)c([N+](=O)[O-])c1	ZINC000286465666	288012588	/nfs/dbraw/zinc/01/25/88/288012588.db2.gz	SZZYFZIXFFEGFW-BZNIZROVSA-N	-1	3	332.360	1.860	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCOC(F)(F)F	ZINC000353786075	302047270	/nfs/dbraw/zinc/04/72/70/302047270.db2.gz	GEJVMFRNRFTFMO-UHFFFAOYSA-N	-1	3	328.268	1.718	20	5		EDBDHM
C[C@@H]1CCC[C@@]1(O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000294579429	303126745	/nfs/dbraw/zinc/12/67/45/303126745.db2.gz	MPIWGAIPKLWJDT-NOZJJQNGSA-N	-1	3	332.353	1.563	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1C[C@H]1C1CC1	ZINC000430000153	305042710	/nfs/dbraw/zinc/04/27/10/305042710.db2.gz	HHRWMQSJFBSASY-NWDGAFQWSA-N	-1	3	340.357	1.458	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1(CF)CCOCC1	ZINC000451740332	305366208	/nfs/dbraw/zinc/36/62/08/305366208.db2.gz	XKJCFRNPCLRCIM-UHFFFAOYSA-N	-1	3	348.352	1.400	20	5		EDBDHM
Cc1nnc([C@@H](C)[N-]c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])o1	ZINC000541189257	306044642	/nfs/dbraw/zinc/04/46/42/306044642.db2.gz	KHURPTMWGYIOCK-RXMQYKEDSA-N	-1	3	332.363	1.924	20	5		EDBDHM
Cc1nc(C)c(CC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(=O)[n-]1	ZINC000031368349	441522674	/nfs/dbraw/zinc/52/26/74/441522674.db2.gz	BCPQJAUJGRMRAK-UHFFFAOYSA-N	-1	3	330.344	1.496	20	5		EDBDHM
CC(C)N1CC[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1=O	ZINC000114743436	441681517	/nfs/dbraw/zinc/68/15/17/441681517.db2.gz	UCDPCYXXKJYKJL-NSHDSACASA-N	-1	3	345.352	1.022	20	5		EDBDHM
CCn1cc([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])ccc1=O	ZINC000057118882	441788034	/nfs/dbraw/zinc/78/80/34/441788034.db2.gz	TXGFLJQDUQOZPV-UHFFFAOYSA-N	-1	3	337.357	1.886	20	5		EDBDHM
CCNC(=O)C(C)(C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000120479571	442079835	/nfs/dbraw/zinc/07/98/35/442079835.db2.gz	FYAPKTXQOJNKDL-UHFFFAOYSA-N	-1	3	347.368	1.175	20	5		EDBDHM
CC(=O)c1sc2[n-]c(Cn3nccc3[N+](=O)[O-])nc(=O)c2c1C	ZINC000128060049	442242381	/nfs/dbraw/zinc/24/23/81/442242381.db2.gz	ZYKNLXRIZFHJIP-UHFFFAOYSA-N	-1	3	333.329	1.649	20	5		EDBDHM
CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc2c(c1)C(=O)[N-]C2=O	ZINC000171450513	442348768	/nfs/dbraw/zinc/34/87/68/442348768.db2.gz	KJGPWFAYAODZHZ-UHFFFAOYSA-N	-1	3	339.307	1.751	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000267853161	442768605	/nfs/dbraw/zinc/76/86/05/442768605.db2.gz	QRMGEAUCXJUPLL-UHFFFAOYSA-N	-1	3	345.315	1.931	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H](C)c2nc[nH]n2)cc1[N+](=O)[O-]	ZINC000183207708	442903724	/nfs/dbraw/zinc/90/37/24/442903724.db2.gz	QIXYRVRJMRRPSI-ZETCQYMHSA-N	-1	3	345.768	1.714	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H](CCO)c1ccco1	ZINC000184269154	443007240	/nfs/dbraw/zinc/00/72/40/443007240.db2.gz	JKIIUHPREMHWDS-SNVBAGLBSA-N	-1	3	326.330	1.590	20	5		EDBDHM
Cc1cc(-c2noc([C@H](C)[N-]S(C)(=O)=O)n2)cc([N+](=O)[O-])c1	ZINC000351148713	319094546	/nfs/dbraw/zinc/09/45/46/319094546.db2.gz	QITXXDWXSPRLSB-QMMMGPOBSA-N	-1	3	326.334	1.563	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCC(=O)N[C@H]2C)c1C	ZINC000282561817	443375063	/nfs/dbraw/zinc/37/50/63/443375063.db2.gz	OGZPOWWXDYSRAG-QWRGUYRKSA-N	-1	3	341.389	1.157	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC(C)(C)C[C@@H](C)O	ZINC000272154202	443541976	/nfs/dbraw/zinc/54/19/76/443541976.db2.gz	XZYMCVFTNBDQJN-SNVBAGLBSA-N	-1	3	346.405	1.679	20	5		EDBDHM
O=C([N-][C@@H]1CCCn2ncnc21)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000272155658	443542795	/nfs/dbraw/zinc/54/27/95/443542795.db2.gz	MWKPPJCCAMKHIN-LLVKDONJSA-N	-1	3	337.286	1.929	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H](C)[C@H](C)OC)cc1[N+](=O)[O-]	ZINC000276189508	443665859	/nfs/dbraw/zinc/66/58/59/443665859.db2.gz	WXIKBZLMUOSKQJ-YUMQZZPRSA-N	-1	3	336.341	1.444	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CC[C@@H](O)C1	ZINC000276629809	443771569	/nfs/dbraw/zinc/77/15/69/443771569.db2.gz	GDCIQAXLTNGSDM-GXSJLCMTSA-N	-1	3	330.362	1.043	20	5		EDBDHM
CCC[C@H]([N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl)C(N)=O	ZINC000285216028	443898303	/nfs/dbraw/zinc/89/83/03/443898303.db2.gz	AGCLEYWLELZVJP-QMMMGPOBSA-N	-1	3	349.796	1.489	20	5		EDBDHM
Cc1nc([C@@H](C)[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2C)n[nH]1	ZINC000285394693	443968770	/nfs/dbraw/zinc/96/87/70/443968770.db2.gz	OIBQMIWFXQPCON-MRVPVSSYSA-N	-1	3	325.350	1.369	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](CO)C1CCCC1	ZINC000289720970	444194951	/nfs/dbraw/zinc/19/49/51/444194951.db2.gz	ZDKFWYYWUNYBNA-GFCCVEGCSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CC[C@@H](C)[C@@H]([N-]c1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C(N)=O	ZINC000302103219	444204241	/nfs/dbraw/zinc/20/42/41/444204241.db2.gz	VZSORHBKEYVYQS-HZGVNTEJSA-N	-1	3	335.407	1.372	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-][C@H]2CCC[C@@]2(C)CO)cc1[N+](=O)[O-]	ZINC000331041177	444370443	/nfs/dbraw/zinc/37/04/43/444370443.db2.gz	CQFOCYCZQQENMR-KBPBESRZSA-N	-1	3	346.380	1.872	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C2CCC(CO)CC2)cc1[N+](=O)[O-]	ZINC000342485301	444711706	/nfs/dbraw/zinc/71/17/06/444711706.db2.gz	HACHBDYHVFBXFF-UHFFFAOYSA-N	-1	3	334.419	1.794	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCN2CC=C(C)CC2)cc1[N+](=O)[O-]	ZINC000342513864	444725244	/nfs/dbraw/zinc/72/52/44/444725244.db2.gz	QKLMOLDZLAWITD-UHFFFAOYSA-N	-1	3	345.446	1.895	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)C[C@H]1CCCO1	ZINC000338726440	444822895	/nfs/dbraw/zinc/82/28/95/444822895.db2.gz	OELZABKPGYSRSO-CMPLNLGQSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CCN1CCC[C@@H](C[N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000330432127	444979161	/nfs/dbraw/zinc/97/91/61/444979161.db2.gz	JYLAYWLTKNTPIN-NSHDSACASA-N	-1	3	345.396	1.744	20	5		EDBDHM
O=[N+]([O-])c1ccc([O-])cc1CN[C@H]1CCCC[C@@H]1n1cc(CO)nn1	ZINC000339121320	445041987	/nfs/dbraw/zinc/04/19/87/445041987.db2.gz	ZYLVZYULTOBRJL-HOCLYGCPSA-N	-1	3	347.375	1.658	20	5		EDBDHM
CN(C)C(=O)c1ccnc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)c1	ZINC000337656023	445189390	/nfs/dbraw/zinc/18/93/90/445189390.db2.gz	NLCXVEMYQVTMLK-UHFFFAOYSA-N	-1	3	331.288	1.045	20	5		EDBDHM
C/C=C\C[C@H](CO)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000359989433	445517656	/nfs/dbraw/zinc/51/76/56/445517656.db2.gz	YAYKWQGMZDZYRD-QMAVJUDZSA-N	-1	3	328.390	1.817	20	5		EDBDHM
COCCOc1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cn1	ZINC000361917315	446065416	/nfs/dbraw/zinc/06/54/16/446065416.db2.gz	YHHNBKYMYQZZMB-UHFFFAOYSA-N	-1	3	334.288	1.368	20	5		EDBDHM
CCNC(=O)c1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc1	ZINC000361918043	446066989	/nfs/dbraw/zinc/06/69/89/446066989.db2.gz	CDUIQHQGXIOUGH-UHFFFAOYSA-N	-1	3	330.300	1.697	20	5		EDBDHM
CCn1cccc(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c1=O	ZINC000433351639	446560001	/nfs/dbraw/zinc/56/00/01/446560001.db2.gz	HSGPUMGOOGBWHZ-UHFFFAOYSA-N	-1	3	337.357	1.255	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC(S(=O)(=O)[N-]c3ccccc3)C2)nc1	ZINC000375204892	446641790	/nfs/dbraw/zinc/64/17/90/446641790.db2.gz	BCEGKSVZBLQKRD-UHFFFAOYSA-N	-1	3	335.345	1.015	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2C[C@H]3OCCC[C@@H]23)c([N+](=O)[O-])c1	ZINC000375368405	446753753	/nfs/dbraw/zinc/75/37/53/446753753.db2.gz	SHHOSXWDBWMUQU-DMDPSCGWSA-N	-1	3	342.373	1.449	20	5		EDBDHM
NC(=O)[C@H]1CC[C@H](C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000420707916	446761763	/nfs/dbraw/zinc/76/17/63/446761763.db2.gz	VLUQEUQENAEXBW-XYPYZODXSA-N	-1	3	341.389	1.165	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]C[C@@H]1[C@H]2COC[C@H]21	ZINC000375663073	446959562	/nfs/dbraw/zinc/95/95/62/446959562.db2.gz	HBQKHFGLBVWVTP-OWUUHHOZSA-N	-1	3	332.765	1.419	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H](CO)C1CCCCC1	ZINC000395505674	447541196	/nfs/dbraw/zinc/54/11/96/447541196.db2.gz	UEXKSPSSAIMQTM-LBPRGKRZSA-N	-1	3	328.390	1.814	20	5		EDBDHM
Cc1ncc(C[N-]S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)o1	ZINC000416546020	447641942	/nfs/dbraw/zinc/64/19/42/447641942.db2.gz	KVCBSXVLVRNGTN-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
COc1ccc(-c2ccc(C[N-]c3nnc(CO)o3)o2)c([N+](=O)[O-])c1	ZINC000429834413	447758043	/nfs/dbraw/zinc/75/80/43/447758043.db2.gz	UHBCBROTGIZZLS-UHFFFAOYSA-N	-1	3	346.299	2.351	20	5		EDBDHM
C[C@H](CN1CCC[C@H](C)C1)[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000530491837	447898899	/nfs/dbraw/zinc/89/88/99/447898899.db2.gz	CIZZEKFMOKCGGE-NWDGAFQWSA-N	-1	3	342.421	1.389	20	5		EDBDHM
COc1ccc(C(=O)N2CCC[C@@H]2c2nc(=N)n(C)[n-]2)cc1[N+](=O)[O-]	ZINC000555530458	448082675	/nfs/dbraw/zinc/08/26/75/448082675.db2.gz	OGPQZLYWOJPMBZ-SNVBAGLBSA-N	-1	3	346.347	1.122	20	5		EDBDHM
COC(=O)c1cc(Cl)cc([N-]C(=O)c2n[nH]cc2[N+](=O)[O-])c1O	ZINC000588098920	448870695	/nfs/dbraw/zinc/87/06/95/448870695.db2.gz	AWTBZIXLIUCJLD-UHFFFAOYSA-N	-1	3	340.679	1.716	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H](c2cccnc2)C2CC2)nc1	ZINC000593570366	449079512	/nfs/dbraw/zinc/07/95/12/449079512.db2.gz	DNIWJGMEHXPEAS-CQSZACIVSA-N	-1	3	334.357	1.814	20	5		EDBDHM
CC(C)[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCO1	ZINC000593573086	449081596	/nfs/dbraw/zinc/08/15/96/449081596.db2.gz	VMAPPSZDMHVOCJ-PWSUYJOCSA-N	-1	3	329.378	1.472	20	5		EDBDHM
C[C@@](O)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C1CCCCC1	ZINC000593581316	449088297	/nfs/dbraw/zinc/08/82/97/449088297.db2.gz	JCFNKXIURJYIPO-CQSZACIVSA-N	-1	3	343.405	1.599	20	5		EDBDHM
COC(=O)CC1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCCC1	ZINC000593588790	449093128	/nfs/dbraw/zinc/09/31/28/449093128.db2.gz	MVHKJHCMJAHQRJ-UHFFFAOYSA-N	-1	3	343.361	1.144	20	5		EDBDHM
O=C(NC[C@@H]1CCN1Cc1ccccc1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000598511896	449435265	/nfs/dbraw/zinc/43/52/65/449435265.db2.gz	ULGSYPOWODTKFS-AWEZNQCLSA-N	-1	3	342.355	1.700	20	5		EDBDHM
O=C(NCc1ccccc1)[C@@H]1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1	ZINC000596288362	449458059	/nfs/dbraw/zinc/45/80/59/449458059.db2.gz	IQIBQOZWVCYNDA-CYBMUJFWSA-N	-1	3	342.355	1.838	20	5		EDBDHM
CCCN(CC)C[C@@H](C)[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594776112	449687898	/nfs/dbraw/zinc/68/78/98/449687898.db2.gz	QYONGVMSKJRQTI-LLVKDONJSA-N	-1	3	330.410	1.389	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CCC[C@H](C)O1	ZINC000594849980	449756983	/nfs/dbraw/zinc/75/69/83/449756983.db2.gz	BJSRVXFSPXDLBJ-JQWIXIFHSA-N	-1	3	344.389	1.839	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@]2(C)CC2(F)F)c([N+](=O)[O-])c1	ZINC000594852568	449761574	/nfs/dbraw/zinc/76/15/74/449761574.db2.gz	RHAWSJYUZWQCPJ-LLVKDONJSA-N	-1	3	336.316	1.927	20	5		EDBDHM
CCN1C[C@@H](C)[C@H]([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)C1	ZINC000601358702	449872459	/nfs/dbraw/zinc/87/24/59/449872459.db2.gz	MMMKBJIJHWYQKD-ZYHUDNBSSA-N	-1	3	345.396	1.661	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@]2(C)CCCO2)c(F)cc1[N+](=O)[O-]	ZINC000601368123	449882851	/nfs/dbraw/zinc/88/28/51/449882851.db2.gz	KXRXAAHNFAHTPQ-CYBMUJFWSA-N	-1	3	332.353	1.890	20	5		EDBDHM
O=C(c1cccc([O-])c1)N1CCN(c2cccnc2[N+](=O)[O-])CC1	ZINC000608779057	449934779	/nfs/dbraw/zinc/93/47/79/449934779.db2.gz	NROQWNVKWUEVJW-UHFFFAOYSA-N	-1	3	328.328	1.658	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CO[C@@H](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000599482101	450010082	/nfs/dbraw/zinc/01/00/82/450010082.db2.gz	MRPBQORXUNUIRL-GXSJLCMTSA-N	-1	3	332.403	1.811	20	5		EDBDHM
CC1(C)CNC(=O)[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000595355806	450070759	/nfs/dbraw/zinc/07/07/59/450070759.db2.gz	XQXCUELHHXIYBX-SNVBAGLBSA-N	-1	3	347.780	1.051	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCOC[C@@H]2CCCO2)c(F)c1	ZINC000609675292	450084055	/nfs/dbraw/zinc/08/40/55/450084055.db2.gz	ILAZRAIGBZXBPQ-NSHDSACASA-N	-1	3	348.352	1.208	20	5		EDBDHM
COC(=O)[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000595398645	450113065	/nfs/dbraw/zinc/11/30/65/450113065.db2.gz	SMBAJBXCLMJYQO-ZKCHVHJHSA-N	-1	3	348.764	1.478	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCC[C@H]2N(C)C)cc1[N+](=O)[O-]	ZINC000603314509	450238421	/nfs/dbraw/zinc/23/84/21/450238421.db2.gz	UASDJLCSIZQZIN-NXEZZACHSA-N	-1	3	333.435	1.726	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](CO)CC1CCC1	ZINC000619504387	450494473	/nfs/dbraw/zinc/49/44/73/450494473.db2.gz	WJFPFPHRUGGMTP-NSHDSACASA-N	-1	3	344.389	1.433	20	5		EDBDHM
CC(C)(C)[C@H](CCO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000178561679	526694169	/nfs/dbraw/zinc/69/41/69/526694169.db2.gz	PWPOJQBWGSEUMS-LBPRGKRZSA-N	-1	3	334.369	1.809	20	5		EDBDHM
CC1(C)[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@@H]2CCO[C@@H]21	ZINC000153379607	527828762	/nfs/dbraw/zinc/82/87/62/527828762.db2.gz	LSACVFNFIKQYOF-XDTLVQLUSA-N	-1	3	326.374	1.687	20	5		EDBDHM
Cn1cc(CN[C@@H]2CCN(C(=O)[O-])C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000740290062	579327394	/nfs/dbraw/zinc/32/73/94/579327394.db2.gz	LWWIDCUPYUCGBU-CYBMUJFWSA-N	-1	3	345.359	1.837	20	5		EDBDHM
O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1cncc([O-])c1	ZINC000732392871	578709101	/nfs/dbraw/zinc/70/91/01/578709101.db2.gz	IILFADTWXGLCMJ-UHFFFAOYSA-N	-1	3	332.268	1.919	20	5		EDBDHM
CC(C)[C@H]1CN(C)CCN1c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000735759259	578921202	/nfs/dbraw/zinc/92/12/02/578921202.db2.gz	QQGQFMKTUDYSJC-CQSZACIVSA-N	-1	3	331.380	1.551	20	5		EDBDHM
CCn1c(C)nnc1Sc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000736720230	579015077	/nfs/dbraw/zinc/01/50/77/579015077.db2.gz	NCBGJXVXSQXHSW-UHFFFAOYSA-N	-1	3	332.349	1.846	20	5		EDBDHM
CCn1c(C)nnc1Sc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000736720230	579015078	/nfs/dbraw/zinc/01/50/78/579015078.db2.gz	NCBGJXVXSQXHSW-UHFFFAOYSA-N	-1	3	332.349	1.846	20	5		EDBDHM
O=C([N-]OCCC(F)(F)F)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000777974791	580454003	/nfs/dbraw/zinc/45/40/03/580454003.db2.gz	HTYNBPOLIYTANW-UHFFFAOYSA-N	-1	3	336.222	1.980	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]N=c2nccc[nH]2)c2ncccc12	ZINC000766357772	580165170	/nfs/dbraw/zinc/16/51/70/580165170.db2.gz	YVTHUZLGIFYCSC-UHFFFAOYSA-N	-1	3	346.328	1.238	20	5		EDBDHM
C[C@@H](CO[C@@H]1CCOC1)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768855448	580222664	/nfs/dbraw/zinc/22/26/64/580222664.db2.gz	YUTXPNBNJBTDTQ-DTWKUNHWSA-N	-1	3	336.391	1.129	20	5		EDBDHM
CCc1ccc(C(=O)[N-]N2C(=O)N[C@@](C)(CC)C2=O)cc1[N+](=O)[O-]	ZINC000769856313	580247251	/nfs/dbraw/zinc/24/72/51/580247251.db2.gz	VUNGNUXWOVLQBL-HNNXBMFYSA-N	-1	3	334.332	1.523	20	5		EDBDHM
O=C(CNC(=O)c1cccc([O-])c1)OCc1ccc([N+](=O)[O-])cc1	ZINC000779465266	580486244	/nfs/dbraw/zinc/48/62/44/580486244.db2.gz	SXSUASLZAILQOX-UHFFFAOYSA-N	-1	3	330.296	1.774	20	5		EDBDHM
CCC(CC)OC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000796274634	580949810	/nfs/dbraw/zinc/94/98/10/580949810.db2.gz	PWAAUKQMJKOJAL-UHFFFAOYSA-N	-1	3	330.362	1.605	20	5		EDBDHM
CC(C)(C)CCOC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000796274149	580949818	/nfs/dbraw/zinc/94/98/18/580949818.db2.gz	IXHJINDTCFLYAF-UHFFFAOYSA-N	-1	3	344.389	1.853	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H](O)c2ccsc2)c(-c2nnn[n-]2)c1	ZINC000738373766	598854935	/nfs/dbraw/zinc/85/49/35/598854935.db2.gz	GVHRETVQESVAHG-SNVBAGLBSA-N	-1	3	333.333	1.377	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H](O)c2ccsc2)c(-c2nn[n-]n2)c1	ZINC000738373766	598854936	/nfs/dbraw/zinc/85/49/36/598854936.db2.gz	GVHRETVQESVAHG-SNVBAGLBSA-N	-1	3	333.333	1.377	20	5		EDBDHM
COc1c([O-])ccc(CN2CCC(N3CCCC3=O)CC2)c1[N+](=O)[O-]	ZINC000891935430	590694989	/nfs/dbraw/zinc/69/49/89/590694989.db2.gz	PRQNIZLJJFFVGK-UHFFFAOYSA-N	-1	3	349.387	1.896	20	5		EDBDHM
COCCO[C@H]1CCN(Cc2ccc([O-])c(OC)c2[N+](=O)[O-])C1	ZINC000893873381	591123851	/nfs/dbraw/zinc/12/38/51/591123851.db2.gz	HDRVJMCFABGHKO-LBPRGKRZSA-N	-1	3	326.349	1.546	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1CC(SC)C1	ZINC000907971892	592243445	/nfs/dbraw/zinc/24/34/45/592243445.db2.gz	XJOZTMXBGXLZHT-UHFFFAOYSA-N	-1	3	332.403	1.776	20	5		EDBDHM
CCN1CCN(CCCNc2ccc([N+](=O)[O-])c(C(=O)[O-])c2)CC1	ZINC000910347460	592839723	/nfs/dbraw/zinc/83/97/23/592839723.db2.gz	XUVNSGLSBFRIEW-UHFFFAOYSA-N	-1	3	336.392	1.733	20	5		EDBDHM
C[C@@H](OC(=O)c1cnn[n-]1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000805602720	593110703	/nfs/dbraw/zinc/11/07/03/593110703.db2.gz	AQHVEYBAJBUNBF-ZCFIWIBFSA-N	-1	3	339.695	1.550	20	5		EDBDHM
C[C@@H](OC(=O)c1c[n-]nn1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000805602720	593110705	/nfs/dbraw/zinc/11/07/05/593110705.db2.gz	AQHVEYBAJBUNBF-ZCFIWIBFSA-N	-1	3	339.695	1.550	20	5		EDBDHM
CC(C)(O)CO[N-]C(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000839744924	593378228	/nfs/dbraw/zinc/37/82/28/593378228.db2.gz	IWWNSXQAAXEHJE-UHFFFAOYSA-N	-1	3	327.293	1.254	20	5		EDBDHM
COc1ccc(-c2nnn[n-]2)cc1COc1cccnc1[N+](=O)[O-]	ZINC000821749798	593929213	/nfs/dbraw/zinc/92/92/13/593929213.db2.gz	YOMFRRKGQHHTNE-UHFFFAOYSA-N	-1	3	328.288	1.758	20	5		EDBDHM
COc1ccc(-c2nn[n-]n2)cc1COc1cccnc1[N+](=O)[O-]	ZINC000821749798	593929215	/nfs/dbraw/zinc/92/92/15/593929215.db2.gz	YOMFRRKGQHHTNE-UHFFFAOYSA-N	-1	3	328.288	1.758	20	5		EDBDHM
Cc1cc(=O)n(CCOc2ccccc2-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000822161037	594002158	/nfs/dbraw/zinc/00/21/58/594002158.db2.gz	NNZLBURAJXTRTE-UHFFFAOYSA-N	-1	3	342.315	1.324	20	5		EDBDHM
Cc1cc(=O)n(CCOc2ccccc2-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000822161037	594002162	/nfs/dbraw/zinc/00/21/62/594002162.db2.gz	NNZLBURAJXTRTE-UHFFFAOYSA-N	-1	3	342.315	1.324	20	5		EDBDHM
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)[C@H](O)C(F)(F)F	ZINC000825146319	594136093	/nfs/dbraw/zinc/13/60/93/594136093.db2.gz	CFKPQMBJNIVGJE-SCZZXKLOSA-N	-1	3	346.269	1.889	20	5		EDBDHM
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)[C@H](O)C(F)(F)F	ZINC000825146319	594136095	/nfs/dbraw/zinc/13/60/95/594136095.db2.gz	CFKPQMBJNIVGJE-SCZZXKLOSA-N	-1	3	346.269	1.889	20	5		EDBDHM
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)c1cc(-c2nnn[n-]2)c[nH]1	ZINC000823241708	594174219	/nfs/dbraw/zinc/17/42/19/594174219.db2.gz	DCWXDPPDBQHVAQ-UHFFFAOYSA-N	-1	3	347.722	1.686	20	5		EDBDHM
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)c1cc(-c2nn[n-]n2)c[nH]1	ZINC000823241708	594174220	/nfs/dbraw/zinc/17/42/20/594174220.db2.gz	DCWXDPPDBQHVAQ-UHFFFAOYSA-N	-1	3	347.722	1.686	20	5		EDBDHM
O=C(OCCOc1ccccc1[N+](=O)[O-])c1cc(-c2nnn[n-]2)c[nH]1	ZINC000823409059	594198993	/nfs/dbraw/zinc/19/89/93/594198993.db2.gz	BPJLDUUQKXBZIN-UHFFFAOYSA-N	-1	3	344.287	1.339	20	5		EDBDHM
O=C(OCCOc1ccccc1[N+](=O)[O-])c1cc(-c2nn[n-]n2)c[nH]1	ZINC000823409059	594198994	/nfs/dbraw/zinc/19/89/94/594198994.db2.gz	BPJLDUUQKXBZIN-UHFFFAOYSA-N	-1	3	344.287	1.339	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NCCCO[C@@H]1CCOC1	ZINC000823629773	594222946	/nfs/dbraw/zinc/22/29/46/594222946.db2.gz	GYKIYOUYBFPFAH-LLVKDONJSA-N	-1	3	334.336	1.382	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NCCCO[C@@H]1CCOC1	ZINC000823629773	594222947	/nfs/dbraw/zinc/22/29/47/594222947.db2.gz	GYKIYOUYBFPFAH-LLVKDONJSA-N	-1	3	334.336	1.382	20	5		EDBDHM
Cc1cnc(OCC(=O)c2cccc(-c3nnn[n-]3)c2)c([N+](=O)[O-])c1	ZINC000826319058	594423681	/nfs/dbraw/zinc/42/36/81/594423681.db2.gz	MQCQGJMWXSRHRX-UHFFFAOYSA-N	-1	3	340.299	1.740	20	5		EDBDHM
Cc1cnc(OCC(=O)c2cccc(-c3nn[n-]n3)c2)c([N+](=O)[O-])c1	ZINC000826319058	594423682	/nfs/dbraw/zinc/42/36/82/594423682.db2.gz	MQCQGJMWXSRHRX-UHFFFAOYSA-N	-1	3	340.299	1.740	20	5		EDBDHM
NC(=O)CCC1CCN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1	ZINC000826391064	594456847	/nfs/dbraw/zinc/45/68/47/594456847.db2.gz	VWUDZWADMDQFGO-UHFFFAOYSA-N	-1	3	345.363	1.257	20	5		EDBDHM
NC(=O)CCC1CCN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1	ZINC000826391064	594456850	/nfs/dbraw/zinc/45/68/50/594456850.db2.gz	VWUDZWADMDQFGO-UHFFFAOYSA-N	-1	3	345.363	1.257	20	5		EDBDHM
O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000826469357	594488128	/nfs/dbraw/zinc/48/81/28/594488128.db2.gz	DISURESKHBJZOS-UHFFFAOYSA-N	-1	3	339.315	1.302	20	5		EDBDHM
O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000826469357	594488130	/nfs/dbraw/zinc/48/81/30/594488130.db2.gz	DISURESKHBJZOS-UHFFFAOYSA-N	-1	3	339.315	1.302	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@@H]2CCO[C@]3(CCOC3)C2)c(-c2nnn[n-]2)c1	ZINC000826498733	594502772	/nfs/dbraw/zinc/50/27/72/594502772.db2.gz	HJJSUKLTGKZFDG-MEBBXXQBSA-N	-1	3	346.347	1.525	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@@H]2CCO[C@]3(CCOC3)C2)c(-c2nn[n-]n2)c1	ZINC000826498733	594502774	/nfs/dbraw/zinc/50/27/74/594502774.db2.gz	HJJSUKLTGKZFDG-MEBBXXQBSA-N	-1	3	346.347	1.525	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCn3ccnc32)c([N+](=O)[O-])c1	ZINC000831744431	594698540	/nfs/dbraw/zinc/69/85/40/594698540.db2.gz	NTSPLFHTPMHMEI-SNVBAGLBSA-N	-1	3	338.345	1.223	20	5		EDBDHM
O=C([O-])N1CCC[C@@H]1[C@H]1CCCCN1CCn1cc([N+](=O)[O-])cn1	ZINC000831998288	594717960	/nfs/dbraw/zinc/71/79/60/594717960.db2.gz	TULZRZPOXIJMES-ZIAGYGMSSA-N	-1	3	337.380	1.788	20	5		EDBDHM
Cc1cc(NC[C@@H]2CN3CCC[C@@H]3CO2)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000844208145	595302777	/nfs/dbraw/zinc/30/27/77/595302777.db2.gz	ICPSYOHHLOUCPD-VXGBXAGGSA-N	-1	3	335.360	1.877	20	5		EDBDHM
O=C(NCC[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000848579618	595407615	/nfs/dbraw/zinc/40/76/15/595407615.db2.gz	JSAKQXGORFBOPO-UHFFFAOYSA-N	-1	3	343.286	1.209	20	5		EDBDHM
COC[C@H](CCO)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848584395	595409616	/nfs/dbraw/zinc/40/96/16/595409616.db2.gz	WWAQXYLZRUEZNU-VIFPVBQESA-N	-1	3	334.275	1.080	20	5		EDBDHM
C[C@H]1OCC[C@@]1(O)C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848592055	595412163	/nfs/dbraw/zinc/41/21/63/595412163.db2.gz	WGAQIGSOJUMXCV-NOZJJQNGSA-N	-1	3	346.286	1.223	20	5		EDBDHM
CC1(C)CN=C(N2CCN(c3cc[n-]c(=O)c3[N+](=O)[O-])CC2)S1	ZINC000853435683	595751179	/nfs/dbraw/zinc/75/11/79/595751179.db2.gz	SHHTXBLFWFPXMW-UHFFFAOYSA-N	-1	3	337.405	1.699	20	5		EDBDHM
O=[N+]([O-])c1cnn(Cc2nnc(-c3ccc(-c4nnn[n-]4)cc3)o2)c1	ZINC000738373471	599165791	/nfs/dbraw/zinc/16/57/91/599165791.db2.gz	DEZXQBWUEYVNFI-UHFFFAOYSA-N	-1	3	339.275	1.070	20	5		EDBDHM
O=[N+]([O-])c1cnn(Cc2nnc(-c3ccc(-c4nn[n-]n4)cc3)o2)c1	ZINC000738373471	599165793	/nfs/dbraw/zinc/16/57/93/599165793.db2.gz	DEZXQBWUEYVNFI-UHFFFAOYSA-N	-1	3	339.275	1.070	20	5		EDBDHM
O=C([N-]OCCN1CCCC1=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000856042117	595883439	/nfs/dbraw/zinc/88/34/39/595883439.db2.gz	SRLCNDGOOUYVAY-UHFFFAOYSA-N	-1	3	327.724	1.532	20	5		EDBDHM
COC(=O)c1ccnc(NCc2nnc(C(F)(F)F)[n-]2)c1[N+](=O)[O-]	ZINC000856742685	596068383	/nfs/dbraw/zinc/06/83/83/596068383.db2.gz	SVFVTVPZDGYTMY-UHFFFAOYSA-N	-1	3	346.225	1.525	20	5		EDBDHM
COC(=O)c1ccnc(NCc2n[n-]c(C(F)(F)F)n2)c1[N+](=O)[O-]	ZINC000856742685	596068387	/nfs/dbraw/zinc/06/83/87/596068387.db2.gz	SVFVTVPZDGYTMY-UHFFFAOYSA-N	-1	3	346.225	1.525	20	5		EDBDHM
COC(=O)c1ccnc(NCc2nc(C(F)(F)F)n[n-]2)c1[N+](=O)[O-]	ZINC000856742685	596068390	/nfs/dbraw/zinc/06/83/90/596068390.db2.gz	SVFVTVPZDGYTMY-UHFFFAOYSA-N	-1	3	346.225	1.525	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCCN(C)C2)cc1F	ZINC000866577044	596255930	/nfs/dbraw/zinc/25/59/30/596255930.db2.gz	MSNAURCJZWQQAK-SNVBAGLBSA-N	-1	3	331.369	1.415	20	5		EDBDHM
COC[C@@H]1CCCN1[N-]C(=O)c1c(F)c(C)cc([N+](=O)[O-])c1F	ZINC000862591198	596353006	/nfs/dbraw/zinc/35/30/06/596353006.db2.gz	QUGIERUJWIRLNY-VIFPVBQESA-N	-1	3	329.303	1.937	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2[C@H]3C[C@H]4CO[C@H]2[C@H]4C3)c(F)c1	ZINC000867614626	596461993	/nfs/dbraw/zinc/46/19/93/596461993.db2.gz	URDFZIAFSUEMEB-FDEBYTSZSA-N	-1	3	342.348	1.436	20	5		EDBDHM
Cc1cccc([C@H](O)C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)c1	ZINC000120031516	596879095	/nfs/dbraw/zinc/87/90/95/596879095.db2.gz	VQQPOXACHRDHGT-GFCCVEGCSA-N	-1	3	342.398	1.977	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@H]2C=C[C@H]3C[C@@H]2CO3)c([N+](=O)[O-])s1	ZINC000921617819	703677558	/nfs/dbraw/zinc/67/75/58/703677558.db2.gz	WMNKOZPKVBPLMD-AXFHLTTASA-N	-1	3	344.414	1.834	20	5		EDBDHM
O=C(Nc1nnc(C(F)(F)F)s1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000186888415	304020468	/nfs/dbraw/zinc/02/04/68/304020468.db2.gz	DSQBINSSVJBCBD-UHFFFAOYSA-N	-1	3	335.223	1.818	20	5		EDBDHM
CNC(=O)C[C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000451952869	305373686	/nfs/dbraw/zinc/37/36/86/305373686.db2.gz	HSOBUSDSWFXCMJ-SSDOTTSWSA-N	-1	3	335.769	1.051	20	5		EDBDHM
COCC(C)(C)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000490289789	255083212	/nfs/dbraw/zinc/08/32/12/255083212.db2.gz	HBYCSFNZKCXXOO-UHFFFAOYSA-N	-1	3	332.378	1.554	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2CC[C@H](O)CC2)cc1[N+](=O)[O-]	ZINC000491599305	255131610	/nfs/dbraw/zinc/13/16/10/255131610.db2.gz	PZRLQIPYHUDGCQ-KYZUINATSA-N	-1	3	348.352	1.324	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCCC[C@@H]1OC	ZINC000266166984	139518814	/nfs/dbraw/zinc/51/88/14/139518814.db2.gz	INBZATGVMGWYKJ-RYUDHWBXSA-N	-1	3	344.389	1.839	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](CCO)C(C)C)c([N+](=O)[O-])c1	ZINC000269860766	140007866	/nfs/dbraw/zinc/00/78/66/140007866.db2.gz	RZHXNVFGXNMDIW-LLVKDONJSA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2(C)OCCO2)cc1C	ZINC000271076188	140231577	/nfs/dbraw/zinc/23/15/77/140231577.db2.gz	RTGZYZSLBNLNGS-UHFFFAOYSA-N	-1	3	330.362	1.253	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1ccoc1	ZINC000322157387	140661389	/nfs/dbraw/zinc/66/13/89/140661389.db2.gz	GIDDRQWRRVWQCU-UHFFFAOYSA-N	-1	3	340.313	1.453	20	5		EDBDHM
CCOC(=O)CC[C@@H](C)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000270475097	285718782	/nfs/dbraw/zinc/71/87/82/285718782.db2.gz	IJHSETJILLYCSL-LLVKDONJSA-N	-1	3	344.389	1.913	20	5		EDBDHM
Cc1ncc(CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c(=O)[n-]1	ZINC000345124482	143053578	/nfs/dbraw/zinc/05/35/78/143053578.db2.gz	LHMUVQZAOOMLFF-UHFFFAOYSA-N	-1	3	341.327	1.670	20	5		EDBDHM
COCC(C)(C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC	ZINC000345534392	143102767	/nfs/dbraw/zinc/10/27/67/143102767.db2.gz	FKHDFEGGIZSBMV-UHFFFAOYSA-N	-1	3	346.361	1.085	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]Cc1nc(CO)cs1	ZINC000347389693	143315972	/nfs/dbraw/zinc/31/59/72/143315972.db2.gz	JKMSKNUTSNHYMP-UHFFFAOYSA-N	-1	3	343.386	1.331	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](CO)C2CC2)c1C	ZINC000352599974	149081390	/nfs/dbraw/zinc/08/13/90/149081390.db2.gz	KKLAZABYNYEXDV-LBPRGKRZSA-N	-1	3	328.390	1.508	20	5		EDBDHM
Cc1cc(CC[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])on1	ZINC000352649982	149101838	/nfs/dbraw/zinc/10/18/38/149101838.db2.gz	WKJPTVWJULHNHI-UHFFFAOYSA-N	-1	3	325.346	1.721	20	5		EDBDHM
Cn1ncc2c1ncc(C(=O)NCCc1ccccc1[N+](=O)[O-])c2[O-]	ZINC000358339136	151342292	/nfs/dbraw/zinc/34/22/92/151342292.db2.gz	GNZFQEAICMUHOL-UHFFFAOYSA-N	-1	3	341.327	1.555	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)N1C[C@H](C)OC[C@H]1C	ZINC000361133860	152316677	/nfs/dbraw/zinc/31/66/77/152316677.db2.gz	ZZCGCEQLUCJRNJ-ZJUUUORDSA-N	-1	3	345.377	1.369	20	5		EDBDHM
NC(=O)CSc1ccccc1[N-]C(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000352424059	162174761	/nfs/dbraw/zinc/17/47/61/162174761.db2.gz	QPMYSHPVCWTSGU-UHFFFAOYSA-N	-1	3	347.356	1.402	20	5		EDBDHM
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NCc1ncccc1[O-]	ZINC000352500759	162215789	/nfs/dbraw/zinc/21/57/89/162215789.db2.gz	LHLSVUFVXXAVGA-SNVBAGLBSA-N	-1	3	348.363	1.244	20	5		EDBDHM
O=C(Cc1cc2c(cc1[N+](=O)[O-])OCCO2)NCc1ncccc1[O-]	ZINC000352511201	162222084	/nfs/dbraw/zinc/22/20/84/162222084.db2.gz	XDDVDGGQRKMRRR-UHFFFAOYSA-N	-1	3	345.311	1.326	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H](CO)C2CC2)c(Cl)c1	ZINC000352551316	162246844	/nfs/dbraw/zinc/24/68/44/162246844.db2.gz	NCZVTMABCFGPMC-SECBINFHSA-N	-1	3	334.781	1.545	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCCC[C@@H]2O)c1C	ZINC000158478106	225025622	/nfs/dbraw/zinc/02/56/22/225025622.db2.gz	QYAYVTRBOCRMJO-AAEUAGOBSA-N	-1	3	328.390	1.793	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCC(=O)N(C)C2)cc1C	ZINC000160097915	225336921	/nfs/dbraw/zinc/33/69/21/225336921.db2.gz	XGJPNAHUVSWGPX-NSHDSACASA-N	-1	3	341.389	1.111	20	5		EDBDHM
CC(C)C[C@H](CCO)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000124164103	222385031	/nfs/dbraw/zinc/38/50/31/222385031.db2.gz	JJIXXOVCCSKCCG-LBPRGKRZSA-N	-1	3	330.406	1.918	20	5		EDBDHM
CCOC(=O)N1CC[C@@H](NCc2cc(OC)c([O-])cc2[N+](=O)[O-])C1	ZINC000274619184	268170370	/nfs/dbraw/zinc/17/03/70/268170370.db2.gz	VUNJDRZZDVZCRO-LLVKDONJSA-N	-1	3	339.348	1.629	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2C[C@H](O)C2(C)C)c([N+](=O)[O-])c1	ZINC000275356604	268329049	/nfs/dbraw/zinc/32/90/49/268329049.db2.gz	HWUMUYLRVQNAOE-RYUDHWBXSA-N	-1	3	330.362	1.041	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1C[C@@H](O)C1(C)C	ZINC000275377077	268333105	/nfs/dbraw/zinc/33/31/05/268333105.db2.gz	LTRZFUSXQCRVCX-VXGBXAGGSA-N	-1	3	330.362	1.041	20	5		EDBDHM
COC[C@H](C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])OC	ZINC000276888863	268493815	/nfs/dbraw/zinc/49/38/15/268493815.db2.gz	UDECHNVWRRXGKB-NSHDSACASA-N	-1	3	332.378	1.151	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCSC1	ZINC000273585462	273046642	/nfs/dbraw/zinc/04/66/42/273046642.db2.gz	PTMOCLNFKSISJJ-MRVPVSSYSA-N	-1	3	346.386	1.165	20	5		EDBDHM
CCOc1cc([N+](=O)[O-])c(C(=O)[N-]OC[C@@H]2CCOC2)cc1OC	ZINC000276350260	273162276	/nfs/dbraw/zinc/16/22/76/273162276.db2.gz	WNDAMYXHKIWALG-SNVBAGLBSA-N	-1	3	340.332	1.700	20	5		EDBDHM
CC1(C)CCC[C@]1(O)C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000292867238	289458487	/nfs/dbraw/zinc/45/84/87/289458487.db2.gz	SCTXCLZTTNPQPN-HNNXBMFYSA-N	-1	3	342.417	1.955	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCCCC[C@@H]1O	ZINC000344966772	302048133	/nfs/dbraw/zinc/04/81/33/302048133.db2.gz	PZZKZLUNAQPJEY-YPMHNXCESA-N	-1	3	328.390	1.875	20	5		EDBDHM
CCN1CC[C@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])c([O-])c3)[C@H]2C1	ZINC000293845602	303028077	/nfs/dbraw/zinc/02/80/77/303028077.db2.gz	IFEUETKSEBJDGA-DZGCQCFKSA-N	-1	3	335.360	1.236	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@]2(O)CCC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000294422338	303104697	/nfs/dbraw/zinc/10/46/97/303104697.db2.gz	DMNCUDWPOYAFPB-HZMBPMFUSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COC(=O)CCC[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000295154496	303181125	/nfs/dbraw/zinc/18/11/25/303181125.db2.gz	FVUUQVRRHAGXTI-UHFFFAOYSA-N	-1	3	330.362	1.443	20	5		EDBDHM
COc1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc1NC(N)=O	ZINC000427977763	305002865	/nfs/dbraw/zinc/00/28/65/305002865.db2.gz	VLSNKAKHVWGYHW-UHFFFAOYSA-N	-1	3	347.287	1.447	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@]2(C)CCCOC2)cc1[N+](=O)[O-]	ZINC000493737762	305625022	/nfs/dbraw/zinc/62/50/22/305625022.db2.gz	NQWWREKQPHRKGR-ZDUSSCGKSA-N	-1	3	348.352	1.590	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNc1ncc([N+](=O)[O-])cc1Br	ZINC000531140698	305953699	/nfs/dbraw/zinc/95/36/99/305953699.db2.gz	GNDLRLZVEOTDRQ-QMMMGPOBSA-N	-1	3	342.153	1.676	20	5		EDBDHM
Cc1nnc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)s1	ZINC000541870700	306048678	/nfs/dbraw/zinc/04/86/78/306048678.db2.gz	YBEXBZWNTUOONK-UHFFFAOYSA-N	-1	3	328.375	1.542	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1cc(C)no1	ZINC000065750379	441482253	/nfs/dbraw/zinc/48/22/53/441482253.db2.gz	IEUZZCRGVSMCAT-UHFFFAOYSA-N	-1	3	327.318	1.378	20	5		EDBDHM
CCN1CCN([C@@H](C)CNC(=O)c2cccc([N+](=O)[O-])c2[O-])CC1	ZINC000137060780	441743424	/nfs/dbraw/zinc/74/34/24/441743424.db2.gz	GWFBGBROUODRRL-LBPRGKRZSA-N	-1	3	336.392	1.056	20	5		EDBDHM
CC1CCN(C[C@@H](O)CNC(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC1	ZINC000116448311	441823431	/nfs/dbraw/zinc/82/34/31/441823431.db2.gz	QWURYKWNQRVKKM-ZDUSSCGKSA-N	-1	3	337.376	1.123	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nnc(-c2ccccn2)[n-]1	ZINC000126592243	442124752	/nfs/dbraw/zinc/12/47/52/442124752.db2.gz	KSDLLOLRKVLLGR-UHFFFAOYSA-N	-1	3	342.319	1.309	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nc(-c2ccccn2)n[n-]1	ZINC000126592243	442124755	/nfs/dbraw/zinc/12/47/55/442124755.db2.gz	KSDLLOLRKVLLGR-UHFFFAOYSA-N	-1	3	342.319	1.309	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1n[n-]c(-c2ccccn2)n1	ZINC000126592243	442124759	/nfs/dbraw/zinc/12/47/59/442124759.db2.gz	KSDLLOLRKVLLGR-UHFFFAOYSA-N	-1	3	342.319	1.309	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H](C)C[S@@](C)=O)cc1[N+](=O)[O-]	ZINC000127054408	442166382	/nfs/dbraw/zinc/16/63/82/442166382.db2.gz	OWFQKJFYMNKGIU-QQOXFEPMSA-N	-1	3	326.421	1.010	20	5		EDBDHM
O=C(NCCN1CCc2sccc2C1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000097152513	442176282	/nfs/dbraw/zinc/17/62/82/442176282.db2.gz	NRWVLTSHGARUNR-UHFFFAOYSA-N	-1	3	348.384	1.133	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CCCC[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000133980398	442444191	/nfs/dbraw/zinc/44/41/91/442444191.db2.gz	DRXAVMBJBRHIEH-VXGBXAGGSA-N	-1	3	328.390	1.733	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@]2(C1)NC(=O)[N-]C2=O	ZINC000192661800	442674002	/nfs/dbraw/zinc/67/40/02/442674002.db2.gz	GWPXDSWTZVEYJT-BDJLRTHQSA-N	-1	3	332.360	1.638	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCN(C)C(=O)C2)cc1C	ZINC000192655405	442673050	/nfs/dbraw/zinc/67/30/50/442673050.db2.gz	LRMSKQHLXONIMO-LLVKDONJSA-N	-1	3	341.389	1.111	20	5		EDBDHM
CN1CC[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1=O	ZINC000192659499	442673261	/nfs/dbraw/zinc/67/32/61/442673261.db2.gz	ITERGLNJRZYYOX-MRVPVSSYSA-N	-1	3	347.780	1.147	20	5		EDBDHM
Cc1ccnc(N2CCN(C(=O)c3ccc([O-])cc3)CC2)c1[N+](=O)[O-]	ZINC000267909968	442785002	/nfs/dbraw/zinc/78/50/02/442785002.db2.gz	FSUIBCSMYHGWBF-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)C[S@@](C)=O)cc1C	ZINC000183189316	442899139	/nfs/dbraw/zinc/89/91/39/442899139.db2.gz	BZRQCLAUWPTQRN-CFMSYZGJSA-N	-1	3	334.419	1.257	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H](C)c2nc[nH]n2)cc1[N+](=O)[O-]	ZINC000183207727	442903484	/nfs/dbraw/zinc/90/34/84/442903484.db2.gz	QIXYRVRJMRRPSI-SSDOTTSWSA-N	-1	3	345.768	1.714	20	5		EDBDHM
CNC(=O)[C@H]([N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C(C)C	ZINC000190080751	443054571	/nfs/dbraw/zinc/05/45/71/443054571.db2.gz	VTMAFVVWADADGT-LLVKDONJSA-N	-1	3	343.405	1.261	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2c(C)noc2C)c([N+](=O)[O-])c1	ZINC000299200812	318887289	/nfs/dbraw/zinc/88/72/89/318887289.db2.gz	CIYALKHNWDZRLH-UHFFFAOYSA-N	-1	3	341.345	1.687	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1C[C@@H](OC(C)C)C1	ZINC000416532409	319440073	/nfs/dbraw/zinc/44/00/73/319440073.db2.gz	WYMCOQJYXUTWOA-KLPPZKSPSA-N	-1	3	344.389	1.838	20	5		EDBDHM
CCOC(=O)C(C)(C)[N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1	ZINC000272586823	443373387	/nfs/dbraw/zinc/37/33/87/443373387.db2.gz	ZDGDBCVSUGHRHL-UHFFFAOYSA-N	-1	3	344.389	1.398	20	5		EDBDHM
COC[C@H](C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])OC	ZINC000272641168	443392505	/nfs/dbraw/zinc/39/25/05/443392505.db2.gz	CPYHGPDITHKJDO-NSHDSACASA-N	-1	3	332.378	1.151	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])[C@@H]1CCCO1	ZINC000278736817	443420153	/nfs/dbraw/zinc/42/01/53/443420153.db2.gz	MKSSXACLUDOYKW-PWSUYJOCSA-N	-1	3	330.362	1.067	20	5		EDBDHM
COC(=O)[C@@H]([N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000272406361	443615364	/nfs/dbraw/zinc/61/53/64/443615364.db2.gz	BQTDYFQXXGZUBZ-ZDUSSCGKSA-N	-1	3	342.373	1.008	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCN2CC=CCC2)c1C	ZINC000280342055	443697822	/nfs/dbraw/zinc/69/78/22/443697822.db2.gz	VUBJSBAILMUMGM-UHFFFAOYSA-N	-1	3	339.417	1.752	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CC[C@H](O)C1	ZINC000276629811	443771457	/nfs/dbraw/zinc/77/14/57/443771457.db2.gz	GDCIQAXLTNGSDM-KOLCDFICSA-N	-1	3	330.362	1.043	20	5		EDBDHM
O=[N+]([O-])c1c(F)cccc1S(=O)(=O)[N-][C@@H]1CCN2CCCC[C@@H]12	ZINC000299047902	443937729	/nfs/dbraw/zinc/93/77/29/443937729.db2.gz	GIBWLFBMTWPSOB-NEPJUHHUSA-N	-1	3	343.380	1.639	20	5		EDBDHM
COc1cc(CN[C@@H](CO)C[C@@H](O)C(C)(C)C)c([N+](=O)[O-])cc1[O-]	ZINC000570806588	321358649	/nfs/dbraw/zinc/35/86/49/321358649.db2.gz	GNBVHVWVWPNWRT-IAQYHMDHSA-N	-1	3	342.392	1.557	20	5		EDBDHM
C[C@@]1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCOC1=O	ZINC000289453672	444148406	/nfs/dbraw/zinc/14/84/06/444148406.db2.gz	FVVAHBVIYLPKFZ-LLVKDONJSA-N	-1	3	334.737	1.232	20	5		EDBDHM
CCC[C@@H](CCO)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000323339846	444342799	/nfs/dbraw/zinc/34/27/99/444342799.db2.gz	WYYABAKAQVCOLD-NSHDSACASA-N	-1	3	346.405	1.680	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CCC[C@@H](O)C1	ZINC000323724080	444345741	/nfs/dbraw/zinc/34/57/41/444345741.db2.gz	OKAUKTUUBTZZHP-CMPLNLGQSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CC[C@](C)([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C(=O)OC	ZINC000337750879	444388544	/nfs/dbraw/zinc/38/85/44/444388544.db2.gz	PWPWERWIHZRDIH-ZDUSSCGKSA-N	-1	3	330.362	1.523	20	5		EDBDHM
COCCOCCC[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000337772911	444399135	/nfs/dbraw/zinc/39/91/35/444399135.db2.gz	DHPXZZYBPSHOCS-UHFFFAOYSA-N	-1	3	332.378	1.235	20	5		EDBDHM
Cc1cc(=O)[n-]c([C@H](C)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)n1	ZINC000580617774	322073739	/nfs/dbraw/zinc/07/37/39/322073739.db2.gz	OBJFKRCQDXKIQQ-LBPRGKRZSA-N	-1	3	344.375	1.677	20	5		EDBDHM
Cc1c(NC(=O)[C@@H](C)Sc2n[n-]c(CO)n2)cccc1[N+](=O)[O-]	ZINC000580692919	322082166	/nfs/dbraw/zinc/08/21/66/322082166.db2.gz	QJFMZUOMVAAHIZ-MRVPVSSYSA-N	-1	3	337.361	1.633	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC[C@@H]1CCOC1	ZINC000343992156	444714019	/nfs/dbraw/zinc/71/40/19/444714019.db2.gz	MRYNLWCCTAHWQB-SNVBAGLBSA-N	-1	3	330.362	1.308	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC(C)(C)C[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000342614015	444776722	/nfs/dbraw/zinc/77/67/22/444776722.db2.gz	YYZNWMBOLLMQBT-LLVKDONJSA-N	-1	3	330.406	1.979	20	5		EDBDHM
O=C(Nc1ccc(OC(F)F)nc1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000338752260	444837503	/nfs/dbraw/zinc/83/75/03/444837503.db2.gz	FUKGKUGERDMPMM-UHFFFAOYSA-N	-1	3	326.215	1.944	20	5		EDBDHM
CCn1cnc(S(=O)(=O)[N-]Cc2ccc([N+](=O)[O-])cc2Cl)c1	ZINC000341640902	444930075	/nfs/dbraw/zinc/93/00/75/444930075.db2.gz	NYZGJDBKGKRMCZ-UHFFFAOYSA-N	-1	3	344.780	1.943	20	5		EDBDHM
COC(=O)c1cccc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])[n-]c21	ZINC000344457619	444986759	/nfs/dbraw/zinc/98/67/59/444986759.db2.gz	PUXPGLLKBWZJIW-UHFFFAOYSA-N	-1	3	330.260	1.233	20	5		EDBDHM
COC(=O)c1cccc2[n-]c(NC(=O)c3n[nH]cc3[N+](=O)[O-])nc21	ZINC000344457619	444986762	/nfs/dbraw/zinc/98/67/62/444986762.db2.gz	PUXPGLLKBWZJIW-UHFFFAOYSA-N	-1	3	330.260	1.233	20	5		EDBDHM
O=[N+]([O-])c1cccc(S(=O)(=O)[N-][C@@H](CO)CC(F)(F)F)c1	ZINC000354630949	445321313	/nfs/dbraw/zinc/32/13/13/445321313.db2.gz	WUBIXMMXPHFPRQ-SSDOTTSWSA-N	-1	3	328.268	1.186	20	5		EDBDHM
COC(=O)c1c(C)nc(=O)[n-]c1SCCn1cc([N+](=O)[O-])cn1	ZINC000348132487	445285194	/nfs/dbraw/zinc/28/51/94/445285194.db2.gz	LDCJXDXQPCWWSS-UHFFFAOYSA-N	-1	3	339.333	1.174	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2CCN(C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000360258160	445661889	/nfs/dbraw/zinc/66/18/89/445661889.db2.gz	OEFUBOQHBSUCEP-CHWSQXEVSA-N	-1	3	341.433	1.973	20	5		EDBDHM
C/C=C\C[C@@H](CO)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000351597654	446195267	/nfs/dbraw/zinc/19/52/67/446195267.db2.gz	RCGMKESSVWTNAA-ZMWSMAPVSA-N	-1	3	334.781	1.854	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCCC2(O)CCC2)cc1[N+](=O)[O-]	ZINC000420717724	446768648	/nfs/dbraw/zinc/76/86/48/446768648.db2.gz	MGKLQQAZOXGKQP-UHFFFAOYSA-N	-1	3	334.419	1.938	20	5		EDBDHM
O=C(Nc1cccc(-c2c[nH]nn2)c1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000442673578	446932704	/nfs/dbraw/zinc/93/27/04/446932704.db2.gz	UZGUEODHQKYDJA-UHFFFAOYSA-N	-1	3	326.272	1.733	20	5		EDBDHM
O=C(NC1CCN([C@H]2CCOC2)CC1)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000371783703	446964598	/nfs/dbraw/zinc/96/45/98/446964598.db2.gz	LOVUTSFTFHQSQF-ZDUSSCGKSA-N	-1	3	335.360	1.284	20	5		EDBDHM
CC[C@@H](C)[C@](C)(O)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000443303003	447027898	/nfs/dbraw/zinc/02/78/98/447027898.db2.gz	QOIQUVDMQAMOPJ-QMTHXVAHSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CCc1cc(C(=O)OC)c([N-]C(=O)c2nn(C)cc2[N+](=O)[O-])s1	ZINC000425641629	447250471	/nfs/dbraw/zinc/25/04/71/447250471.db2.gz	WGGRXKHVADXUTI-UHFFFAOYSA-N	-1	3	338.345	1.991	20	5		EDBDHM
Cc1nn(C)cc1C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000416450915	447607270	/nfs/dbraw/zinc/60/72/70/447607270.db2.gz	ACVVBDVXXUXBAZ-UHFFFAOYSA-N	-1	3	338.389	1.732	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1C(=O)Nc1nnc(C(F)(F)F)[n-]1	ZINC000427817381	447653822	/nfs/dbraw/zinc/65/38/22/447653822.db2.gz	FOOHWLRLGKWISB-UHFFFAOYSA-N	-1	3	331.210	1.993	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1C(=O)Nc1nc(C(F)(F)F)n[n-]1	ZINC000427817381	447653827	/nfs/dbraw/zinc/65/38/27/447653827.db2.gz	FOOHWLRLGKWISB-UHFFFAOYSA-N	-1	3	331.210	1.993	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1C(=O)Nc1n[n-]c(C(F)(F)F)n1	ZINC000427817381	447653834	/nfs/dbraw/zinc/65/38/34/447653834.db2.gz	FOOHWLRLGKWISB-UHFFFAOYSA-N	-1	3	331.210	1.993	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C(C)(C)c2cn(C)nn2)c([N+](=O)[O-])c1	ZINC000517742125	448612942	/nfs/dbraw/zinc/61/29/42/448612942.db2.gz	NGGMQOOBSLNNAU-UHFFFAOYSA-N	-1	3	339.377	1.245	20	5		EDBDHM
COCCN(CCN(C)C)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000592758836	448973647	/nfs/dbraw/zinc/97/36/47/448973647.db2.gz	QWKUVDQPYBXHJX-UHFFFAOYSA-N	-1	3	345.783	1.604	20	5		EDBDHM
CN1CCC2(CC1)CN(C(=O)c1ccc([N+](=O)[O-])c([O-])c1)CCO2	ZINC000592898594	449042730	/nfs/dbraw/zinc/04/27/30/449042730.db2.gz	IZNPMVICROSVKQ-UHFFFAOYSA-N	-1	3	335.360	1.237	20	5		EDBDHM
C[C@@]1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCCC[C@@H]1O	ZINC000593562691	449352255	/nfs/dbraw/zinc/35/22/55/449352255.db2.gz	XIRYNDFBKCIJNY-AAEUAGOBSA-N	-1	3	329.378	1.209	20	5		EDBDHM
CC1CCN(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CC1	ZINC000593531650	449329331	/nfs/dbraw/zinc/32/93/31/449329331.db2.gz	SAUPSNDEQOWILU-UHFFFAOYSA-N	-1	3	328.394	1.000	20	5		EDBDHM
O=c1[n-]ccc(N2CCO[C@H](COc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000596208691	449415798	/nfs/dbraw/zinc/41/57/98/449415798.db2.gz	VKDIKQGUOWULBL-ZDUSSCGKSA-N	-1	3	331.328	1.980	20	5		EDBDHM
O=c1[n-]ccc(NCCCN2C(=O)COc3ccccc32)c1[N+](=O)[O-]	ZINC000596139083	449382374	/nfs/dbraw/zinc/38/23/74/449382374.db2.gz	BBAXUKUWKISSSP-UHFFFAOYSA-N	-1	3	344.327	1.923	20	5		EDBDHM
CC(C)OC(=O)CNC(=O)[C@H](C)Sc1cc[n-]c(=O)c1[N+](=O)[O-]	ZINC000596270285	449448411	/nfs/dbraw/zinc/44/84/11/449448411.db2.gz	YNAWHOMWAQMEPE-QMMMGPOBSA-N	-1	3	343.361	1.244	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCCN(C)C2)cc1[N+](=O)[O-]	ZINC000614539168	449677541	/nfs/dbraw/zinc/67/75/41/449677541.db2.gz	ABFIJXYLJOJWKS-SECBINFHSA-N	-1	3	347.368	1.115	20	5		EDBDHM
CC(C)(C)N1CC[C@@H](C[N-]S(=O)(=O)c2cccnc2[N+](=O)[O-])C1	ZINC000594787588	449696258	/nfs/dbraw/zinc/69/62/58/449696258.db2.gz	ANSKIGJRWNDTKH-NSHDSACASA-N	-1	3	342.421	1.389	20	5		EDBDHM
CC(C)(C)N1CC[C@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000594790805	449700515	/nfs/dbraw/zinc/70/05/15/449700515.db2.gz	XMBMKBMKOCTHSG-JTQLQIEISA-N	-1	3	328.394	1.141	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CO)C2CCC2)cc1C	ZINC000594801626	449712633	/nfs/dbraw/zinc/71/26/33/449712633.db2.gz	QEGQDGMZENQGMM-GFCCVEGCSA-N	-1	3	328.390	1.651	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CO)C2CCC2)cc1C	ZINC000594801627	449712659	/nfs/dbraw/zinc/71/26/59/449712659.db2.gz	QEGQDGMZENQGMM-LBPRGKRZSA-N	-1	3	328.390	1.651	20	5		EDBDHM
C[C@@H](CN(C)C)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594779907	449691896	/nfs/dbraw/zinc/69/18/96/449691896.db2.gz	UGMWKAZPYUPRSN-JTQLQIEISA-N	-1	3	338.389	1.371	20	5		EDBDHM
CN1CCCC[C@@H](C[N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000599412631	449958193	/nfs/dbraw/zinc/95/81/93/449958193.db2.gz	LXZSHJAKCAMUAX-NSHDSACASA-N	-1	3	345.396	1.744	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1[C@H](C)O[C@H](C)[C@H]1C	ZINC000599460161	449993654	/nfs/dbraw/zinc/99/36/54/449993654.db2.gz	UDGMIOINBICJCM-DCQANWLSSA-N	-1	3	328.390	1.993	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1[C@H](C)O[C@@H](C)[C@H]1C	ZINC000599460560	449994632	/nfs/dbraw/zinc/99/46/32/449994632.db2.gz	ZCLIPAZAIUKTTL-QYTUQVAYSA-N	-1	3	344.389	1.694	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2C[C@H]3OCCC[C@@H]23)c([N+](=O)[O-])c1	ZINC000615186999	449995153	/nfs/dbraw/zinc/99/51/53/449995153.db2.gz	AHYAOQCLOCDEHK-DMDPSCGWSA-N	-1	3	326.374	1.749	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1scnc1C	ZINC000619482156	450486391	/nfs/dbraw/zinc/48/63/91/450486391.db2.gz	VNKUSIAADASCHN-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1C(=O)OCc1nc2c(cnn2C)c(=O)[n-]1	ZINC000742994299	579467039	/nfs/dbraw/zinc/46/70/39/579467039.db2.gz	CFHUQRIYRXLBFG-UHFFFAOYSA-N	-1	3	343.299	1.643	20	5		EDBDHM
C[C@H](OC(=O)c1cncc([O-])c1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000731914954	578683099	/nfs/dbraw/zinc/68/30/99/578683099.db2.gz	CZPMNJYFNDFREK-VIFPVBQESA-N	-1	3	331.284	1.879	20	5		EDBDHM
C[C@H]([C@H](C)Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])N1CCOCC1	ZINC000736136772	578956161	/nfs/dbraw/zinc/95/61/61/578956161.db2.gz	HJZNTAURFDCUDL-WDEREUQCSA-N	-1	3	347.379	1.296	20	5		EDBDHM
C[C@H]([C@H](C)Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])N1CCOCC1	ZINC000736136772	578956162	/nfs/dbraw/zinc/95/61/62/578956162.db2.gz	HJZNTAURFDCUDL-WDEREUQCSA-N	-1	3	347.379	1.296	20	5		EDBDHM
COC(=O)c1cc(Oc2ccc(-c3nnn[n-]3)cn2)ccc1[N+](=O)[O-]	ZINC000736950019	579034734	/nfs/dbraw/zinc/03/47/34/579034734.db2.gz	JNOJUHIGEZXOOI-UHFFFAOYSA-N	-1	3	342.271	1.749	20	5		EDBDHM
COC(=O)c1cc(Oc2ccc(-c3nn[n-]n3)cn2)ccc1[N+](=O)[O-]	ZINC000736950019	579034735	/nfs/dbraw/zinc/03/47/35/579034735.db2.gz	JNOJUHIGEZXOOI-UHFFFAOYSA-N	-1	3	342.271	1.749	20	5		EDBDHM
Cc1cc(C(=O)Nc2ccc(-c3nnn[n-]3)cn2)cc([N+](=O)[O-])c1	ZINC000737236138	579058512	/nfs/dbraw/zinc/05/85/12/579058512.db2.gz	CQHFJPUFTNZSQD-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cc1cc(C(=O)Nc2ccc(-c3nn[n-]n3)cn2)cc([N+](=O)[O-])c1	ZINC000737236138	579058513	/nfs/dbraw/zinc/05/85/13/579058513.db2.gz	CQHFJPUFTNZSQD-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2nnn[n-]2)cn1	ZINC000737498688	579098870	/nfs/dbraw/zinc/09/88/70/579098870.db2.gz	KNFKHBGRJUTKJW-UHFFFAOYSA-N	-1	3	326.276	1.126	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2nn[n-]n2)cn1	ZINC000737498688	579098871	/nfs/dbraw/zinc/09/88/71/579098871.db2.gz	KNFKHBGRJUTKJW-UHFFFAOYSA-N	-1	3	326.276	1.126	20	5		EDBDHM
NC(=O)[C@@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C1	ZINC000737742818	579127527	/nfs/dbraw/zinc/12/75/27/579127527.db2.gz	HKDIXYNFZQIXBH-BDAKNGLRSA-N	-1	3	331.336	1.231	20	5		EDBDHM
NC(=O)[C@@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C1	ZINC000737742818	579127528	/nfs/dbraw/zinc/12/75/28/579127528.db2.gz	HKDIXYNFZQIXBH-BDAKNGLRSA-N	-1	3	331.336	1.231	20	5		EDBDHM
O=C(NCc1ccc(-c2nnn[n-]2)cc1)c1cc([N+](=O)[O-])ccc1F	ZINC000738101308	579160122	/nfs/dbraw/zinc/16/01/22/579160122.db2.gz	XWPSYASJPDVPIB-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=C(NCc1ccc(-c2nn[n-]n2)cc1)c1cc([N+](=O)[O-])ccc1F	ZINC000738101308	579160124	/nfs/dbraw/zinc/16/01/24/579160124.db2.gz	XWPSYASJPDVPIB-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=C(Nc1ccncc1-c1nnn[n-]1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000738195655	579170400	/nfs/dbraw/zinc/17/04/00/579170400.db2.gz	OZJXRHQWYZJGNS-UHFFFAOYSA-N	-1	3	345.706	1.498	20	5		EDBDHM
O=C(Nc1ccncc1-c1nn[n-]n1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000738195655	579170402	/nfs/dbraw/zinc/17/04/02/579170402.db2.gz	OZJXRHQWYZJGNS-UHFFFAOYSA-N	-1	3	345.706	1.498	20	5		EDBDHM
CCN(CC)C(=O)C[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000778248063	580459879	/nfs/dbraw/zinc/45/98/79/580459879.db2.gz	ZOEKYYMAVVUDKF-UHFFFAOYSA-N	-1	3	329.303	1.671	20	5		EDBDHM
CS[C@H](CO)[C@H](C)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768864404	580222979	/nfs/dbraw/zinc/22/29/79/580222979.db2.gz	BZLSKMQDCASTLH-POYBYMJQSA-N	-1	3	326.421	1.047	20	5		EDBDHM
CCOC(=O)C[C@H](C)C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768868377	580222997	/nfs/dbraw/zinc/22/29/97/580222997.db2.gz	MMDMQPREIVRCRM-QMMMGPOBSA-N	-1	3	336.391	1.524	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@H](CCO)c2ccco2)cs1	ZINC000768897992	580223806	/nfs/dbraw/zinc/22/38/06/580223806.db2.gz	DUYBPKYQPLOOED-SECBINFHSA-N	-1	3	332.359	1.651	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCN1CCC[C@H]1C	ZINC000780864860	580535467	/nfs/dbraw/zinc/53/54/67/580535467.db2.gz	BTAQYCLWANTPEU-GFCCVEGCSA-N	-1	3	327.406	1.666	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2OCCCO2)cc1C	ZINC000788415228	580720992	/nfs/dbraw/zinc/72/09/92/580720992.db2.gz	DRWAUCJGJKBSPF-UHFFFAOYSA-N	-1	3	330.362	1.253	20	5		EDBDHM
Cc1n[n-]nc1C(=O)OCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000791046824	580783468	/nfs/dbraw/zinc/78/34/68/580783468.db2.gz	NDYMOSGNXGMYOO-UHFFFAOYSA-N	-1	3	339.695	1.470	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1cc(Cl)c([N+](=O)[O-])cc1F)c1nnc[nH]1	ZINC000798227798	580991428	/nfs/dbraw/zinc/99/14/28/580991428.db2.gz	YXJOMMVYKOQEKU-YFKPBYRVSA-N	-1	3	349.731	1.545	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-][C@H]1COC[C@H]1C1CC1	ZINC000908409592	592484422	/nfs/dbraw/zinc/48/44/22/592484422.db2.gz	LITDUFIEMUDXGA-STQMWFEESA-N	-1	3	326.374	1.439	20	5		EDBDHM
CN1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@H](C(=O)[O-])C1	ZINC000910320352	592831494	/nfs/dbraw/zinc/83/14/94/592831494.db2.gz	OAJILPDTHLWYHP-SECBINFHSA-N	-1	3	345.302	1.649	20	5		EDBDHM
Cc1cc(N[C@H](C)[C@@H]2CN(C)CCN2C)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000910364556	592844996	/nfs/dbraw/zinc/84/49/96/592844996.db2.gz	SEXZEYYQCVQMEP-ABAIWWIYSA-N	-1	3	336.392	1.648	20	5		EDBDHM
CCn1cnnc1[N-]C(=O)COc1cc([N+](=O)[O-])c(C=O)cc1OC	ZINC000803525514	593339711	/nfs/dbraw/zinc/33/97/11/593339711.db2.gz	CWNXJBOTJMRLHX-UHFFFAOYSA-N	-1	3	349.303	1.045	20	5		EDBDHM
O=C(OCCn1ccc([N+](=O)[O-])n1)c1c[n-]nc1-c1ccccn1	ZINC000811365671	593469135	/nfs/dbraw/zinc/46/91/35/593469135.db2.gz	DSJMYAQRXBGSLI-UHFFFAOYSA-N	-1	3	328.288	1.433	20	5		EDBDHM
CC(C)OC(=O)[C@H](C)CNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000820137302	593794433	/nfs/dbraw/zinc/79/44/33/593794433.db2.gz	ITITWSWXOVLLSW-SECBINFHSA-N	-1	3	334.336	1.775	20	5		EDBDHM
CC(C)OC(=O)[C@H](C)CNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000820137302	593794434	/nfs/dbraw/zinc/79/44/34/593794434.db2.gz	ITITWSWXOVLLSW-SECBINFHSA-N	-1	3	334.336	1.775	20	5		EDBDHM
COC(=O)CCN(CC(C)C)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000821661473	593901238	/nfs/dbraw/zinc/90/12/38/593901238.db2.gz	KQCCNOOZDNKJAN-UHFFFAOYSA-N	-1	3	348.363	1.800	20	5		EDBDHM
COC(=O)CCN(CC(C)C)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000821661473	593901240	/nfs/dbraw/zinc/90/12/40/593901240.db2.gz	KQCCNOOZDNKJAN-UHFFFAOYSA-N	-1	3	348.363	1.800	20	5		EDBDHM
Cc1cc(C[C@@H](C)Nc2nccc(-c3nnn[n-]3)c2[N+](=O)[O-])n[nH]1	ZINC000822200157	594008660	/nfs/dbraw/zinc/00/86/60/594008660.db2.gz	WUMHEJUIXLOQOA-SSDOTTSWSA-N	-1	3	329.324	1.245	20	5		EDBDHM
Cc1cc(C[C@@H](C)Nc2nccc(-c3nnn[n-]3)c2[N+](=O)[O-])[nH]n1	ZINC000822200157	594008661	/nfs/dbraw/zinc/00/86/61/594008661.db2.gz	WUMHEJUIXLOQOA-SSDOTTSWSA-N	-1	3	329.324	1.245	20	5		EDBDHM
Cc1cc(C[C@@H](C)Nc2nccc(-c3nn[n-]n3)c2[N+](=O)[O-])n[nH]1	ZINC000822200157	594008662	/nfs/dbraw/zinc/00/86/62/594008662.db2.gz	WUMHEJUIXLOQOA-SSDOTTSWSA-N	-1	3	329.324	1.245	20	5		EDBDHM
Cc1cc(C[C@@H](C)Nc2nccc(-c3nn[n-]n3)c2[N+](=O)[O-])[nH]n1	ZINC000822200157	594008663	/nfs/dbraw/zinc/00/86/63/594008663.db2.gz	WUMHEJUIXLOQOA-SSDOTTSWSA-N	-1	3	329.324	1.245	20	5		EDBDHM
Cc1cnc(OCCOc2ccccc2-c2nnn[n-]2)c([N+](=O)[O-])c1	ZINC000822399975	594043706	/nfs/dbraw/zinc/04/37/06/594043706.db2.gz	RLCSIZZRYSBZPA-UHFFFAOYSA-N	-1	3	342.315	1.936	20	5		EDBDHM
Cc1cnc(OCCOc2ccccc2-c2nn[n-]n2)c([N+](=O)[O-])c1	ZINC000822399975	594043708	/nfs/dbraw/zinc/04/37/08/594043708.db2.gz	RLCSIZZRYSBZPA-UHFFFAOYSA-N	-1	3	342.315	1.936	20	5		EDBDHM
CCOC(=O)CN(CC(C)C)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000825511870	594194943	/nfs/dbraw/zinc/19/49/43/594194943.db2.gz	IWSKIEYIXGBMNR-UHFFFAOYSA-N	-1	3	348.363	1.800	20	5		EDBDHM
CCOC(=O)CN(CC(C)C)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000825511870	594194944	/nfs/dbraw/zinc/19/49/44/594194944.db2.gz	IWSKIEYIXGBMNR-UHFFFAOYSA-N	-1	3	348.363	1.800	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@@H]2CCC[C@@H]3OCC[C@@H]32)c(-c2nnn[n-]2)c1	ZINC000823651438	594224719	/nfs/dbraw/zinc/22/47/19/594224719.db2.gz	JQKXYMWIEHEPGH-JLLWLGSASA-N	-1	3	331.336	1.539	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@@H]2CCC[C@@H]3OCC[C@@H]32)c(-c2nn[n-]n2)c1	ZINC000823651438	594224720	/nfs/dbraw/zinc/22/47/20/594224720.db2.gz	JQKXYMWIEHEPGH-JLLWLGSASA-N	-1	3	331.336	1.539	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCOC3(CCCCC3)C2)c(-c2nnn[n-]2)c1	ZINC000823651798	594224828	/nfs/dbraw/zinc/22/48/28/594224828.db2.gz	QZNRAFIWGFXTCM-UHFFFAOYSA-N	-1	3	345.363	1.709	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCOC3(CCCCC3)C2)c(-c2nn[n-]n2)c1	ZINC000823651798	594224829	/nfs/dbraw/zinc/22/48/29/594224829.db2.gz	QZNRAFIWGFXTCM-UHFFFAOYSA-N	-1	3	345.363	1.709	20	5		EDBDHM
CN(C)c1cccc(CNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)n1	ZINC000825880034	594267607	/nfs/dbraw/zinc/26/76/07/594267607.db2.gz	VBLRUTKMPPLZLE-UHFFFAOYSA-N	-1	3	340.347	1.848	20	5		EDBDHM
CN(C)c1cccc(CNc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)n1	ZINC000825880034	594267608	/nfs/dbraw/zinc/26/76/08/594267608.db2.gz	VBLRUTKMPPLZLE-UHFFFAOYSA-N	-1	3	340.347	1.848	20	5		EDBDHM
CNC(=O)[C@H]1CCC[C@@H]1Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000826060488	594321637	/nfs/dbraw/zinc/32/16/37/594321637.db2.gz	NJDKTYGPOUYAIW-UWVGGRQHSA-N	-1	3	331.336	1.102	20	5		EDBDHM
CNC(=O)[C@H]1CCC[C@@H]1Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000826060488	594321638	/nfs/dbraw/zinc/32/16/38/594321638.db2.gz	NJDKTYGPOUYAIW-UWVGGRQHSA-N	-1	3	331.336	1.102	20	5		EDBDHM
O=C(NCCc1ccccc1[N+](=O)[O-])c1c[nH]c(-c2nnn[n-]2)c1	ZINC000826439689	594477805	/nfs/dbraw/zinc/47/78/05/594477805.db2.gz	FXHDBJXEHVQMNE-UHFFFAOYSA-N	-1	3	327.304	1.076	20	5		EDBDHM
O=C(NCCc1ccccc1[N+](=O)[O-])c1c[nH]c(-c2nn[n-]n2)c1	ZINC000826439689	594477806	/nfs/dbraw/zinc/47/78/06/594477806.db2.gz	FXHDBJXEHVQMNE-UHFFFAOYSA-N	-1	3	327.304	1.076	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NC[C@H]1COC2(CCCC2)O1	ZINC000826497727	594502974	/nfs/dbraw/zinc/50/29/74/594502974.db2.gz	RUUIVJZEOQGHOJ-NSHDSACASA-N	-1	3	346.347	1.873	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NC[C@H]1COC2(CCCC2)O1	ZINC000826497727	594502975	/nfs/dbraw/zinc/50/29/75/594502975.db2.gz	RUUIVJZEOQGHOJ-NSHDSACASA-N	-1	3	346.347	1.873	20	5		EDBDHM
O=c1[n-]nc([C@@H]2CCCN(C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)o1	ZINC000829438061	594613309	/nfs/dbraw/zinc/61/33/09/594613309.db2.gz	ACEHIPBMFZYYHD-YPMHNXCESA-N	-1	3	334.332	1.596	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2CCn3ccnc32)c1[N+](=O)[O-]	ZINC000831738098	594697866	/nfs/dbraw/zinc/69/78/66/594697866.db2.gz	KFXLYKAHGNHRFU-NSHDSACASA-N	-1	3	336.373	1.831	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)co1	ZINC000832477740	594753173	/nfs/dbraw/zinc/75/31/73/594753173.db2.gz	BPAMFQAZIKYWJA-UHFFFAOYSA-N	-1	3	325.346	1.932	20	5		EDBDHM
CN1CCC(O[N-]C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000846651749	595293644	/nfs/dbraw/zinc/29/36/44/595293644.db2.gz	VAEAVRSOHKWLBN-UHFFFAOYSA-N	-1	3	335.360	1.700	20	5		EDBDHM
O=C([N-][C@@H]1CCNC(=O)CC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848590108	595411329	/nfs/dbraw/zinc/41/13/29/595411329.db2.gz	BBPGWMBOBPFMGG-VIFPVBQESA-N	-1	3	343.286	1.351	20	5		EDBDHM
O=[N+]([O-])c1cn(Cc2nnc(-c3cccc(-c4nnn[n-]4)c3)o2)cn1	ZINC000738368643	599162800	/nfs/dbraw/zinc/16/28/00/599162800.db2.gz	HAQVEPIUZUKNIO-UHFFFAOYSA-N	-1	3	339.275	1.070	20	5		EDBDHM
O=[N+]([O-])c1cn(Cc2nnc(-c3cccc(-c4nn[n-]n4)c3)o2)cn1	ZINC000738368643	599162803	/nfs/dbraw/zinc/16/28/03/599162803.db2.gz	HAQVEPIUZUKNIO-UHFFFAOYSA-N	-1	3	339.275	1.070	20	5		EDBDHM
COC(=O)C1=CC[C@@H]([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000859288518	596035451	/nfs/dbraw/zinc/03/54/51/596035451.db2.gz	ZALVCVVSOGIRCM-LLVKDONJSA-N	-1	3	340.357	1.443	20	5		EDBDHM
CC1(C(=O)N[C@@H]2[C@H]3CN(c4cc[n-]c(=O)c4[N+](=O)[O-])C[C@H]32)CC=CC1	ZINC001060471855	695366435	/nfs/dbraw/zinc/36/64/35/695366435.db2.gz	FGSGVXKDTPKLIC-PJXYFTJBSA-N	-1	3	344.371	1.603	20	5		EDBDHM
CN(C)c1nc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc(=O)[n-]1	ZINC000338767189	282314538	/nfs/dbraw/zinc/31/45/38/282314538.db2.gz	DJGQOLQAMBYQPN-UHFFFAOYSA-N	-1	3	331.332	1.429	20	5		EDBDHM
NC(=O)Cc1csc(NC(=O)c2n[n-]c3ccc([N+](=O)[O-])cc32)n1	ZINC000074113891	138225286	/nfs/dbraw/zinc/22/52/86/138225286.db2.gz	MCLACKKBYGKAJZ-UHFFFAOYSA-N	-1	3	346.328	1.208	20	5		EDBDHM
Cn1ccnc1-c1cc(NC(=O)Cc2ccccc2[N+](=O)[O-])n[n-]1	ZINC000119683226	138314569	/nfs/dbraw/zinc/31/45/69/138314569.db2.gz	CNEIOCWZMMCWEX-UHFFFAOYSA-N	-1	3	326.316	1.900	20	5		EDBDHM
Cn1ccnc1-c1cc(NC(=O)Cc2ccccc2[N+](=O)[O-])[n-]n1	ZINC000119683226	138314570	/nfs/dbraw/zinc/31/45/70/138314570.db2.gz	CNEIOCWZMMCWEX-UHFFFAOYSA-N	-1	3	326.316	1.900	20	5		EDBDHM
O=[N+]([O-])c1ccc(CS(=O)(=O)[N-][C@H]2Cc3ccccc3[C@@H]2O)cc1	ZINC000178717610	138744811	/nfs/dbraw/zinc/74/48/11/138744811.db2.gz	GNNKRQWADFNDJN-HOTGVXAUSA-N	-1	3	348.380	1.673	20	5		EDBDHM
C[C@]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1)(C(N)=O)c1ccccc1	ZINC000195098155	139006897	/nfs/dbraw/zinc/00/68/97/139006897.db2.gz	SVLPWPUNKSQCBI-OAHLLOKOSA-N	-1	3	349.368	1.274	20	5		EDBDHM
CCN1CCC[C@H]([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000060510891	285268729	/nfs/dbraw/zinc/26/87/29/285268729.db2.gz	PRWCGNPHMYHBLT-LBPRGKRZSA-N	-1	3	327.406	1.666	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCNCc1ccco1	ZINC000116922662	221011497	/nfs/dbraw/zinc/01/14/97/221011497.db2.gz	QKWGHUIPWNBNJU-UHFFFAOYSA-N	-1	3	325.346	1.256	20	5		EDBDHM
Cc1cccc(CNCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c1	ZINC000116922551	221011814	/nfs/dbraw/zinc/01/18/14/221011814.db2.gz	FJPBFUXGZQEGMS-UHFFFAOYSA-N	-1	3	349.412	1.971	20	5		EDBDHM
CCC[C@H](CCO)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000269880615	140011494	/nfs/dbraw/zinc/01/14/94/140011494.db2.gz	WABALHMZGFBLCJ-LLVKDONJSA-N	-1	3	346.405	1.680	20	5		EDBDHM
CCOC(=O)CC[C@@H](C)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000270557602	140123273	/nfs/dbraw/zinc/12/32/73/140123273.db2.gz	OSWLZUCSGBIXPC-SNVBAGLBSA-N	-1	3	330.362	1.605	20	5		EDBDHM
O=C([N-][C@@H]1CCCCNC1=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000272063394	140394651	/nfs/dbraw/zinc/39/46/51/140394651.db2.gz	AEBXPXZJNISBQS-LLVKDONJSA-N	-1	3	327.287	1.472	20	5		EDBDHM
Cc1cnc(CC[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])nc1	ZINC000340091118	142262858	/nfs/dbraw/zinc/26/28/58/142262858.db2.gz	LCYYQABVJRXAAT-UHFFFAOYSA-N	-1	3	336.373	1.523	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CC[C@H](F)C1	ZINC000344907385	143025729	/nfs/dbraw/zinc/02/57/29/143025729.db2.gz	IFECTHIYLBFJCT-IUCAKERBSA-N	-1	3	346.336	1.550	20	5		EDBDHM
COC(=O)c1ccc(S(=O)(=O)[N-]C2CC(C)(F)C2)cc1[N+](=O)[O-]	ZINC000416488388	304323944	/nfs/dbraw/zinc/32/39/44/304323944.db2.gz	MQMSDXSRFGSFJB-UHFFFAOYSA-N	-1	3	346.336	1.550	20	5		EDBDHM
COC(=O)c1cc([N-]C(=O)c2ccc(C(N)=O)s2)cc([N+](=O)[O-])c1	ZINC000346234074	143181704	/nfs/dbraw/zinc/18/17/04/143181704.db2.gz	JBARLXLFQXZZIY-UHFFFAOYSA-N	-1	3	349.324	1.794	20	5		EDBDHM
NS(=O)(=O)c1ccc(O)c([N-]C(=O)c2ccc([N+](=O)[O-])s2)c1	ZINC000347715247	143353299	/nfs/dbraw/zinc/35/32/99/143353299.db2.gz	FSNHJTBIPPJEDY-UHFFFAOYSA-N	-1	3	343.342	1.262	20	5		EDBDHM
CCn1ccc(C[N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])n1	ZINC000416591795	304334940	/nfs/dbraw/zinc/33/49/40/304334940.db2.gz	URCIAABTUJRLRB-UHFFFAOYSA-N	-1	3	338.389	1.907	20	5		EDBDHM
C[C@@H]1C[C@@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H](C)O1	ZINC000416609304	304337281	/nfs/dbraw/zinc/33/72/81/304337281.db2.gz	UQHIOVAHZCHMLN-BBBLOLIVSA-N	-1	3	332.353	1.826	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-]CCCCF)OCCO2	ZINC000360260259	151972356	/nfs/dbraw/zinc/97/23/56/151972356.db2.gz	DVEGERFIRKUPQI-UHFFFAOYSA-N	-1	3	334.325	1.394	20	5		EDBDHM
CCn1ncnc1C[N-]S(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1C	ZINC000360364892	152007999	/nfs/dbraw/zinc/00/79/99/152007999.db2.gz	WHIIPGYXMVCAPE-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
Cc1nn(C)c(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)c1[N+](=O)[O-]	ZINC000364519542	153257589	/nfs/dbraw/zinc/25/75/89/153257589.db2.gz	LVBKQMMPQWHZQT-UHFFFAOYSA-N	-1	3	328.292	1.069	20	5		EDBDHM
Cc1nn(C)c(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)c1[N+](=O)[O-]	ZINC000364519542	153257591	/nfs/dbraw/zinc/25/75/91/153257591.db2.gz	LVBKQMMPQWHZQT-UHFFFAOYSA-N	-1	3	328.292	1.069	20	5		EDBDHM
CCCCS(=O)(=O)[N-]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000090021485	287329061	/nfs/dbraw/zinc/32/90/61/287329061.db2.gz	IYDBRDYHGWOBSD-UHFFFAOYSA-N	-1	3	341.389	1.203	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H](O)C2CCCCC2)c(F)c1	ZINC000159546420	225235953	/nfs/dbraw/zinc/23/59/53/225235953.db2.gz	LPGRGTCJIIHTRC-ZDUSSCGKSA-N	-1	3	346.380	1.953	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CCO)C(C)C)cc1C	ZINC000122541244	222108658	/nfs/dbraw/zinc/10/86/58/222108658.db2.gz	IXNDRVOEEMDNBH-LBPRGKRZSA-N	-1	3	330.406	1.897	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CCCC[C@@H]1O	ZINC000275176686	268290584	/nfs/dbraw/zinc/29/05/84/268290584.db2.gz	MHAZQMHYBNLGQO-QWRGUYRKSA-N	-1	3	330.362	1.185	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCCSC	ZINC000276086018	268395408	/nfs/dbraw/zinc/39/54/08/268395408.db2.gz	GZIVKHBDRPGWHA-UHFFFAOYSA-N	-1	3	348.402	1.413	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H](C)[C@@H](C)CO)cc1[N+](=O)[O-]	ZINC000275111663	273100861	/nfs/dbraw/zinc/10/08/61/273100861.db2.gz	WHQOWHLQRKCSEH-YUMQZZPRSA-N	-1	3	336.341	1.038	20	5		EDBDHM
CN(CCCN(C)C(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)Cc1ccco1	ZINC000286441670	288006765	/nfs/dbraw/zinc/00/67/65/288006765.db2.gz	HAYKCKTWZKJWNN-UHFFFAOYSA-N	-1	3	348.359	1.883	20	5		EDBDHM
C[C@@]1(C[C@@H]2CCCN2c2ncc([N+](=O)[O-])s2)NC(=O)[N-]C1=O	ZINC000286460056	288011337	/nfs/dbraw/zinc/01/13/37/288011337.db2.gz	SQCQTDYYTPMIMH-MADCSZMMSA-N	-1	3	325.350	1.008	20	5		EDBDHM
CC[C@@H](C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)OC	ZINC000289678205	288758237	/nfs/dbraw/zinc/75/82/37/288758237.db2.gz	WYNUQORROFOCMB-VIFPVBQESA-N	-1	3	346.361	1.069	20	5		EDBDHM
CC(C)(CCC(=O)Nc1ccccc1[N-]S(C)(=O)=O)[N+](=O)[O-]	ZINC000294458154	303110197	/nfs/dbraw/zinc/11/01/97/303110197.db2.gz	NTAGRPGCISQGET-UHFFFAOYSA-N	-1	3	329.378	1.832	20	5		EDBDHM
CCC1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(=O)OC)CC1	ZINC000295428371	303217629	/nfs/dbraw/zinc/21/76/29/303217629.db2.gz	XMBIWLGOMDOYGH-UHFFFAOYSA-N	-1	3	328.346	1.602	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1C[C@H]1C1CC1	ZINC000430001645	305042731	/nfs/dbraw/zinc/04/27/31/305042731.db2.gz	DUPWYTGJAFRNQK-CMPLNLGQSA-N	-1	3	340.357	1.458	20	5		EDBDHM
Cc1cc(NC(=O)c2ccc([N+](=O)[O-])[n-]2)n(C2CCN(C)CC2)n1	ZINC000431524704	305078619	/nfs/dbraw/zinc/07/86/19/305078619.db2.gz	MTZFRIXNSGGNQI-UHFFFAOYSA-N	-1	3	332.364	1.947	20	5		EDBDHM
CC(C)c1[nH]nc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)c1[N+](=O)[O-]	ZINC000434179369	305118315	/nfs/dbraw/zinc/11/83/15/305118315.db2.gz	IYOLKVYLHBGQQT-UHFFFAOYSA-N	-1	3	342.319	1.874	20	5		EDBDHM
CC(C)c1[nH]nc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)c1[N+](=O)[O-]	ZINC000434179369	305118316	/nfs/dbraw/zinc/11/83/16/305118316.db2.gz	IYOLKVYLHBGQQT-UHFFFAOYSA-N	-1	3	342.319	1.874	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1COCC1(C)C	ZINC000451964839	305374713	/nfs/dbraw/zinc/37/47/13/305374713.db2.gz	JUVNUAUMWMRLRE-LBPRGKRZSA-N	-1	3	330.362	1.307	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1cc(C)ncc1C	ZINC000532618356	305987105	/nfs/dbraw/zinc/98/71/05/305987105.db2.gz	HIQFFYXKUCJXIF-UHFFFAOYSA-N	-1	3	337.357	1.838	20	5		EDBDHM
Nc1ncc([N+](=O)[O-])cc1C(=O)[N-]c1ncn(Cc2ccccc2)n1	ZINC000544742849	306078357	/nfs/dbraw/zinc/07/83/57/306078357.db2.gz	PRUQYZDMKXXDHH-UHFFFAOYSA-N	-1	3	339.315	1.464	20	5		EDBDHM
CCOc1ccc([N+](=O)[O-])c(C(=O)NCCc2c(C)[n-][nH]c2=O)c1	ZINC000555008981	306199567	/nfs/dbraw/zinc/19/95/67/306199567.db2.gz	DAFPRRGRIKSBMJ-LLVKDONJSA-N	-1	3	334.332	1.235	20	5		EDBDHM
Cc1c(C(=O)[N-]N2C(=O)NC3(CCCCC3)C2=O)cccc1[N+](=O)[O-]	ZINC000014792478	441188999	/nfs/dbraw/zinc/18/89/99/441188999.db2.gz	LYCAYCMQFSDYMA-UHFFFAOYSA-N	-1	3	346.343	1.803	20	5		EDBDHM
CCN1CCC[C@H]([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)C1	ZINC000060510955	441248483	/nfs/dbraw/zinc/24/84/83/441248483.db2.gz	YLYZUEMNGYNGKA-NSHDSACASA-N	-1	3	343.405	1.366	20	5		EDBDHM
CCOC(=O)CCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000032413837	441555749	/nfs/dbraw/zinc/55/57/49/441555749.db2.gz	GVBSKQKOAGGZFO-UHFFFAOYSA-N	-1	3	346.361	1.225	20	5		EDBDHM
CC(C)N1CC[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1=O	ZINC000114743438	441681865	/nfs/dbraw/zinc/68/18/65/441681865.db2.gz	UCDPCYXXKJYKJL-LLVKDONJSA-N	-1	3	345.352	1.022	20	5		EDBDHM
CC(C)(CCO)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000178829284	442496215	/nfs/dbraw/zinc/49/62/15/442496215.db2.gz	JNTVSCYMZXGXLM-UHFFFAOYSA-N	-1	3	336.797	1.935	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccncc1F	ZINC000180170133	442552197	/nfs/dbraw/zinc/55/21/97/442552197.db2.gz	UZEVNZWSUHDPRB-UHFFFAOYSA-N	-1	3	327.293	1.938	20	5		EDBDHM
CNC(=O)[C@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(C)C	ZINC000178926517	442527767	/nfs/dbraw/zinc/52/77/67/442527767.db2.gz	NJZQZXLUHCHHTD-GFCCVEGCSA-N	-1	3	343.405	1.261	20	5		EDBDHM
C[C@H](CCN1CCN(C)CC1)NC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000184064654	442988049	/nfs/dbraw/zinc/98/80/49/442988049.db2.gz	ZQPQMVMEXSJMCA-GFCCVEGCSA-N	-1	3	336.392	1.056	20	5		EDBDHM
CC[C@H](CCO)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000268576645	443039650	/nfs/dbraw/zinc/03/96/50/443039650.db2.gz	INVKJRHKCVPHKR-SNVBAGLBSA-N	-1	3	332.378	1.290	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)c1cnn(C)c1	ZINC000266169391	443043599	/nfs/dbraw/zinc/04/35/99/443043599.db2.gz	IWSVFMPZXUPDPH-VIFPVBQESA-N	-1	3	340.361	1.376	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C1CC1	ZINC000190083612	443054816	/nfs/dbraw/zinc/05/48/16/443054816.db2.gz	PLXXCHUVRHUTEE-GFCCVEGCSA-N	-1	3	328.390	1.915	20	5		EDBDHM
CC[C@](C)([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(=O)OC	ZINC000268872772	443133229	/nfs/dbraw/zinc/13/32/29/443133229.db2.gz	POSNZMBECBYUBA-AWEZNQCLSA-N	-1	3	344.389	1.832	20	5		EDBDHM
O=C(Nc1cc(C2CCOCC2)[nH]n1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000266597519	443181178	/nfs/dbraw/zinc/18/11/78/443181178.db2.gz	YZAQEBQZTDWWOO-UHFFFAOYSA-N	-1	3	333.304	1.565	20	5		EDBDHM
O=c1ccc([N+](=O)[O-])cn1Cc1nc(-c2ccc3n[n-]nc3c2)no1	ZINC000350479082	319050746	/nfs/dbraw/zinc/05/07/46/319050746.db2.gz	HPMMWEPTNNXJTI-UHFFFAOYSA-N	-1	3	339.271	1.126	20	5		EDBDHM
COC[C@@](C)(CCO)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000272529945	443352172	/nfs/dbraw/zinc/35/21/72/443352172.db2.gz	SZQHNYOWEAWDIJ-CYBMUJFWSA-N	-1	3	332.303	1.590	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](O)C(F)(F)F)cc1C	ZINC000269742947	443419973	/nfs/dbraw/zinc/41/99/73/443419973.db2.gz	VNRHAYQMIOPLFK-SNVBAGLBSA-N	-1	3	342.295	1.413	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CC1(CO)CC2(CCC2)C1	ZINC000278701141	443406521	/nfs/dbraw/zinc/40/65/21/443406521.db2.gz	JXOLDGSDGUTRSY-UHFFFAOYSA-N	-1	3	340.401	1.816	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@]2(O)CCO[C@H]2C)c1[N+](=O)[O-]	ZINC000278859787	443465080	/nfs/dbraw/zinc/46/50/80/443465080.db2.gz	XMKFDDPYTQNGMG-SMDDNHRTSA-N	-1	3	344.389	1.030	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](CO)CC1CCC1	ZINC000280220548	443676954	/nfs/dbraw/zinc/67/69/54/443676954.db2.gz	KVLXEQKBJJUKNK-NSHDSACASA-N	-1	3	344.389	1.433	20	5		EDBDHM
COC(=O)[C@@H](CC(C)C)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000298468345	443776894	/nfs/dbraw/zinc/77/68/94/443776894.db2.gz	ARTINSDNWQINDH-LLVKDONJSA-N	-1	3	344.389	1.769	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2CC[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000276793622	443829830	/nfs/dbraw/zinc/82/98/30/443829830.db2.gz	YFHZUNLQKXQGIT-ZJUUUORDSA-N	-1	3	330.362	1.043	20	5		EDBDHM
Cc1nnc([C@@H](C)[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])o1	ZINC000532702958	320675700	/nfs/dbraw/zinc/67/57/00/320675700.db2.gz	DMZYBTOOKJBXPL-MRVPVSSYSA-N	-1	3	326.334	1.634	20	5		EDBDHM
CSC[C@](C)(O)C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276879493	443862584	/nfs/dbraw/zinc/86/25/84/443862584.db2.gz	SCKCQYGZSLRDOS-CYBMUJFWSA-N	-1	3	348.446	1.604	20	5		EDBDHM
O=[N+]([O-])c1c(F)cccc1S(=O)(=O)[N-][C@H]1CCN2CCCC[C@@H]12	ZINC000299047905	443937717	/nfs/dbraw/zinc/93/77/17/443937717.db2.gz	GIBWLFBMTWPSOB-RYUDHWBXSA-N	-1	3	343.380	1.639	20	5		EDBDHM
Cc1nc([C@@H](C)[N-]S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)n[nH]1	ZINC000285477868	444000065	/nfs/dbraw/zinc/00/00/65/444000065.db2.gz	VPFNDZQKKJXANF-SSDOTTSWSA-N	-1	3	343.340	1.508	20	5		EDBDHM
Cc1cncc(NCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])n1	ZINC000302216991	444209717	/nfs/dbraw/zinc/20/97/17/444209717.db2.gz	JXZOHUBOTIXKCO-UHFFFAOYSA-N	-1	3	337.361	1.084	20	5		EDBDHM
C[C@@H]1C[C@H]([N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CCN1C	ZINC000319615814	444325258	/nfs/dbraw/zinc/32/52/58/444325258.db2.gz	ZUKRNSFGHGGQMN-NXEZZACHSA-N	-1	3	331.369	1.495	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H](C)C1CC1	ZINC000322498024	444340048	/nfs/dbraw/zinc/34/00/48/444340048.db2.gz	BTCPULYRPJXPOP-VIFPVBQESA-N	-1	3	342.373	1.706	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CC1(C)C	ZINC000323240986	444342238	/nfs/dbraw/zinc/34/22/38/444342238.db2.gz	DUISGJBDSIDNNQ-SECBINFHSA-N	-1	3	342.373	1.706	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]Cc2cc(C)nc(C)n2)c([N+](=O)[O-])c1	ZINC000340730477	444491572	/nfs/dbraw/zinc/49/15/72/444491572.db2.gz	CUNBQHCWEJFCMD-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
O=C(Nc1cccc(N2CCOCC2)c1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000580180954	322019276	/nfs/dbraw/zinc/01/92/76/322019276.db2.gz	QWEUTPBZRZDXDS-UHFFFAOYSA-N	-1	3	344.327	1.784	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)n(C)n1	ZINC000341085126	444665687	/nfs/dbraw/zinc/66/56/87/444665687.db2.gz	MECLHBDOAUQQGZ-UHFFFAOYSA-N	-1	3	330.391	1.485	20	5		EDBDHM
COCCOC[C@H](C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000342513246	444724850	/nfs/dbraw/zinc/72/48/50/444724850.db2.gz	KHDSZHHTHDPCDY-QMMMGPOBSA-N	-1	3	338.407	1.295	20	5		EDBDHM
COC(=O)c1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1N	ZINC000338621891	444778568	/nfs/dbraw/zinc/77/85/68/444778568.db2.gz	JBBLHYCHDFBHDZ-UHFFFAOYSA-N	-1	3	332.272	1.317	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@]2(C)CCO[C@H]2C)c([N+](=O)[O-])c1	ZINC000344137444	444801928	/nfs/dbraw/zinc/80/19/28/444801928.db2.gz	YKVNBKPCRJYBON-TVQRCGJNSA-N	-1	3	330.362	1.449	20	5		EDBDHM
CCN1CCC[C@@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000338726260	444822951	/nfs/dbraw/zinc/82/29/51/444822951.db2.gz	WNCSXXBQJXIOSZ-NSHDSACASA-N	-1	3	345.396	1.744	20	5		EDBDHM
COC(=O)c1cccc2nc(NC(=O)Cn3cc([N+](=O)[O-])cn3)[n-]c21	ZINC000344453696	444984238	/nfs/dbraw/zinc/98/42/38/444984238.db2.gz	LZMJZKMKGOJIBK-UHFFFAOYSA-N	-1	3	344.287	1.093	20	5		EDBDHM
COC(=O)c1cccc2[n-]c(NC(=O)Cn3cc([N+](=O)[O-])cn3)nc21	ZINC000344453696	444984241	/nfs/dbraw/zinc/98/42/41/444984241.db2.gz	LZMJZKMKGOJIBK-UHFFFAOYSA-N	-1	3	344.287	1.093	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC[C@@H](C)F	ZINC000339036534	445000364	/nfs/dbraw/zinc/00/03/64/445000364.db2.gz	UYDVEWNMHPUNGL-MRVPVSSYSA-N	-1	3	334.325	1.408	20	5		EDBDHM
CCCc1[nH]nc(C(=O)[N-]c2cc(C(N)=O)ccc2F)c1[N+](=O)[O-]	ZINC000348712150	445351125	/nfs/dbraw/zinc/35/11/25/445351125.db2.gz	TWGABROBCPTSGY-UHFFFAOYSA-N	-1	3	335.295	1.761	20	5		EDBDHM
COc1ccc([N-]C(=O)c2nc3nc(C)cc(C)n3n2)cc1[N+](=O)[O-]	ZINC000359959908	445504844	/nfs/dbraw/zinc/50/48/44/445504844.db2.gz	POWUBBWCBIXIAF-UHFFFAOYSA-N	-1	3	342.315	1.910	20	5		EDBDHM
Cc1cc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)nn1-c1ccccc1	ZINC000357977842	445598121	/nfs/dbraw/zinc/59/81/21/445598121.db2.gz	VKZZUTNVVPVDKD-UHFFFAOYSA-N	-1	3	339.311	2.442	20	5		EDBDHM
CCc1nc2n(n1)CCC[C@H]2NC(=O)c1cc(C)[n-]c(=O)c1[N+](=O)[O-]	ZINC000375085593	446570364	/nfs/dbraw/zinc/57/03/64/446570364.db2.gz	TZBKEJKHWTYFFP-SNVBAGLBSA-N	-1	3	346.347	1.423	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2CNCCC2(F)F)c1[N+](=O)[O-]	ZINC000420446550	446622569	/nfs/dbraw/zinc/62/25/69/446622569.db2.gz	OTRVBUYBHWZKFS-SNVBAGLBSA-N	-1	3	349.359	1.487	20	5		EDBDHM
Cc1cncc(-c2cc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)no2)c1	ZINC000377603019	447238194	/nfs/dbraw/zinc/23/81/94/447238194.db2.gz	UEPJEXZMVJHHRW-UHFFFAOYSA-N	-1	3	341.283	2.306	20	5		EDBDHM
O=C(NCCOc1ccc([N+](=O)[O-])cc1)NCc1ncccc1[O-]	ZINC000525918187	448056243	/nfs/dbraw/zinc/05/62/43/448056243.db2.gz	DDXMDHIKDIXGJQ-UHFFFAOYSA-N	-1	3	332.316	1.574	20	5		EDBDHM
N[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[n-]c2=O)C[C@H]1c1ccccc1F	ZINC000516288420	448408815	/nfs/dbraw/zinc/40/88/15/448408815.db2.gz	CPXYCIWQWJNLKI-GXTWGEPZSA-N	-1	3	346.318	1.401	20	5		EDBDHM
COCCCN1CCC(Nc2ncc(C(=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000584532282	448560168	/nfs/dbraw/zinc/56/01/68/448560168.db2.gz	HLTZIJYMCNXHQA-UHFFFAOYSA-N	-1	3	338.364	1.601	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCS[C@H]1C	ZINC000592111194	448691234	/nfs/dbraw/zinc/69/12/34/448691234.db2.gz	IUDGNGYJTUGHEX-WPRPVWTQSA-N	-1	3	332.403	1.776	20	5		EDBDHM
C[C@@H](C(=O)Nc1ncccc1[O-])[C@H](C)NC(=O)c1ccc([N+](=O)[O-])o1	ZINC000588860778	448941945	/nfs/dbraw/zinc/94/19/45/448941945.db2.gz	AQBHNTFFRKSTJC-BDAKNGLRSA-N	-1	3	348.315	1.682	20	5		EDBDHM
O=C(NCCCc1cc(=O)[nH][n-]1)c1cc2cccc([N+](=O)[O-])c2[nH]1	ZINC000588876107	448944570	/nfs/dbraw/zinc/94/45/70/448944570.db2.gz	SIBLYRBPZZEQHP-UHFFFAOYSA-N	-1	3	329.316	1.462	20	5		EDBDHM
CO[C@@H]1[C@H](C)[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1(C)C	ZINC000593572270	449081666	/nfs/dbraw/zinc/08/16/66/449081666.db2.gz	HGHVKTZHORDMFA-GGZOMVNGSA-N	-1	3	329.378	1.328	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)CSc1ccc([N+](=O)[O-])cc1	ZINC000522254709	449067936	/nfs/dbraw/zinc/06/79/36/449067936.db2.gz	VOQBRPRRWFZBHU-LBPRGKRZSA-N	-1	3	336.373	1.315	20	5		EDBDHM
CC(C)N1CCC[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000593578545	449086723	/nfs/dbraw/zinc/08/67/23/449086723.db2.gz	NGCKFMMFTXBGNX-LLVKDONJSA-N	-1	3	328.394	1.141	20	5		EDBDHM
CC[C@H](C)C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(=O)OC	ZINC000593612305	449108762	/nfs/dbraw/zinc/10/87/62/449108762.db2.gz	JWAMHIZWJHKKJP-ONGXEEELSA-N	-1	3	345.377	1.246	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C1CCC1	ZINC000611117457	449175600	/nfs/dbraw/zinc/17/56/00/449175600.db2.gz	COUNXWFOBFJDID-SECBINFHSA-N	-1	3	342.373	1.833	20	5		EDBDHM
O=C([O-])[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)C[C@@H]1c1ccccc1	ZINC000593751516	449180302	/nfs/dbraw/zinc/18/03/02/449180302.db2.gz	CCKPKEOBYNHZCS-HUUCEWRRSA-N	-1	3	330.344	1.592	20	5		EDBDHM
CC1(C)Cc2nc([N-]C(=O)c3ccc([N+](=O)[O-])cn3)sc2C(=O)N1	ZINC000593348511	449237880	/nfs/dbraw/zinc/23/78/80/449237880.db2.gz	BRGWUGDNIISYBF-UHFFFAOYSA-N	-1	3	347.356	1.763	20	5		EDBDHM
CCNC(=O)COc1cccc(CNc2cc[n-]c(=O)c2[N+](=O)[O-])c1	ZINC000596084589	449354548	/nfs/dbraw/zinc/35/45/48/449354548.db2.gz	CJUKJNRDTIXYAB-UHFFFAOYSA-N	-1	3	346.343	1.822	20	5		EDBDHM
O=C(Cn1cc(Nc2cc[n-]c(=O)c2[N+](=O)[O-])cn1)NC1CCCC1	ZINC000596096471	449359085	/nfs/dbraw/zinc/35/90/85/449359085.db2.gz	HTVPTIUWTLWBCI-UHFFFAOYSA-N	-1	3	346.347	1.694	20	5		EDBDHM
O=C(NCc1ccccc1)[C@H]1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1	ZINC000596288363	449458270	/nfs/dbraw/zinc/45/82/70/449458270.db2.gz	IQIBQOZWVCYNDA-ZDUSSCGKSA-N	-1	3	342.355	1.838	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1CN1CCN(C(C)(C)C(=O)[O-])CC1	ZINC000600672539	449484538	/nfs/dbraw/zinc/48/45/38/449484538.db2.gz	NWWVDJAESAKPTO-UHFFFAOYSA-N	-1	3	337.376	1.584	20	5		EDBDHM
COc1cc(CCNC(=O)c2cc(=O)[n-]cn2)c([N+](=O)[O-])cc1OC	ZINC000598985036	449680999	/nfs/dbraw/zinc/68/09/99/449680999.db2.gz	HCAOIEAROKLDQR-UHFFFAOYSA-N	-1	3	348.315	1.080	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2C[C@H](O)C23CCC3)cc1C	ZINC000594866972	449782517	/nfs/dbraw/zinc/78/25/17/449782517.db2.gz	ZYXTUDQDMZJTMY-KGLIPLIRSA-N	-1	3	340.401	1.793	20	5		EDBDHM
C[C@H]1CCC[C@@H](C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])O1	ZINC000594851260	449759317	/nfs/dbraw/zinc/75/93/17/449759317.db2.gz	INLRITIVMANTJN-AAEUAGOBSA-N	-1	3	328.390	1.972	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H](CO)CC2CC2)c(Cl)c1	ZINC000594863528	449775443	/nfs/dbraw/zinc/77/54/43/449775443.db2.gz	GSWZUABYCUFUQX-JTQLQIEISA-N	-1	3	348.808	1.935	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@H]2CCCOC2)c(F)cc1[N+](=O)[O-]	ZINC000601312321	449821801	/nfs/dbraw/zinc/82/18/01/449821801.db2.gz	IQJAPEYBCUWJKB-SNVBAGLBSA-N	-1	3	332.353	1.747	20	5		EDBDHM
CCN1C[C@H](C)[C@H]([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)C1	ZINC000601358699	449872219	/nfs/dbraw/zinc/87/22/19/449872219.db2.gz	MMMKBJIJHWYQKD-CMPLNLGQSA-N	-1	3	345.396	1.661	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H]1CCCN1CC(F)F	ZINC000599398612	449945438	/nfs/dbraw/zinc/94/54/38/449945438.db2.gz	ZYICRSNPLAAIQU-JTQLQIEISA-N	-1	3	349.359	1.603	20	5		EDBDHM
CCC[C@H](C)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000609121032	449961211	/nfs/dbraw/zinc/96/12/11/449961211.db2.gz	XFIMQTLZOBPHLU-VIFPVBQESA-N	-1	3	330.362	1.833	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1[C@@H](C)[C@@H](C)O[C@H]1C	ZINC000599459991	449993370	/nfs/dbraw/zinc/99/33/70/449993370.db2.gz	PDFACLCMONMMSM-JIXVBMEVSA-N	-1	3	344.389	1.694	20	5		EDBDHM
O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NCCCc1cc(=O)[nH][n-]1	ZINC000597664846	450179952	/nfs/dbraw/zinc/17/99/52/450179952.db2.gz	NCRNXLNFGSSNPH-UHFFFAOYSA-N	-1	3	343.343	1.322	20	5		EDBDHM
O=C(c1cc([O-])cc([N+](=O)[O-])c1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000597621661	450151269	/nfs/dbraw/zinc/15/12/69/450151269.db2.gz	ZNAAMURPIRFHNW-CQSZACIVSA-N	-1	3	349.387	1.627	20	5		EDBDHM
C[C@@H](C[C@@H]1CCOC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000610739614	450316771	/nfs/dbraw/zinc/31/67/71/450316771.db2.gz	GGKFMHXDQPQVEM-UWVGGRQHSA-N	-1	3	332.353	1.827	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](C)Cn1cccn1	ZINC000619476298	450484160	/nfs/dbraw/zinc/48/41/60/450484160.db2.gz	ZSRMDNWEOCWBMG-SNVBAGLBSA-N	-1	3	340.361	1.167	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1ncc(C)s1	ZINC000619487165	450487709	/nfs/dbraw/zinc/48/77/09/450487709.db2.gz	HJHJRGCEIJTOQK-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
CN1CC[C@@H](NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)[C@H]1c1ccccc1	ZINC000248834927	536457730	/nfs/dbraw/zinc/45/77/30/536457730.db2.gz	NQHTZBVGUVIPNH-UKRRQHHQSA-N	-1	3	342.355	1.871	20	5		EDBDHM
O=C([O-])NC[C@H]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000740644010	579373703	/nfs/dbraw/zinc/37/37/03/579373703.db2.gz	RXOZFDPXCLMDCQ-LLVKDONJSA-N	-1	3	336.348	1.513	20	5		EDBDHM
C[C@@H](CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)Cn1ccnc1	ZINC000736025456	578947278	/nfs/dbraw/zinc/94/72/78/578947278.db2.gz	GVNBXBAUHZJVCF-VIFPVBQESA-N	-1	3	329.324	1.115	20	5		EDBDHM
C[C@@H](CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)Cn1ccnc1	ZINC000736025456	578947279	/nfs/dbraw/zinc/94/72/79/578947279.db2.gz	GVNBXBAUHZJVCF-VIFPVBQESA-N	-1	3	329.324	1.115	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1	ZINC000737500894	579099178	/nfs/dbraw/zinc/09/91/78/579099178.db2.gz	RANMJZKFUYVPRH-UHFFFAOYSA-N	-1	3	343.278	1.870	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1	ZINC000737500894	579099179	/nfs/dbraw/zinc/09/91/79/579099179.db2.gz	RANMJZKFUYVPRH-UHFFFAOYSA-N	-1	3	343.278	1.870	20	5		EDBDHM
O=C(OCCc1ccc([N+](=O)[O-])cc1)c1ccc(-c2nnn[n-]2)cn1	ZINC000738220609	579174052	/nfs/dbraw/zinc/17/40/52/579174052.db2.gz	ANBMQJDDLCYSMJ-UHFFFAOYSA-N	-1	3	340.299	1.569	20	5		EDBDHM
O=C(OCCc1ccc([N+](=O)[O-])cc1)c1ccc(-c2nn[n-]n2)cn1	ZINC000738220609	579174053	/nfs/dbraw/zinc/17/40/53/579174053.db2.gz	ANBMQJDDLCYSMJ-UHFFFAOYSA-N	-1	3	340.299	1.569	20	5		EDBDHM
COC(=O)C[C@@]1(NCc2cc(Cl)cc([N+](=O)[O-])c2[O-])CCOC1	ZINC000766465677	580167559	/nfs/dbraw/zinc/16/75/59/580167559.db2.gz	CEWAPSMTAXRJNF-AWEZNQCLSA-N	-1	3	344.751	1.766	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C2CCC3(CC2)OCCO3)cs1	ZINC000768809035	580220898	/nfs/dbraw/zinc/22/08/98/580220898.db2.gz	VMSVQHNLKZZBAW-UHFFFAOYSA-N	-1	3	348.402	1.620	20	5		EDBDHM
O=C([N-]C[C@@H](O)c1ccncc1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000778392322	580464045	/nfs/dbraw/zinc/46/40/45/580464045.db2.gz	KPZJSBZPVRYDPM-CYBMUJFWSA-N	-1	3	337.282	1.931	20	5		EDBDHM
CO[C@H](CC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C(F)(F)F	ZINC000786876399	580682443	/nfs/dbraw/zinc/68/24/43/580682443.db2.gz	VXLZTEKVDFZZGN-SSDOTTSWSA-N	-1	3	348.324	1.902	20	5		EDBDHM
C/C=C/C[C@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C(=O)OCC	ZINC000788668157	580727619	/nfs/dbraw/zinc/72/76/19/580727619.db2.gz	HVDWQTKEGOGGIT-GFAPAMAISA-N	-1	3	348.402	1.833	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@]23C[C@H]2COC32CCC2)cs1	ZINC000908120594	592333527	/nfs/dbraw/zinc/33/35/27/592333527.db2.gz	RHNTXROVNJTSGN-JOYOIKCWSA-N	-1	3	344.414	1.894	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2CC[C@@H](C3CC3)O2)c(F)c1	ZINC000907469530	592650910	/nfs/dbraw/zinc/65/09/10/592650910.db2.gz	NYLNUGCGASPQKP-AAEUAGOBSA-N	-1	3	344.364	1.970	20	5		EDBDHM
Cc1cc(N2CCN(C)CCN(C)CC2)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000910389561	592857146	/nfs/dbraw/zinc/85/71/46/592857146.db2.gz	WLAQNHRNBFXOLN-UHFFFAOYSA-N	-1	3	336.392	1.285	20	5		EDBDHM
CCC[C@H](O)[C@H](CO)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000839815376	593174709	/nfs/dbraw/zinc/17/47/09/593174709.db2.gz	AATSLAXETMLNSC-RYUDHWBXSA-N	-1	3	332.303	1.325	20	5		EDBDHM
O=C(Nc1ccc(C2(O)COC2)cc1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000807871357	593205682	/nfs/dbraw/zinc/20/56/82/593205682.db2.gz	ADNGQQAOAIVRLW-UHFFFAOYSA-N	-1	3	331.284	1.166	20	5		EDBDHM
CCn1ncc(C(=O)[N-]c2cc3c(cc2[N+](=O)[O-])OCCCO3)n1	ZINC000839233234	593282840	/nfs/dbraw/zinc/28/28/40/593282840.db2.gz	XQEBEHKILYZWFB-UHFFFAOYSA-N	-1	3	333.304	1.620	20	5		EDBDHM
C/C=C/COC(=O)C[N-]S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000803102695	593302401	/nfs/dbraw/zinc/30/24/01/593302401.db2.gz	KOZIPOBHFPPNTE-NSCUHMNNSA-N	-1	3	348.764	1.646	20	5		EDBDHM
CCOc1nc2ccc(C(=O)OCCn3ccc([N+](=O)[O-])n3)cc2[n-]1	ZINC000815442502	593635712	/nfs/dbraw/zinc/63/57/12/593635712.db2.gz	NQWIQCHOCPEDAP-UHFFFAOYSA-N	-1	3	345.315	1.923	20	5		EDBDHM
CCOc1nc2cc(C(=O)OCCn3ccc([N+](=O)[O-])n3)ccc2[n-]1	ZINC000815442502	593635713	/nfs/dbraw/zinc/63/57/13/593635713.db2.gz	NQWIQCHOCPEDAP-UHFFFAOYSA-N	-1	3	345.315	1.923	20	5		EDBDHM
C[C@H](C(=O)OC(C)(C)C)N(C)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000819882507	593773621	/nfs/dbraw/zinc/77/36/21/593773621.db2.gz	ATMNGHXRPPDYBL-SECBINFHSA-N	-1	3	348.363	1.941	20	5		EDBDHM
C[C@H](C(=O)OC(C)(C)C)N(C)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000819882507	593773622	/nfs/dbraw/zinc/77/36/22/593773622.db2.gz	ATMNGHXRPPDYBL-SECBINFHSA-N	-1	3	348.363	1.941	20	5		EDBDHM
C[C@H](C[C@@H](O)c1ccco1)Nc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820234984	593801338	/nfs/dbraw/zinc/80/13/38/593801338.db2.gz	PSUBXADJBXYZSE-LDYMZIIASA-N	-1	3	345.319	1.687	20	5		EDBDHM
C[C@H](C[C@@H](O)c1ccco1)Nc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820234984	593801339	/nfs/dbraw/zinc/80/13/39/593801339.db2.gz	PSUBXADJBXYZSE-LDYMZIIASA-N	-1	3	345.319	1.687	20	5		EDBDHM
CCCN(CCO)c1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000821099634	593966118	/nfs/dbraw/zinc/96/61/18/593966118.db2.gz	MAOKEXHDVVICBH-UHFFFAOYSA-N	-1	3	343.347	1.532	20	5		EDBDHM
CCCN(CCO)c1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000821099634	593966120	/nfs/dbraw/zinc/96/61/20/593966120.db2.gz	MAOKEXHDVVICBH-UHFFFAOYSA-N	-1	3	343.347	1.532	20	5		EDBDHM
C[C@H](NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1ccccc1[N+](=O)[O-]	ZINC000824516736	594029722	/nfs/dbraw/zinc/02/97/22/594029722.db2.gz	YZABYMPJBLNDPR-QMMMGPOBSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@H](NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1ccccc1[N+](=O)[O-]	ZINC000824516736	594029725	/nfs/dbraw/zinc/02/97/25/594029725.db2.gz	YZABYMPJBLNDPR-QMMMGPOBSA-N	-1	3	327.304	1.594	20	5		EDBDHM
Cc1nccn1CCCNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000822479017	594055227	/nfs/dbraw/zinc/05/52/27/594055227.db2.gz	XLTXZWQTHXHYHE-UHFFFAOYSA-N	-1	3	328.336	1.782	20	5		EDBDHM
Cc1nccn1CCCNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000822479017	594055229	/nfs/dbraw/zinc/05/52/29/594055229.db2.gz	XLTXZWQTHXHYHE-UHFFFAOYSA-N	-1	3	328.336	1.782	20	5		EDBDHM
CC[C@@H](Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@@H](O)C(F)(F)F	ZINC000825146310	594136220	/nfs/dbraw/zinc/13/62/20/594136220.db2.gz	CCKHTWVJRWWZJV-GMSGAONNSA-N	-1	3	346.269	1.889	20	5		EDBDHM
CC[C@@H](Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])[C@@H](O)C(F)(F)F	ZINC000825146310	594136221	/nfs/dbraw/zinc/13/62/21/594136221.db2.gz	CCKHTWVJRWWZJV-GMSGAONNSA-N	-1	3	346.269	1.889	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC(c3nnc[nH]3)CC2)c(-c2nnn[n-]2)c1	ZINC000823639521	594223845	/nfs/dbraw/zinc/22/38/45/594223845.db2.gz	BYJLPENUORVTCA-UHFFFAOYSA-N	-1	3	341.335	1.277	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC(c3nnc[nH]3)CC2)c(-c2nn[n-]n2)c1	ZINC000823639521	594223846	/nfs/dbraw/zinc/22/38/46/594223846.db2.gz	BYJLPENUORVTCA-UHFFFAOYSA-N	-1	3	341.335	1.277	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCO[C@@H](c3ccco3)C2)c(-c2nnn[n-]2)c1	ZINC000823639927	594223855	/nfs/dbraw/zinc/22/38/55/594223855.db2.gz	MDMYJOQNSCTSRL-CQSZACIVSA-N	-1	3	342.315	1.946	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCO[C@@H](c3ccco3)C2)c(-c2nn[n-]n2)c1	ZINC000823639927	594223856	/nfs/dbraw/zinc/22/38/56/594223856.db2.gz	MDMYJOQNSCTSRL-CQSZACIVSA-N	-1	3	342.315	1.946	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOc2ccc(-c3nnn[n-]3)cc2)cn1	ZINC000823639987	594223976	/nfs/dbraw/zinc/22/39/76/594223976.db2.gz	OIWHASMELJKKLM-UHFFFAOYSA-N	-1	3	327.304	1.661	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOc2ccc(-c3nn[n-]n3)cc2)cn1	ZINC000823639987	594223977	/nfs/dbraw/zinc/22/39/77/594223977.db2.gz	OIWHASMELJKKLM-UHFFFAOYSA-N	-1	3	327.304	1.661	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(NC[C@H](O)C3CC3)cc(-c3nnn[n-]3)c2c1	ZINC000823644225	594224330	/nfs/dbraw/zinc/22/43/30/594224330.db2.gz	GXDDBXDUTGAJOY-ZDUSSCGKSA-N	-1	3	341.331	1.506	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(NC[C@H](O)C3CC3)cc(-c3nn[n-]n3)c2c1	ZINC000823644225	594224331	/nfs/dbraw/zinc/22/43/31/594224331.db2.gz	GXDDBXDUTGAJOY-ZDUSSCGKSA-N	-1	3	341.331	1.506	20	5		EDBDHM
CN(C[C@@H]1CCCC[C@H]1O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825909373	594276107	/nfs/dbraw/zinc/27/61/07/594276107.db2.gz	XFANNEYEKULLLP-IINYFYTJSA-N	-1	3	332.364	1.762	20	5		EDBDHM
CN(C[C@@H]1CCCC[C@H]1O)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825909373	594276109	/nfs/dbraw/zinc/27/61/09/594276109.db2.gz	XFANNEYEKULLLP-IINYFYTJSA-N	-1	3	332.364	1.762	20	5		EDBDHM
Cn1c(C(=O)OCc2cccc(-c3nnn[n-]3)c2F)ccc1[N+](=O)[O-]	ZINC000826355066	594441022	/nfs/dbraw/zinc/44/10/22/594441022.db2.gz	IQTZIDIPRRVJDM-UHFFFAOYSA-N	-1	3	346.278	1.610	20	5		EDBDHM
Cn1c(C(=O)OCc2cccc(-c3nn[n-]n3)c2F)ccc1[N+](=O)[O-]	ZINC000826355066	594441023	/nfs/dbraw/zinc/44/10/23/594441023.db2.gz	IQTZIDIPRRVJDM-UHFFFAOYSA-N	-1	3	346.278	1.610	20	5		EDBDHM
O=C(Nc1ccncc1-c1nnn[n-]1)c1ccc([N+](=O)[O-])c(Cl)c1	ZINC000826458844	594483559	/nfs/dbraw/zinc/48/35/59/594483559.db2.gz	JFRVJFDMQSWIMV-UHFFFAOYSA-N	-1	3	345.706	1.498	20	5		EDBDHM
O=C(Nc1ccncc1-c1nn[n-]n1)c1ccc([N+](=O)[O-])c(Cl)c1	ZINC000826458844	594483561	/nfs/dbraw/zinc/48/35/61/594483561.db2.gz	JFRVJFDMQSWIMV-UHFFFAOYSA-N	-1	3	345.706	1.498	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC[C@@H]([C@@H]3CCOC3)C2)c(-c2nnn[n-]2)c1	ZINC000826500675	594503372	/nfs/dbraw/zinc/50/33/72/594503372.db2.gz	HWPUFDJAXLBRGU-NXEZZACHSA-N	-1	3	331.336	1.033	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC[C@@H]([C@@H]3CCOC3)C2)c(-c2nn[n-]n2)c1	ZINC000826500675	594503373	/nfs/dbraw/zinc/50/33/73/594503373.db2.gz	HWPUFDJAXLBRGU-NXEZZACHSA-N	-1	3	331.336	1.033	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C[C@@H](O)C2CCC2)c1	ZINC000832654664	594767083	/nfs/dbraw/zinc/76/70/83/594767083.db2.gz	QCAIHWZJVQHBHZ-LLVKDONJSA-N	-1	3	348.808	1.996	20	5		EDBDHM
Cc1cc(N2CCN([C@@H]3CCC[C@@H]3O)CC2)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000832891574	594783297	/nfs/dbraw/zinc/78/32/97/594783297.db2.gz	ZHHRMJNCRFXBEK-CABCVRRESA-N	-1	3	349.387	1.637	20	5		EDBDHM
CC(C)(C)[C@@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(=O)[O-]	ZINC000833426043	594845877	/nfs/dbraw/zinc/84/58/77/594845877.db2.gz	MSDWEJXZZHDXDA-LBPRGKRZSA-N	-1	3	344.389	1.457	20	5		EDBDHM
COC(=O)[C@@H]1CCN(C/C=C\c2ccccc2[N+](=O)[O-])[C@@H](C(=O)[O-])C1	ZINC000833708213	594912214	/nfs/dbraw/zinc/91/22/14/594912214.db2.gz	OLQYQNYUAYXSDY-AVXNYWLKSA-N	-1	3	348.355	1.946	20	5		EDBDHM
COCCOc1cc([N+](=O)[O-])c(C(=O)[N-]OC(C)C)cc1OC	ZINC000836800950	594999088	/nfs/dbraw/zinc/99/90/88/594999088.db2.gz	OWBKOOYKRZFXOD-UHFFFAOYSA-N	-1	3	328.321	1.698	20	5		EDBDHM
Cc1cc(NC[C@H]2CN3CCC[C@@H]3CO2)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000844208142	595302813	/nfs/dbraw/zinc/30/28/13/595302813.db2.gz	ICPSYOHHLOUCPD-NEPJUHHUSA-N	-1	3	335.360	1.877	20	5		EDBDHM
Cn1nccc1CC[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848587333	595410237	/nfs/dbraw/zinc/41/02/37/595410237.db2.gz	DYOUNEIGUKXFQW-UHFFFAOYSA-N	-1	3	340.286	1.659	20	5		EDBDHM
C[C@H]1OCC[C@]1(O)C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848589409	595411182	/nfs/dbraw/zinc/41/11/82/595411182.db2.gz	FHZMUBWJWVTOFS-RNCFNFMXSA-N	-1	3	346.286	1.223	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H]2CCCC23OCCO3)cs1	ZINC000851814943	595932168	/nfs/dbraw/zinc/93/21/68/595932168.db2.gz	GZSUHGFBZKESAD-SECBINFHSA-N	-1	3	334.375	1.230	20	5		EDBDHM
CCc1noc(C[C@]2(O)CCCN(c3cc[n-]c(=O)c3[N+](=O)[O-])C2)n1	ZINC000856567292	596018784	/nfs/dbraw/zinc/01/87/84/596018784.db2.gz	NHHSZFPTVNNUAS-OAHLLOKOSA-N	-1	3	349.347	1.215	20	5		EDBDHM
Cn1cc([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)cc(Cl)c1=O	ZINC000120050495	596240193	/nfs/dbraw/zinc/24/01/93/596240193.db2.gz	OJKHTMWJRIOXMT-UHFFFAOYSA-N	-1	3	349.777	1.809	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@@H](O)c2ccsc2)cs1	ZINC000120252676	596384681	/nfs/dbraw/zinc/38/46/81/596384681.db2.gz	AVKRJHVXUBIQLY-SECBINFHSA-N	-1	3	334.400	1.730	20	5		EDBDHM
O=C([N-]C[C@H](O)[C@H]1CCCO1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000863497533	596599882	/nfs/dbraw/zinc/59/98/82/596599882.db2.gz	WMIOFAABIBAIKO-NWDGAFQWSA-N	-1	3	346.286	1.223	20	5		EDBDHM
O=c1c(Cl)cc([N+](=O)[O-])cn1Cc1ccccc1-c1nnn[n-]1	ZINC000738372379	599364728	/nfs/dbraw/zinc/36/47/28/599364728.db2.gz	OSFRBHPEALZCHY-UHFFFAOYSA-N	-1	3	332.707	1.638	20	5		EDBDHM
O=c1c(Cl)cc([N+](=O)[O-])cn1Cc1ccccc1-c1nn[n-]n1	ZINC000738372379	599364731	/nfs/dbraw/zinc/36/47/31/599364731.db2.gz	OSFRBHPEALZCHY-UHFFFAOYSA-N	-1	3	332.707	1.638	20	5		EDBDHM
Nc1cc([N+](=O)[O-])ccc1C(=O)OCC(=O)[N-]C(=O)c1cccs1	ZINC000916408020	696659869	/nfs/dbraw/zinc/65/98/69/696659869.db2.gz	UBHNGTFODRUYMM-UHFFFAOYSA-N	-1	3	349.324	1.352	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H](O)Cc1ccccc1	ZINC000070958368	138205104	/nfs/dbraw/zinc/20/51/04/138205104.db2.gz	NXVRGVQAPFGYSD-ZDUSSCGKSA-N	-1	3	336.369	1.477	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCC[C@@H](C(N)=O)C2)cc1[N+](=O)[O-]	ZINC000124212971	138324936	/nfs/dbraw/zinc/32/49/36/138324936.db2.gz	BHXMWUCMZJXTSY-RKDXNWHRSA-N	-1	3	347.418	1.287	20	5		EDBDHM
CCC[C@H](C)[C@@H](CO)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000566624518	306422453	/nfs/dbraw/zinc/42/24/53/306422453.db2.gz	ATLMWFCRBBKNHB-NWDGAFQWSA-N	-1	3	330.406	1.979	20	5		EDBDHM
Cc1ccc(F)c(S(=O)(=O)[N-]CCn2cc([N+](=O)[O-])cn2)c1	ZINC000152817386	224015888	/nfs/dbraw/zinc/01/58/88/224015888.db2.gz	JWRLZAGRUBYNKX-UHFFFAOYSA-N	-1	3	328.325	1.217	20	5		EDBDHM
CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCN2C(=O)[N-]C(=O)[C@@H]2C1	ZINC000347378098	533407239	/nfs/dbraw/zinc/40/72/39/533407239.db2.gz	NEWIEFVEDVIIHW-OIOXUXFSSA-N	-1	3	330.344	1.234	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C2(CC(N)=O)CCC2)cc1C	ZINC000447644343	291992480	/nfs/dbraw/zinc/99/24/80/291992480.db2.gz	RTNHMVMCCZPDEF-UHFFFAOYSA-N	-1	3	341.389	1.288	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCCOCC1	ZINC000271997246	140385065	/nfs/dbraw/zinc/38/50/65/140385065.db2.gz	RCGXGFYDDANMMJ-SNVBAGLBSA-N	-1	3	330.362	1.451	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2CCC[C@@H](CO)C2)c(F)c1	ZINC000344954735	143030470	/nfs/dbraw/zinc/03/04/70/143030470.db2.gz	FZSMHIXNGGANIO-GHMZBOCLSA-N	-1	3	346.380	1.811	20	5		EDBDHM
COc1cc([N-]C(=O)c2n[nH]cc2[N+](=O)[O-])ncc1Br	ZINC000345305389	143075810	/nfs/dbraw/zinc/07/58/10/143075810.db2.gz	PTIVWTQPSOJJEV-UHFFFAOYSA-N	-1	3	342.109	1.736	20	5		EDBDHM
COC(=O)CC1([N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])CC1	ZINC000573098121	306611798	/nfs/dbraw/zinc/61/17/98/306611798.db2.gz	UBASUIOXFPCIKW-UHFFFAOYSA-N	-1	3	342.373	1.586	20	5		EDBDHM
CCO[C@@H]1COCC[C@@H]1[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000352978731	149238066	/nfs/dbraw/zinc/23/80/66/149238066.db2.gz	YEOOWJQUDDKBTH-WCQYABFASA-N	-1	3	344.389	1.376	20	5		EDBDHM
COCCC(C)(C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000352986960	149241449	/nfs/dbraw/zinc/24/14/49/149241449.db2.gz	SSKCLBKWIJJUDY-UHFFFAOYSA-N	-1	3	332.378	1.697	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H](C)[C@@H]2CCCOC2)c([N+](=O)[O-])c1	ZINC000355719891	150374210	/nfs/dbraw/zinc/37/42/10/150374210.db2.gz	XORVXTXTUVYXGP-NWDGAFQWSA-N	-1	3	328.390	1.997	20	5		EDBDHM
CN(C)c1nc(C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc(=O)[n-]1	ZINC000361478361	152407814	/nfs/dbraw/zinc/40/78/14/152407814.db2.gz	XCQUVBXQDXVEMU-UHFFFAOYSA-N	-1	3	345.359	1.822	20	5		EDBDHM
O=C(Nc1ccc2c(c1)N[C@@H](CO)CO2)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000367638884	154208015	/nfs/dbraw/zinc/20/80/15/154208015.db2.gz	RMPZDVNSPKTYSZ-JTQLQIEISA-N	-1	3	346.299	1.113	20	5		EDBDHM
O=[N+]([O-])c1cccnc1N1CC(S(=O)(=O)[N-]c2ccccc2)C1	ZINC000374714056	157375984	/nfs/dbraw/zinc/37/59/84/157375984.db2.gz	GWGPZLNTSWOSFQ-UHFFFAOYSA-N	-1	3	334.357	1.620	20	5		EDBDHM
CCC(CC)NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000280856487	273407302	/nfs/dbraw/zinc/40/73/02/273407302.db2.gz	XBLBFSZMEVUKGA-UHFFFAOYSA-N	-1	3	329.378	1.178	20	5		EDBDHM
Cc1cc(N2CCC[C@@H]2C[C@@]2(C)NC(=O)[N-]C2=O)ncc1[N+](=O)[O-]	ZINC000286239514	287965222	/nfs/dbraw/zinc/96/52/22/287965222.db2.gz	DDGHZBQJRIELGY-MEBBXXQBSA-N	-1	3	333.348	1.255	20	5		EDBDHM
Cc1ccc(N2CCC[C@H]2C[C@@]2(C)NC(=O)[N-]C2=O)c([N+](=O)[O-])c1	ZINC000286465670	288012682	/nfs/dbraw/zinc/01/26/82/288012682.db2.gz	SZZYFZIXFFEGFW-MEDUHNTESA-N	-1	3	332.360	1.860	20	5		EDBDHM
O=C(Cn1ccc([N-]c2c(F)cccc2[N+](=O)[O-])n1)N1CCOCC1	ZINC000287452532	288241369	/nfs/dbraw/zinc/24/13/69/288241369.db2.gz	VTCHNQBDLXMLTJ-UHFFFAOYSA-N	-1	3	349.322	1.533	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCN2CCCCC2)c1C	ZINC000119669827	281015944	/nfs/dbraw/zinc/01/59/44/281015944.db2.gz	VGVQBQAYCQHHSW-UHFFFAOYSA-N	-1	3	341.433	1.976	20	5		EDBDHM
Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H]2C[C@]2(C)NC(=O)[N-]C2=O)n1	ZINC000343356397	301204165	/nfs/dbraw/zinc/20/41/65/301204165.db2.gz	QIWNIGJVMXXHEF-ZBEGNZNMSA-N	-1	3	347.375	1.564	20	5		EDBDHM
Cn1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c(=O)[n-]c1=O	ZINC000437505732	305176072	/nfs/dbraw/zinc/17/60/72/305176072.db2.gz	YITZHFDXHDYOEC-UHFFFAOYSA-N	-1	3	344.327	1.199	20	5		EDBDHM
CO[C@H]1C[C@@H]([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C1(C)C	ZINC000440384328	305205132	/nfs/dbraw/zinc/20/51/32/305205132.db2.gz	VRMKMOSCDZMEKA-NEPJUHHUSA-N	-1	3	328.390	1.995	20	5		EDBDHM
COCCOc1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000445181525	305257546	/nfs/dbraw/zinc/25/75/46/305257546.db2.gz	MGRZKNPYDWISAS-UHFFFAOYSA-N	-1	3	333.300	1.973	20	5		EDBDHM
COC[C@@](C)(O)CC[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000451657387	305359861	/nfs/dbraw/zinc/35/98/61/305359861.db2.gz	KQMUZCXLTRZPHG-AWEZNQCLSA-N	-1	3	346.405	1.277	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCC[C@@H]1CCO	ZINC000494621202	305632355	/nfs/dbraw/zinc/63/23/55/305632355.db2.gz	NVZPIHNLHZTTDG-ZYHUDNBSSA-N	-1	3	344.389	1.433	20	5		EDBDHM
O=C(c1cc([O-])ccc1F)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000556121324	306207966	/nfs/dbraw/zinc/20/79/66/306207966.db2.gz	JCPJUJUALHGIDO-UHFFFAOYSA-N	-1	3	346.318	1.797	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccccc1[N-]S(C)(=O)=O	ZINC000024893425	441322630	/nfs/dbraw/zinc/32/26/30/441322630.db2.gz	QLSWUWDZUYDVHR-UHFFFAOYSA-N	-1	3	338.345	1.557	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCN1Cc2ccccc2C1	ZINC000066446825	441532917	/nfs/dbraw/zinc/53/29/17/441532917.db2.gz	GUYYIGCYJSGWSM-UHFFFAOYSA-N	-1	3	347.396	1.889	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)CN1CCCC1	ZINC000055265064	441635331	/nfs/dbraw/zinc/63/53/31/441635331.db2.gz	JVPVGGIMESXHEJ-LLVKDONJSA-N	-1	3	345.396	1.744	20	5		EDBDHM
COCCCN(C)CC[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000173428288	441746495	/nfs/dbraw/zinc/74/64/95/441746495.db2.gz	KEGMWQMCCVXDAM-UHFFFAOYSA-N	-1	3	345.421	1.150	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](C)C[C@H](C)O)cc1C	ZINC000120779041	442131362	/nfs/dbraw/zinc/13/13/62/442131362.db2.gz	WWCROLIZEMXERN-SKDRFNHKSA-N	-1	3	330.406	1.897	20	5		EDBDHM
NC(=O)C1([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCCCC1	ZINC000175693451	442106283	/nfs/dbraw/zinc/10/62/83/442106283.db2.gz	CQOMUIMSGUXLKO-UHFFFAOYSA-N	-1	3	327.362	1.061	20	5		EDBDHM
CC[C@@H](O)CC[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl	ZINC000156800610	442522428	/nfs/dbraw/zinc/52/24/28/442522428.db2.gz	KPWKHABNDOISMW-SECBINFHSA-N	-1	3	336.797	1.996	20	5		EDBDHM
O=[N+]([O-])c1c(F)cccc1S(=O)(=O)[N-]C[C@@H]1CCN(C2CC2)C1	ZINC000173024191	442588150	/nfs/dbraw/zinc/58/81/50/442588150.db2.gz	MNDVKCIJPLFSBX-JTQLQIEISA-N	-1	3	343.380	1.497	20	5		EDBDHM
O=C(CC[C@@H]1NC(=O)[N-]C1=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000610961661	450393729	/nfs/dbraw/zinc/39/37/29/450393729.db2.gz	KJEXHXOJZDAGHF-LBPRGKRZSA-N	-1	3	346.343	1.074	20	5		EDBDHM
CN1CC[C@H]([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1=O	ZINC000192852865	442692646	/nfs/dbraw/zinc/69/26/46/442692646.db2.gz	CELPMRXNZZQHTR-VIFPVBQESA-N	-1	3	347.780	1.147	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2(CCO)CC2)c1C	ZINC000188949437	442847999	/nfs/dbraw/zinc/84/79/99/442847999.db2.gz	MTNBCIJZPAHILY-UHFFFAOYSA-N	-1	3	328.390	1.653	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCCn2ccnn2)c1C	ZINC000183167893	442893919	/nfs/dbraw/zinc/89/39/19/442893919.db2.gz	BYJBZICEUSYUSW-UHFFFAOYSA-N	-1	3	339.377	1.172	20	5		EDBDHM
COCc1nc(Sc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)n[n-]1	ZINC000268495400	443009659	/nfs/dbraw/zinc/00/96/59/443009659.db2.gz	QCBPPNLNQFCBLE-UHFFFAOYSA-N	-1	3	335.345	1.895	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H](OC)C(C)C	ZINC000266727743	443221231	/nfs/dbraw/zinc/22/12/31/443221231.db2.gz	KYGPUTWJIXNAPK-GFCCVEGCSA-N	-1	3	332.378	1.553	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H](O)C2CCC2)c(Cl)c1	ZINC000315957775	318933801	/nfs/dbraw/zinc/93/38/01/318933801.db2.gz	CNNULSFISKKIPM-NSHDSACASA-N	-1	3	334.781	1.688	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-])N1CCCC1	ZINC000319363592	318937934	/nfs/dbraw/zinc/93/79/34/318937934.db2.gz	SWGPDKSXVOHINX-SNVBAGLBSA-N	-1	3	331.369	1.497	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)c2ccn(C)n2)c([N+](=O)[O-])c1	ZINC000416557987	319444533	/nfs/dbraw/zinc/44/45/33/319444533.db2.gz	IGNWAKYLPVWTIJ-SECBINFHSA-N	-1	3	340.361	1.376	20	5		EDBDHM
C[C@@H]1CN(CCCNC(=O)c2cccc([N+](=O)[O-])c2[O-])CCCO1	ZINC000278460701	443338989	/nfs/dbraw/zinc/33/89/89/443338989.db2.gz	JAVAUXQZUUMRLZ-GFCCVEGCSA-N	-1	3	337.376	1.531	20	5		EDBDHM
CCCOC(=O)CC[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000267163577	443363328	/nfs/dbraw/zinc/36/33/28/443363328.db2.gz	RQVAAWSISLDBIJ-UHFFFAOYSA-N	-1	3	344.389	1.833	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CCC[C@@H](C)O)c1	ZINC000278853162	443462393	/nfs/dbraw/zinc/46/23/93/443462393.db2.gz	XBMXWJQGWMSHBC-SECBINFHSA-N	-1	3	336.797	1.996	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1C[N-]S(=O)(=O)Cc1cc(C)on1	ZINC000265309021	443602706	/nfs/dbraw/zinc/60/27/06/443602706.db2.gz	IIOKHXVCZPJDTO-UHFFFAOYSA-N	-1	3	341.345	1.519	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](C)CO[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000441530463	320098079	/nfs/dbraw/zinc/09/80/79/320098079.db2.gz	BANXMJNOXSOHCR-NEPJUHHUSA-N	-1	3	344.389	1.376	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2COCC2(C)C)c([N+](=O)[O-])c1	ZINC000451986444	320240225	/nfs/dbraw/zinc/24/02/25/320240225.db2.gz	XONDIEQVJHUPDD-LBPRGKRZSA-N	-1	3	330.362	1.307	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](C)Cn2cccn2)c1[N+](=O)[O-]	ZINC000276782472	443825347	/nfs/dbraw/zinc/82/53/47/443825347.db2.gz	IGWWPPQCZUZYRT-LBPRGKRZSA-N	-1	3	338.389	1.775	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](C)[C@@H]2CCOC2)c1[N+](=O)[O-]	ZINC000276799526	443831501	/nfs/dbraw/zinc/83/15/01/443831501.db2.gz	KNJLBFDRZUOUMV-NWDGAFQWSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Cc1nc([C@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1	ZINC000285327986	443944024	/nfs/dbraw/zinc/94/40/24/443944024.db2.gz	JNVXPWZZYBJUFV-LURJTMIESA-N	-1	3	329.313	1.200	20	5		EDBDHM
Cc1nnc([C@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)[nH]1	ZINC000285327986	443944026	/nfs/dbraw/zinc/94/40/26/443944026.db2.gz	JNVXPWZZYBJUFV-LURJTMIESA-N	-1	3	329.313	1.200	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]Cc1noc2c1CCCC2	ZINC000288647088	443944629	/nfs/dbraw/zinc/94/46/29/443944629.db2.gz	QAHDSEVSAZPIQE-UHFFFAOYSA-N	-1	3	337.357	1.940	20	5		EDBDHM
CC[C@](C)([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)OC	ZINC000299588461	444087493	/nfs/dbraw/zinc/08/74/93/444087493.db2.gz	FGCSHDDUMMVHSC-ZDUSSCGKSA-N	-1	3	330.362	1.523	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(C(=O)Nc2[n-]nnc2C(=O)NC2CC2)c1	ZINC000297736752	444326127	/nfs/dbraw/zinc/32/61/27/444326127.db2.gz	MVUOQRXQKAIWHK-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(C(=O)Nc2nn[n-]c2C(=O)NC2CC2)c1	ZINC000297736752	444326129	/nfs/dbraw/zinc/32/61/29/444326129.db2.gz	MVUOQRXQKAIWHK-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(C(=O)Nc2n[n-]nc2C(=O)NC2CC2)c1	ZINC000297736752	444326131	/nfs/dbraw/zinc/32/61/31/444326131.db2.gz	MVUOQRXQKAIWHK-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
CCN(CC)C[C@H](C)[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000319426275	444324048	/nfs/dbraw/zinc/32/40/48/444324048.db2.gz	JCDGJPDWZFRDPA-JTQLQIEISA-N	-1	3	333.385	1.743	20	5		EDBDHM
C[C@H]1C[C@@H]([N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CCN1C	ZINC000319615816	444324937	/nfs/dbraw/zinc/32/49/37/444324937.db2.gz	ZUKRNSFGHGGQMN-UWVGGRQHSA-N	-1	3	331.369	1.495	20	5		EDBDHM
CC(C)(C)[C@H](O)C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000324238675	444351901	/nfs/dbraw/zinc/35/19/01/444351901.db2.gz	AGCNCWUYDUXCMD-LLVKDONJSA-N	-1	3	336.797	1.934	20	5		EDBDHM
CCc1ccc(C(=O)Nc2[n-]nnc2C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000297802495	444336223	/nfs/dbraw/zinc/33/62/23/444336223.db2.gz	SLQZDUYYGORXPP-UHFFFAOYSA-N	-1	3	344.331	1.420	20	5		EDBDHM
CCc1ccc(C(=O)Nc2nn[n-]c2C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000297802495	444336225	/nfs/dbraw/zinc/33/62/25/444336225.db2.gz	SLQZDUYYGORXPP-UHFFFAOYSA-N	-1	3	344.331	1.420	20	5		EDBDHM
CCc1ccc(C(=O)Nc2n[n-]nc2C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000297802495	444336227	/nfs/dbraw/zinc/33/62/27/444336227.db2.gz	SLQZDUYYGORXPP-UHFFFAOYSA-N	-1	3	344.331	1.420	20	5		EDBDHM
CSCC[C@H](CO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000342512607	444725100	/nfs/dbraw/zinc/72/51/00/444725100.db2.gz	PCXPTYYMPSLPRV-MRVPVSSYSA-N	-1	3	340.448	1.357	20	5		EDBDHM
CCc1[nH]nc(C(=O)[N-]c2nncn2-c2ccccc2)c1[N+](=O)[O-]	ZINC000344679396	445123230	/nfs/dbraw/zinc/12/32/30/445123230.db2.gz	YUBYQVZIHAESCP-UHFFFAOYSA-N	-1	3	327.304	1.713	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C2CCC(C(N)=O)CC2)cc1[N+](=O)[O-]	ZINC000343511230	445236289	/nfs/dbraw/zinc/23/62/89/445236289.db2.gz	SZHWDXQAOLQJBG-UHFFFAOYSA-N	-1	3	347.418	1.287	20	5		EDBDHM
CCO[C@@H]1C[C@@H]([N-]c2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]1OC	ZINC000362675489	445493946	/nfs/dbraw/zinc/49/39/46/445493946.db2.gz	SHNMJXXRZBGTEY-UPJWGTAASA-N	-1	3	334.332	2.249	20	5		EDBDHM
O=[N+]([O-])c1cccc(CS(=O)(=O)[N-][C@@H](CO)c2ccsc2)c1	ZINC000351565476	446163062	/nfs/dbraw/zinc/16/30/62/446163062.db2.gz	BGZZNRNHGQHZDI-ZDUSSCGKSA-N	-1	3	342.398	1.809	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1CCO[C@@]2(CCOC2)C1	ZINC000371401467	446833290	/nfs/dbraw/zinc/83/32/90/446833290.db2.gz	PFAOXPUWXANIMR-RISCZKNCSA-N	-1	3	342.373	1.211	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@](C)(O)C2CC2)c1C	ZINC000443260893	447019144	/nfs/dbraw/zinc/01/91/44/447019144.db2.gz	IUNQDAYPJUNFNH-CQSZACIVSA-N	-1	3	328.390	1.651	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H]2[C@H]3COC[C@H]32)c1C	ZINC000375685674	446974413	/nfs/dbraw/zinc/97/44/13/446974413.db2.gz	TVOHEFUDJXZWLE-CNDDSTCGSA-N	-1	3	326.374	1.382	20	5		EDBDHM
COC(=O)C[C@@H](C)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000390054619	447490512	/nfs/dbraw/zinc/49/05/12/447490512.db2.gz	HNYAUMGHYCXWAI-SNVBAGLBSA-N	-1	3	330.362	1.442	20	5		EDBDHM
CCOC(=O)c1cnc(C)c([N-]C(=O)c2nn(CC)cc2[N+](=O)[O-])c1	ZINC000427367352	447587777	/nfs/dbraw/zinc/58/77/77/447587777.db2.gz	RVWSSHNFBROPCT-UHFFFAOYSA-N	-1	3	347.331	1.944	20	5		EDBDHM
C[C@H](CCO)CC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000397757957	447552185	/nfs/dbraw/zinc/55/21/85/447552185.db2.gz	SYTTXWDAFZLTNQ-VIFPVBQESA-N	-1	3	336.797	1.935	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CCCC[C@@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC000487433236	447832549	/nfs/dbraw/zinc/83/25/49/447832549.db2.gz	QGPBCIBKCCTNKF-QWRGUYRKSA-N	-1	3	341.389	1.226	20	5		EDBDHM
CNc1ccc(C(=O)Nc2nnc(SCCO)[n-]2)cc1[N+](=O)[O-]	ZINC000536544906	448528346	/nfs/dbraw/zinc/52/83/46/448528346.db2.gz	KPMUNCZOMKZUDH-UHFFFAOYSA-N	-1	3	338.349	1.091	20	5		EDBDHM
CNc1ccc(C(=O)Nc2nc(SCCO)n[n-]2)cc1[N+](=O)[O-]	ZINC000536544906	448528349	/nfs/dbraw/zinc/52/83/49/448528349.db2.gz	KPMUNCZOMKZUDH-UHFFFAOYSA-N	-1	3	338.349	1.091	20	5		EDBDHM
CNc1ccc(C(=O)Nc2n[n-]c(SCCO)n2)cc1[N+](=O)[O-]	ZINC000536544906	448528352	/nfs/dbraw/zinc/52/83/52/448528352.db2.gz	KPMUNCZOMKZUDH-UHFFFAOYSA-N	-1	3	338.349	1.091	20	5		EDBDHM
CC1(C)C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C(C)(C)O1	ZINC000593574010	449082512	/nfs/dbraw/zinc/08/25/12/449082512.db2.gz	WTFMUKVNVLWILJ-JTQLQIEISA-N	-1	3	329.378	1.614	20	5		EDBDHM
O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CCc2nc[n-]c(=O)c2C1	ZINC000593105681	449137792	/nfs/dbraw/zinc/13/77/92/449137792.db2.gz	UHDDXUWNLFABJT-UHFFFAOYSA-N	-1	3	332.291	1.357	20	5		EDBDHM
CCn1ccnc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000590760523	449279109	/nfs/dbraw/zinc/27/91/09/449279109.db2.gz	SZSSOWVURSKCIT-UHFFFAOYSA-N	-1	3	328.325	1.429	20	5		EDBDHM
CC(C)OC(=O)CNC(=O)[C@@H](C)Sc1cc[n-]c(=O)c1[N+](=O)[O-]	ZINC000596270284	449448620	/nfs/dbraw/zinc/44/86/20/449448620.db2.gz	YNAWHOMWAQMEPE-MRVPVSSYSA-N	-1	3	343.361	1.244	20	5		EDBDHM
COCc1nnc(Sc2nccc(C(=O)OC)c2[N+](=O)[O-])[n-]1	ZINC000598602658	449487660	/nfs/dbraw/zinc/48/76/60/449487660.db2.gz	CKNMGENSXWPKLQ-UHFFFAOYSA-N	-1	3	325.306	1.192	20	5		EDBDHM
COCc1n[n-]c(Sc2nccc(C(=O)OC)c2[N+](=O)[O-])n1	ZINC000598602658	449487664	/nfs/dbraw/zinc/48/76/64/449487664.db2.gz	CKNMGENSXWPKLQ-UHFFFAOYSA-N	-1	3	325.306	1.192	20	5		EDBDHM
COCc1nc(Sc2nccc(C(=O)OC)c2[N+](=O)[O-])n[n-]1	ZINC000598602658	449487669	/nfs/dbraw/zinc/48/76/69/449487669.db2.gz	CKNMGENSXWPKLQ-UHFFFAOYSA-N	-1	3	325.306	1.192	20	5		EDBDHM
CO[C@@H](C)CC[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594754270	449669706	/nfs/dbraw/zinc/66/97/06/449669706.db2.gz	ZLHRJCJJYGMLBK-JTQLQIEISA-N	-1	3	339.373	1.846	20	5		EDBDHM
C[C@H](C[C@H](C)O)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594771635	449684527	/nfs/dbraw/zinc/68/45/27/449684527.db2.gz	JAYNIQGRHSBTFQ-ZJUUUORDSA-N	-1	3	339.373	1.581	20	5		EDBDHM
COCC1([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2OC)CCCC1	ZINC000594792261	449702051	/nfs/dbraw/zinc/70/20/51/449702051.db2.gz	YHZZYZOMLFHEMA-UHFFFAOYSA-N	-1	3	344.389	1.841	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]CC(O)(C1CC1)C1CC1	ZINC000594867151	449782760	/nfs/dbraw/zinc/78/27/60/449782760.db2.gz	XWDWRNXHWHKIDQ-UHFFFAOYSA-N	-1	3	340.401	1.565	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2CCC[C@@H](C)O2)c([N+](=O)[O-])c1	ZINC000594852245	449760563	/nfs/dbraw/zinc/76/05/63/449760563.db2.gz	PHMXSGINZHHWII-PWSUYJOCSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCOCC(F)(F)F)c([N+](=O)[O-])s1	ZINC000601297519	449807420	/nfs/dbraw/zinc/80/74/20/449807420.db2.gz	BQFJBEIPASGWRG-UHFFFAOYSA-N	-1	3	348.324	1.822	20	5		EDBDHM
CCCN(CC)CC[N-]S(=O)(=O)c1cc(C)sc1[N+](=O)[O-]	ZINC000601362164	449874884	/nfs/dbraw/zinc/87/48/84/449874884.db2.gz	DECOJDWHGSIEDA-UHFFFAOYSA-N	-1	3	335.451	1.975	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN2CC[C@@H](C)C2)c([N+](=O)[O-])s1	ZINC000601362882	449875598	/nfs/dbraw/zinc/87/55/98/449875598.db2.gz	XVFCHOWCFDEEPH-SECBINFHSA-N	-1	3	333.435	1.585	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@H]2CCCN(C)C2)c(F)cc1[N+](=O)[O-]	ZINC000601340273	449849922	/nfs/dbraw/zinc/84/99/22/449849922.db2.gz	OCWVQRCLWWOGAP-NSHDSACASA-N	-1	3	345.396	1.662	20	5		EDBDHM
O=C(CNC(=O)c1ccc([O-])cc1)NCCc1ccc([N+](=O)[O-])cc1	ZINC000608985142	449955457	/nfs/dbraw/zinc/95/54/57/449955457.db2.gz	JOCFSUWWVMHFKJ-UHFFFAOYSA-N	-1	3	343.339	1.389	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](CO)CCC(C)C	ZINC000599410853	449956654	/nfs/dbraw/zinc/95/66/54/449956654.db2.gz	SVZJCQWBSKPFFE-LLVKDONJSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CC[C@@H]1OCC[C@H]1[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F	ZINC000601436999	449958886	/nfs/dbraw/zinc/95/88/86/449958886.db2.gz	PRMICBGGYHQZSW-PWSUYJOCSA-N	-1	3	332.353	1.888	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2[C@@H](C)[C@H](C)O[C@H]2C)c([N+](=O)[O-])c1	ZINC000599460506	449994922	/nfs/dbraw/zinc/99/49/22/449994922.db2.gz	XZXKLQJSDYFXTJ-QSDJMHMYSA-N	-1	3	344.389	1.694	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2C[C@H]2C(F)(F)F)c([N+](=O)[O-])c1	ZINC000601521291	450043462	/nfs/dbraw/zinc/04/34/62/450043462.db2.gz	MHXOSLPJTWTWRZ-HTQZYQBOSA-N	-1	3	340.279	1.833	20	5		EDBDHM
O=C([N-]c1nnc2ccccn21)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000603620692	450335641	/nfs/dbraw/zinc/33/56/41/450335641.db2.gz	LELZWMXNGZKZIU-UHFFFAOYSA-N	-1	3	327.256	1.619	20	5		EDBDHM
O=C(c1c[n-]c(=O)c([N+](=O)[O-])c1)N1CCN([C@@H]2C[C@H]3CC[C@@H]2C3)CC1	ZINC000187165121	534767312	/nfs/dbraw/zinc/76/73/12/534767312.db2.gz	CQUFFMWMXDTCFL-OUCADQQQSA-N	-1	3	346.387	1.642	20	5		EDBDHM
CCN(CC)C(=O)CCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000046035758	535418935	/nfs/dbraw/zinc/41/89/35/535418935.db2.gz	HSVSJVBQYNZQRT-UHFFFAOYSA-N	-1	3	343.405	1.522	20	5		EDBDHM
O=C(NCc1ccc(-c2nnn[n-]2)cc1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000732086342	578690397	/nfs/dbraw/zinc/69/03/97/578690397.db2.gz	VXHPDBVFNZRJLC-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=C(NCc1ccc(-c2nn[n-]n2)cc1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000732086342	578690399	/nfs/dbraw/zinc/69/03/99/578690399.db2.gz	VXHPDBVFNZRJLC-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
CCCO[C@H]1CCCN(c2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000736487362	578992593	/nfs/dbraw/zinc/99/25/93/578992593.db2.gz	GHZGKVIJSIOZJV-LBPRGKRZSA-N	-1	3	347.379	1.955	20	5		EDBDHM
CCCO[C@H]1CCCN(c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000736487362	578992594	/nfs/dbraw/zinc/99/25/94/578992594.db2.gz	GHZGKVIJSIOZJV-LBPRGKRZSA-N	-1	3	347.379	1.955	20	5		EDBDHM
Cc1nc(C)c(CCNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)s1	ZINC000737473939	579096467	/nfs/dbraw/zinc/09/64/67/579096467.db2.gz	NEPQJUDTWVYNLV-UHFFFAOYSA-N	-1	3	346.376	1.898	20	5		EDBDHM
Cc1nc(C)c(CCNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)s1	ZINC000737473939	579096468	/nfs/dbraw/zinc/09/64/68/579096468.db2.gz	NEPQJUDTWVYNLV-UHFFFAOYSA-N	-1	3	346.376	1.898	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@@H]2CCCCN2C2CC2)cs1	ZINC000766206357	580161878	/nfs/dbraw/zinc/16/18/78/580161878.db2.gz	FJROYNDZCPDWJB-NSHDSACASA-N	-1	3	345.446	1.952	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H]2CCO[C@]3(CCOC3)C2)cs1	ZINC000768882559	580223373	/nfs/dbraw/zinc/22/33/73/580223373.db2.gz	PIBCSCKGXUYSIN-BXKDBHETSA-N	-1	3	348.402	1.273	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]Cc1cccnc1F	ZINC000795265418	580917055	/nfs/dbraw/zinc/91/70/55/580917055.db2.gz	LQOQLEASYLPZIX-UHFFFAOYSA-N	-1	3	325.321	1.916	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCOC[C@H]2CCOC2)c(-c2nnn[n-]2)c1	ZINC000738373385	598973275	/nfs/dbraw/zinc/97/32/75/598973275.db2.gz	BLSGYQAJCFDSAU-SNVBAGLBSA-N	-1	3	349.351	1.025	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCOC[C@H]2CCOC2)c(-c2nn[n-]n2)c1	ZINC000738373385	598973277	/nfs/dbraw/zinc/97/32/77/598973277.db2.gz	BLSGYQAJCFDSAU-SNVBAGLBSA-N	-1	3	349.351	1.025	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@H]23)c1C	ZINC000907766485	592783369	/nfs/dbraw/zinc/78/33/69/592783369.db2.gz	HSKMPNCFWNPNBO-QXJJFIIZSA-N	-1	3	338.385	1.666	20	5		EDBDHM
CC(C)(O)CO[N-]C(=O)c1ccc([N+](=O)[O-])cc1Br	ZINC000839739713	593377554	/nfs/dbraw/zinc/37/75/54/593377554.db2.gz	RQDOXVDGQGYILB-UHFFFAOYSA-N	-1	3	333.138	1.790	20	5		EDBDHM
CCOCCO[N-]C(=O)c1cc(OCC)c(OC)cc1[N+](=O)[O-]	ZINC000772690976	593455078	/nfs/dbraw/zinc/45/50/78/593455078.db2.gz	ICWXKWBCVSXZCC-UHFFFAOYSA-N	-1	3	328.321	1.700	20	5		EDBDHM
C[C@H](CO[C@@H]1CCOC1)Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000820286980	593806486	/nfs/dbraw/zinc/80/64/86/593806486.db2.gz	HUOIEAUDVCRWFJ-MWLCHTKSSA-N	-1	3	334.336	1.381	20	5		EDBDHM
C[C@H](CO[C@@H]1CCOC1)Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000820286980	593806487	/nfs/dbraw/zinc/80/64/87/593806487.db2.gz	HUOIEAUDVCRWFJ-MWLCHTKSSA-N	-1	3	334.336	1.381	20	5		EDBDHM
CC[C@H](NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000820920157	593922242	/nfs/dbraw/zinc/92/22/42/593922242.db2.gz	LZVNCNUUQFRFLK-LBPRGKRZSA-N	-1	3	341.331	1.984	20	5		EDBDHM
CC[C@H](NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000820920157	593922244	/nfs/dbraw/zinc/92/22/44/593922244.db2.gz	LZVNCNUUQFRFLK-LBPRGKRZSA-N	-1	3	341.331	1.984	20	5		EDBDHM
COc1ccc(CN(C)c2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cc1	ZINC000821794464	593940680	/nfs/dbraw/zinc/94/06/80/593940680.db2.gz	HTKNNDWFRBBISC-UHFFFAOYSA-N	-1	3	341.331	1.815	20	5		EDBDHM
COc1ccc(CN(C)c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)cc1	ZINC000821794464	593940683	/nfs/dbraw/zinc/94/06/83/593940683.db2.gz	HTKNNDWFRBBISC-UHFFFAOYSA-N	-1	3	341.331	1.815	20	5		EDBDHM
Cc1cc(=O)n(Cc2cc(F)ccc2-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000822160243	594002150	/nfs/dbraw/zinc/00/21/50/594002150.db2.gz	FPRVRCNGUJOPCT-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cc1cc(=O)n(Cc2cc(F)ccc2-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000822160243	594002151	/nfs/dbraw/zinc/00/21/51/594002151.db2.gz	FPRVRCNGUJOPCT-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cn1cc(-c2nnn[n-]2)cc1C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F	ZINC000822645590	594078715	/nfs/dbraw/zinc/07/87/15/594078715.db2.gz	GLNWWKXWJWRVDK-UHFFFAOYSA-N	-1	3	349.257	1.644	20	5		EDBDHM
Cn1cc(-c2nn[n-]n2)cc1C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F	ZINC000822645590	594078716	/nfs/dbraw/zinc/07/87/16/594078716.db2.gz	GLNWWKXWJWRVDK-UHFFFAOYSA-N	-1	3	349.257	1.644	20	5		EDBDHM
C[C@H]1C[C@H](CCNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CCO1	ZINC000824883541	594090114	/nfs/dbraw/zinc/09/01/14/594090114.db2.gz	HZQOYTYJRNPMJH-VHSXEESVSA-N	-1	3	333.352	1.787	20	5		EDBDHM
C[C@H]1C[C@H](CCNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CCO1	ZINC000824883541	594090115	/nfs/dbraw/zinc/09/01/15/594090115.db2.gz	HZQOYTYJRNPMJH-VHSXEESVSA-N	-1	3	333.352	1.787	20	5		EDBDHM
O=C(NCc1ccc([N+](=O)[O-])cc1)c1cc(-c2nnn[n-]2)cs1	ZINC000823253649	594175694	/nfs/dbraw/zinc/17/56/94/594175694.db2.gz	JZVCBYKGQNHNKD-UHFFFAOYSA-N	-1	3	330.329	1.766	20	5		EDBDHM
O=C(NCc1ccc([N+](=O)[O-])cc1)c1cc(-c2nn[n-]n2)cs1	ZINC000823253649	594175695	/nfs/dbraw/zinc/17/56/95/594175695.db2.gz	JZVCBYKGQNHNKD-UHFFFAOYSA-N	-1	3	330.329	1.766	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCO[C@H]([C@@H]2CCCO2)C1	ZINC000823629714	594223018	/nfs/dbraw/zinc/22/30/18/594223018.db2.gz	FQBIDTIRLLXZSB-KBPBESRZSA-N	-1	3	346.347	1.159	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCO[C@H]([C@@H]2CCCO2)C1	ZINC000823629714	594223019	/nfs/dbraw/zinc/22/30/19/594223019.db2.gz	FQBIDTIRLLXZSB-KBPBESRZSA-N	-1	3	346.347	1.159	20	5		EDBDHM
O=[N+]([O-])c1cc(N[C@H](CO)Cc2ccccc2)ccc1-c1nnn[n-]1	ZINC000823634700	594223304	/nfs/dbraw/zinc/22/33/04/594223304.db2.gz	KFEDOLNSUYWYDB-ZDUSSCGKSA-N	-1	3	340.343	1.790	20	5		EDBDHM
COc1ccc(CNc2ncccc2[N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000826204416	594377463	/nfs/dbraw/zinc/37/74/63/594377463.db2.gz	KGZRWUUSOXAAMV-UHFFFAOYSA-N	-1	3	327.304	1.791	20	5		EDBDHM
COc1ccc(CNc2ncccc2[N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000826204416	594377464	/nfs/dbraw/zinc/37/74/64/594377464.db2.gz	KGZRWUUSOXAAMV-UHFFFAOYSA-N	-1	3	327.304	1.791	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@H]2CCO[C@]3(CCOC3)C2)c(-c2nnn[n-]2)c1	ZINC000826498734	594502887	/nfs/dbraw/zinc/50/28/87/594502887.db2.gz	HJJSUKLTGKZFDG-ZUZCIYMTSA-N	-1	3	346.347	1.525	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@H]2CCO[C@]3(CCOC3)C2)c(-c2nn[n-]n2)c1	ZINC000826498734	594502889	/nfs/dbraw/zinc/50/28/89/594502889.db2.gz	HJJSUKLTGKZFDG-ZUZCIYMTSA-N	-1	3	346.347	1.525	20	5		EDBDHM
O=[N+]([O-])c1cnc(Nc2cccc(CCCO)c2)c(-c2nnn[n-]2)c1	ZINC000826501082	594503255	/nfs/dbraw/zinc/50/32/55/594503255.db2.gz	YNYKZZXOBYIVFH-UHFFFAOYSA-N	-1	3	341.331	1.838	20	5		EDBDHM
O=[N+]([O-])c1cnc(Nc2cccc(CCCO)c2)c(-c2nn[n-]n2)c1	ZINC000826501082	594503257	/nfs/dbraw/zinc/50/32/57/594503257.db2.gz	YNYKZZXOBYIVFH-UHFFFAOYSA-N	-1	3	341.331	1.838	20	5		EDBDHM
O=c1ccc([N+](=O)[O-])cn1CCSc1ccc(-c2nnn[n-]2)cn1	ZINC000826502186	594504924	/nfs/dbraw/zinc/50/49/24/594504924.db2.gz	YEERHEJVLHXJRB-UHFFFAOYSA-N	-1	3	345.344	1.124	20	5		EDBDHM
O=c1ccc([N+](=O)[O-])cn1CCSc1ccc(-c2nn[n-]n2)cn1	ZINC000826502186	594504926	/nfs/dbraw/zinc/50/49/26/594504926.db2.gz	YEERHEJVLHXJRB-UHFFFAOYSA-N	-1	3	345.344	1.124	20	5		EDBDHM
C[C@]1(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])CCCC[C@H]1C(=O)[O-]	ZINC000833568129	594876125	/nfs/dbraw/zinc/87/61/25/594876125.db2.gz	DSWYEXVIZITENE-LRDDRELGSA-N	-1	3	335.360	1.817	20	5		EDBDHM
NC(=O)c1ccc(CNC2(C(=O)[O-])CCCCCC2)c([N+](=O)[O-])c1	ZINC000833762745	594924416	/nfs/dbraw/zinc/92/44/16/594924416.db2.gz	UOQFNMVCFZBINE-UHFFFAOYSA-N	-1	3	335.360	1.961	20	5		EDBDHM
C[C@@]1(C[N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)CCC(=O)N1	ZINC000848592733	595412549	/nfs/dbraw/zinc/41/25/49/595412549.db2.gz	ZFWRHVZBYULGTL-ZDUSSCGKSA-N	-1	3	343.286	1.351	20	5		EDBDHM
CCON(C)C(=O)C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848593406	595412827	/nfs/dbraw/zinc/41/28/27/595412827.db2.gz	HLANESXMXLVAKP-UHFFFAOYSA-N	-1	3	347.274	1.093	20	5		EDBDHM
C/C(=C\C(=O)[N-]OCCN1CCCC1=O)c1ccc([N+](=O)[O-])cc1	ZINC000856043362	595884083	/nfs/dbraw/zinc/88/40/83/595884083.db2.gz	VIOYJZKVZVQRGD-VAWYXSNFSA-N	-1	3	333.344	1.668	20	5		EDBDHM
O=C([N-][C@@H](CO)C1CCC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000853820323	595891167	/nfs/dbraw/zinc/89/11/67/595891167.db2.gz	MTHIXKUIAMBXRZ-LBPRGKRZSA-N	-1	3	330.287	1.844	20	5		EDBDHM
CCCN1CC[C@@H]([N-]S(=O)(=O)c2cc(F)c(C)cc2[N+](=O)[O-])C1	ZINC000867528504	596417028	/nfs/dbraw/zinc/41/70/28/596417028.db2.gz	PGMUZGDHHUEMPQ-LLVKDONJSA-N	-1	3	345.396	1.805	20	5		EDBDHM
CON(C)C(=O)[C@H](C)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000863520861	596608084	/nfs/dbraw/zinc/60/80/84/596608084.db2.gz	VOVXTOTWWNJBPV-QMMMGPOBSA-N	-1	3	347.274	1.091	20	5		EDBDHM
CC(C)(C(=O)[O-])N1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC1	ZINC000864159655	596773320	/nfs/dbraw/zinc/77/33/20/596773320.db2.gz	WQCZNWBFZWWVFN-YVMONPNESA-N	-1	3	347.371	1.615	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCCC[C@@H]2O)c(Cl)c1	ZINC000052003560	214112616	/nfs/dbraw/zinc/11/26/16/214112616.db2.gz	SACZAQLXUWSDCI-QWRGUYRKSA-N	-1	3	334.781	1.830	20	5		EDBDHM
CCC(CC)([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C(N)=O	ZINC000101923232	282143489	/nfs/dbraw/zinc/14/34/89/282143489.db2.gz	AROJYQYDKHNHHD-UHFFFAOYSA-N	-1	3	329.378	1.226	20	5		EDBDHM
C[N-]S(=O)(=O)c1cc(C(=O)Nc2cccc([N+](=O)[O-])c2)c(C)o1	ZINC000177600212	530026192	/nfs/dbraw/zinc/02/61/92/530026192.db2.gz	ACNPSHNYXFVURR-UHFFFAOYSA-N	-1	3	339.329	1.657	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@H](C)[C@@H](C)CO)c1	ZINC000183716227	235205488	/nfs/dbraw/zinc/20/54/88/235205488.db2.gz	LOVGKHXOUBZOAZ-IUCAKERBSA-N	-1	3	336.797	1.852	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCC[C@@]2(C)CO)cc1[N+](=O)[O-]	ZINC000124661666	138328848	/nfs/dbraw/zinc/32/88/48/138328848.db2.gz	JHJZFTKBFJZJGZ-PWSUYJOCSA-N	-1	3	334.419	1.794	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H]1CCN(CC(F)F)C1	ZINC000416659350	251101496	/nfs/dbraw/zinc/10/14/96/251101496.db2.gz	HNPYPHCWPLQATQ-VIFPVBQESA-N	-1	3	335.332	1.213	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1[C@H]2CCO[C@@H]2C1(C)C	ZINC000153370884	224095129	/nfs/dbraw/zinc/09/51/29/224095129.db2.gz	BNNHGNQDAVBRHE-HONMWMINSA-N	-1	3	340.401	1.995	20	5		EDBDHM
COC(=O)Cc1n[n-]c(NC(=O)C=Cc2ccc([N+](=O)[O-])cc2)n1	ZINC000491847732	255151835	/nfs/dbraw/zinc/15/18/35/255151835.db2.gz	RKRVIKBCIJVCQM-DAXSKMNVSA-N	-1	3	331.288	1.080	20	5		EDBDHM
COC(=O)Cc1nnc(NC(=O)C=Cc2ccc([N+](=O)[O-])cc2)[n-]1	ZINC000491847732	255151836	/nfs/dbraw/zinc/15/18/36/255151836.db2.gz	RKRVIKBCIJVCQM-DAXSKMNVSA-N	-1	3	331.288	1.080	20	5		EDBDHM
COC(=O)Cc1nc(NC(=O)C=Cc2ccc([N+](=O)[O-])cc2)n[n-]1	ZINC000491847732	255151837	/nfs/dbraw/zinc/15/18/37/255151837.db2.gz	RKRVIKBCIJVCQM-DAXSKMNVSA-N	-1	3	331.288	1.080	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H](C)C[C@@H](C)O)cc1[N+](=O)[O-]	ZINC000493923716	255226769	/nfs/dbraw/zinc/22/67/69/255226769.db2.gz	DKVRSFXQYSAOML-HTQZYQBOSA-N	-1	3	336.341	1.180	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]Cc2cc(C(N)=O)co2)c([N+](=O)[O-])c1	ZINC000494339515	255246914	/nfs/dbraw/zinc/24/69/14/255246914.db2.gz	OZHMWWSEFGQPSS-UHFFFAOYSA-N	-1	3	339.329	1.074	20	5		EDBDHM
CCC[C@](C)([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000268573882	139803093	/nfs/dbraw/zinc/80/30/93/139803093.db2.gz	RQTKHZBLNLWTHZ-AWEZNQCLSA-N	-1	3	344.389	1.746	20	5		EDBDHM
CC(C)N1CC[C@@H]([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000272146103	140408714	/nfs/dbraw/zinc/40/87/14/140408714.db2.gz	BNIFLOXIUQRIQE-GFCCVEGCSA-N	-1	3	341.314	1.812	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@]1(C)CCCO1	ZINC000331332280	141008352	/nfs/dbraw/zinc/00/83/52/141008352.db2.gz	IDYCZENEDNDREB-ZDUSSCGKSA-N	-1	3	330.362	1.451	20	5		EDBDHM
O=[N+]([O-])c1ccc(CS(=O)(=O)[N-][C@@H](CO)CC(F)(F)F)cc1	ZINC000339788576	142157113	/nfs/dbraw/zinc/15/71/13/142157113.db2.gz	SPGVXCQLXSATRR-SECBINFHSA-N	-1	3	342.295	1.328	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CC[C@@H](C)C1	ZINC000345350242	143081105	/nfs/dbraw/zinc/08/11/05/143081105.db2.gz	XQNYBJMRAWDWAF-NXEZZACHSA-N	-1	3	342.373	1.848	20	5		EDBDHM
CCn1cc(S(=O)(=O)[N-]CCc2ccc([N+](=O)[O-])cc2)nc1C	ZINC000347972988	143385735	/nfs/dbraw/zinc/38/57/35/143385735.db2.gz	WZUNRSHOWFHAJD-UHFFFAOYSA-N	-1	3	338.389	1.641	20	5		EDBDHM
COCC[C@@H](C)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000416576823	304333456	/nfs/dbraw/zinc/33/34/56/304333456.db2.gz	DXUHSKGNRWHHDI-SNVBAGLBSA-N	-1	3	332.378	1.554	20	5		EDBDHM
Cc1nnc([C@@H](C)[N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)s1	ZINC000352999286	149246332	/nfs/dbraw/zinc/24/63/32/149246332.db2.gz	DGASJHUCGUDEHA-MRVPVSSYSA-N	-1	3	342.402	1.935	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]Cc2ccnc(C)n2)c1[N+](=O)[O-]	ZINC000360255460	151968204	/nfs/dbraw/zinc/96/82/04/151968204.db2.gz	BFVGXUFARNIZIG-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
Cc1cc(N2CC(S(=O)(=O)[N-]c3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000364022360	153124592	/nfs/dbraw/zinc/12/45/92/153124592.db2.gz	YTWMUOJOWVTDAH-UHFFFAOYSA-N	-1	3	348.384	1.929	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]C[C@@H]1C[C@H](F)CN1	ZINC000367774020	154262930	/nfs/dbraw/zinc/26/29/30/154262930.db2.gz	XLHVPVAXRJCDGC-IUCAKERBSA-N	-1	3	337.760	1.227	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2C(N)=O)c1C	ZINC000120987892	287366874	/nfs/dbraw/zinc/36/68/74/287366874.db2.gz	JEOGDEYDYFXZMC-WDEREUQCSA-N	-1	3	341.389	1.144	20	5		EDBDHM
O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1cc(=O)c([O-])co1	ZINC000130570191	287495033	/nfs/dbraw/zinc/49/50/33/287495033.db2.gz	TXJGWFCXLXMPIK-UHFFFAOYSA-N	-1	3	331.240	1.119	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1CCSC1	ZINC000279865709	273334964	/nfs/dbraw/zinc/33/49/64/273334964.db2.gz	SVMDSIAIRFDPMO-VIFPVBQESA-N	-1	3	332.403	1.635	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC[C@@H](C)OC	ZINC000273617368	268065640	/nfs/dbraw/zinc/06/56/40/268065640.db2.gz	VHZJBJORMMTDTC-SECBINFHSA-N	-1	3	346.361	1.085	20	5		EDBDHM
Cc1nc(C(C)(C)[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])no1	ZINC000273717535	268077142	/nfs/dbraw/zinc/07/71/42/268077142.db2.gz	RFGYFFLEQKDTDQ-UHFFFAOYSA-N	-1	3	340.361	1.641	20	5		EDBDHM
O=C([N-]OCCC(F)(F)F)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000275035516	268269507	/nfs/dbraw/zinc/26/95/07/268269507.db2.gz	CXSGPYLZYVTWNP-UHFFFAOYSA-N	-1	3	336.222	1.980	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCCOC2)cc1[N+](=O)[O-]	ZINC000275078983	273099989	/nfs/dbraw/zinc/09/99/89/273099989.db2.gz	NBOAPZBGPPYCLQ-MRVPVSSYSA-N	-1	3	334.325	1.200	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCOC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000277690400	273217507	/nfs/dbraw/zinc/21/75/07/273217507.db2.gz	HJTWDCFDADBRBZ-GXSJLCMTSA-N	-1	3	330.362	1.307	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCC2(O)CCC2)c1[N+](=O)[O-]	ZINC000284643053	274276377	/nfs/dbraw/zinc/27/63/77/274276377.db2.gz	LPPZHMCXLXSYME-UHFFFAOYSA-N	-1	3	328.390	1.795	20	5		EDBDHM
CC[C@@H](C)[C@@H]([N-]S(C)(=O)=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1	ZINC000114115198	280118839	/nfs/dbraw/zinc/11/88/39/280118839.db2.gz	SQLGPMRXAQRGMO-NOZJJQNGSA-N	-1	3	343.405	1.806	20	5		EDBDHM
CCOCC(C)(C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000288498222	288500102	/nfs/dbraw/zinc/50/01/02/288500102.db2.gz	WXRPGRCZHOJMKO-UHFFFAOYSA-N	-1	3	346.405	1.944	20	5		EDBDHM
Cc1nnsc1C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000292008248	289237776	/nfs/dbraw/zinc/23/77/76/289237776.db2.gz	MHYKRWOUJSIGAR-UHFFFAOYSA-N	-1	3	342.402	1.850	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CSC[C@H]2C)c([N+](=O)[O-])c1	ZINC000352334266	295201139	/nfs/dbraw/zinc/20/11/39/295201139.db2.gz	ZIVKTUCIPOSRIR-SCZZXKLOSA-N	-1	3	332.403	1.633	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCCO[C@@H]1CCOC1	ZINC000268228808	302047300	/nfs/dbraw/zinc/04/73/00/302047300.db2.gz	KNZFUMDJURDPGN-GFCCVEGCSA-N	-1	3	344.389	1.377	20	5		EDBDHM
CC/C=C/C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC	ZINC000295529300	303230339	/nfs/dbraw/zinc/23/03/39/303230339.db2.gz	QBMLVOXNCPXCDG-SNAWJCMRSA-N	-1	3	328.346	1.626	20	5		EDBDHM
CCC[C@H](C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)OC	ZINC000296256335	303305937	/nfs/dbraw/zinc/30/59/37/303305937.db2.gz	PQEAZBSWCPMGOX-LLVKDONJSA-N	-1	3	332.378	1.697	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1(OC)CCCC1	ZINC000296555611	303323963	/nfs/dbraw/zinc/32/39/63/303323963.db2.gz	CDSOGFYCBBEDEZ-UHFFFAOYSA-N	-1	3	344.389	1.841	20	5		EDBDHM
O=C(NCCNc1ccc2ncc([N+](=O)[O-])n2n1)c1ccc([O-])cc1	ZINC000301937878	303704052	/nfs/dbraw/zinc/70/40/52/303704052.db2.gz	SEHATYXCNYGYSS-UHFFFAOYSA-N	-1	3	342.315	1.185	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCC[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000452024121	305379463	/nfs/dbraw/zinc/37/94/63/305379463.db2.gz	XMDAPLQOFNJRQC-LLVKDONJSA-N	-1	3	344.389	1.698	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CCn2ccnc2C1	ZINC000492023665	305582369	/nfs/dbraw/zinc/58/23/69/305582369.db2.gz	MVBHDRJMDKTUTO-NSHDSACASA-N	-1	3	336.373	1.393	20	5		EDBDHM
NC(=O)CCCC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000537170221	306026435	/nfs/dbraw/zinc/02/64/35/306026435.db2.gz	FPXCBGHYKJSBHR-UHFFFAOYSA-N	-1	3	335.769	1.182	20	5		EDBDHM
O=C(c1ccccc1[O-])N1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000058773119	441211196	/nfs/dbraw/zinc/21/11/96/441211196.db2.gz	LDPKDHFWLMIMSY-UHFFFAOYSA-N	-1	3	328.328	1.658	20	5		EDBDHM
COC(=O)CCCCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000055216343	441630477	/nfs/dbraw/zinc/63/04/77/441630477.db2.gz	WWTNYZBYHQNMIK-UHFFFAOYSA-N	-1	3	348.352	1.746	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C)C(=O)NC(C)(C)C	ZINC000067717607	441672241	/nfs/dbraw/zinc/67/22/41/441672241.db2.gz	DBBXMQBMILYYNJ-SNVBAGLBSA-N	-1	3	343.405	1.485	20	5		EDBDHM
Cc1noc(C)c1S(=O)(=O)[N-]CCOc1ccc([N+](=O)[O-])cc1	ZINC000068940092	441872020	/nfs/dbraw/zinc/87/20/20/441872020.db2.gz	BVUZAEYWDYCEJS-UHFFFAOYSA-N	-1	3	341.345	1.557	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC[C@H](C)[S@@](C)=O)c([N+](=O)[O-])c1	ZINC000124136184	441909431	/nfs/dbraw/zinc/90/94/31/441909431.db2.gz	RULMZFPGVRILEC-FVINQWEUSA-N	-1	3	334.419	1.339	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CCCCO1	ZINC000145395862	441889325	/nfs/dbraw/zinc/88/93/25/441889325.db2.gz	IUWUZQFMYJJGIZ-LLVKDONJSA-N	-1	3	330.362	1.451	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@H](C)N(C)C2CC2)c([N+](=O)[O-])c1	ZINC000069129105	441895792	/nfs/dbraw/zinc/89/57/92/441895792.db2.gz	JMWLBWLLACYNOQ-NSHDSACASA-N	-1	3	327.406	1.664	20	5		EDBDHM
O=C(NCCCNC(=O)c1cccc([O-])c1)c1ccc([N+](=O)[O-])o1	ZINC000154591926	442347157	/nfs/dbraw/zinc/34/71/57/442347157.db2.gz	VMDKZQDQGYKFMY-UHFFFAOYSA-N	-1	3	333.300	1.443	20	5		EDBDHM
CC[C@]([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])(C(N)=O)C(C)C	ZINC000184872133	443089135	/nfs/dbraw/zinc/08/91/35/443089135.db2.gz	SALOHMUXXCBZKM-CQSZACIVSA-N	-1	3	343.405	1.304	20	5		EDBDHM
CC[C@@H](CCO)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000268660055	443067964	/nfs/dbraw/zinc/06/79/64/443067964.db2.gz	XDAWFNUNLPVKPJ-JTQLQIEISA-N	-1	3	332.378	1.290	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCCC[C@@H]1CO	ZINC000269301808	443273757	/nfs/dbraw/zinc/27/37/57/443273757.db2.gz	QVUCBVKQGDNCOR-ZYHUDNBSSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CC[C@@](C)([N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)C(=O)OC	ZINC000272440978	443317065	/nfs/dbraw/zinc/31/70/65/443317065.db2.gz	IJTFWIMJEKOVFT-CQSZACIVSA-N	-1	3	344.389	1.398	20	5		EDBDHM
Cc1cc([C@@H]2CCCN(C(=O)c3cc([N+](=O)[O-])c[n-]c3=O)C2)n[nH]1	ZINC000282829896	443444921	/nfs/dbraw/zinc/44/49/21/443444921.db2.gz	QHYFQDXKIQHBHF-SNVBAGLBSA-N	-1	3	331.332	1.747	20	5		EDBDHM
CC[C@H](C)NC(=O)[C@@H](C)[N-]c1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000272834998	443461102	/nfs/dbraw/zinc/46/11/02/443461102.db2.gz	LPROLPUPHFXDJT-JGVFFNPUSA-N	-1	3	349.434	1.775	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C[C@H](O)C2CC2)c1	ZINC000272408170	443616276	/nfs/dbraw/zinc/61/62/76/443616276.db2.gz	BTCJSGRTYSZWBO-JTQLQIEISA-N	-1	3	334.781	1.606	20	5		EDBDHM
CCOCC(C)(C)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000288455449	443886304	/nfs/dbraw/zinc/88/63/04/443886304.db2.gz	RWKIQHNHSKZTOV-UHFFFAOYSA-N	-1	3	346.405	1.944	20	5		EDBDHM
Cc1ccccc1[C@@H](CO)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000533095134	320682162	/nfs/dbraw/zinc/68/21/62/320682162.db2.gz	KFZQDPJZLUBKPJ-CYBMUJFWSA-N	-1	3	336.369	1.915	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCOC[C@@H]2C)c1C	ZINC000277728402	444033312	/nfs/dbraw/zinc/03/33/12/444033312.db2.gz	JMRADOSJAFAWGE-CMPLNLGQSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCOC[C@H]2C)c1C	ZINC000277728408	444033602	/nfs/dbraw/zinc/03/36/02/444033602.db2.gz	JMRADOSJAFAWGE-PWSUYJOCSA-N	-1	3	328.390	1.915	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@@H]2CCN(c3nc4nncc-4c(O)[n-]3)C2)nc1	ZINC000302719073	444221171	/nfs/dbraw/zinc/22/11/71/444221171.db2.gz	GZCIZRHAXZLFMM-MRVPVSSYSA-N	-1	3	342.319	1.053	20	5		EDBDHM
CC(C)(CO)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000289730683	444196108	/nfs/dbraw/zinc/19/61/08/444196108.db2.gz	ZQFDBDPUTWFHIV-ZDUSSCGKSA-N	-1	3	346.380	1.809	20	5		EDBDHM
CCc1cc(=O)[n-]c(CN2CCN(c3ncccc3[N+](=O)[O-])CC2)n1	ZINC000298059847	444401734	/nfs/dbraw/zinc/40/17/34/444401734.db2.gz	JWVOWOFGZKXCIW-UHFFFAOYSA-N	-1	3	344.375	1.370	20	5		EDBDHM
CCOC(=O)C[C@H](C)C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000340604457	444457403	/nfs/dbraw/zinc/45/74/03/444457403.db2.gz	MOLYDSRVZNLQDY-NSHDSACASA-N	-1	3	344.389	1.771	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCCn2ccnc2C)cc1[N+](=O)[O-]	ZINC000337958832	444471543	/nfs/dbraw/zinc/47/15/43/444471543.db2.gz	FEDORSJUHZKNBT-UHFFFAOYSA-N	-1	3	344.418	1.838	20	5		EDBDHM
CCOC(=O)[C@@H](C)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000342504601	444720810	/nfs/dbraw/zinc/72/08/10/444720810.db2.gz	RKWIRVSWZIODQU-ZETCQYMHSA-N	-1	3	336.391	1.442	20	5		EDBDHM
Cc1cc(C(=O)NCC(=O)Nc2ncccc2[O-])ccc1[N+](=O)[O-]	ZINC000344194235	444833476	/nfs/dbraw/zinc/83/34/76/444833476.db2.gz	JYPOPJGLGZXLNR-UHFFFAOYSA-N	-1	3	330.300	1.372	20	5		EDBDHM
C[C@@H]1CCC[C@]1(O)C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000336886079	444833547	/nfs/dbraw/zinc/83/35/47/444833547.db2.gz	BLEDADXQEOJDCB-RISCZKNCSA-N	-1	3	328.390	1.565	20	5		EDBDHM
CC(C)c1nc([C@@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)n[nH]1	ZINC000342794415	444870123	/nfs/dbraw/zinc/87/01/23/444870123.db2.gz	VCHVQNBCEVMMKY-SSDOTTSWSA-N	-1	3	345.406	1.937	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](C)c2cnn(C)c2)c1[N+](=O)[O-]	ZINC000360253634	445658486	/nfs/dbraw/zinc/65/84/86/445658486.db2.gz	ZTGSURIETWMPDJ-NSHDSACASA-N	-1	3	338.389	1.985	20	5		EDBDHM
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])[C@H]1OC	ZINC000356221595	445684220	/nfs/dbraw/zinc/68/42/20/445684220.db2.gz	OWZUUPWHYYYFOQ-MPKXVKKWSA-N	-1	3	344.389	1.374	20	5		EDBDHM
CCN1CC[C@H]([N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C1	ZINC000360764194	445732165	/nfs/dbraw/zinc/73/21/65/445732165.db2.gz	CNQMIOGFWFXACI-LBPRGKRZSA-N	-1	3	327.406	1.584	20	5		EDBDHM
O=C(Nc1ccc2c(c1)CCC(=O)N2)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000361984128	446129124	/nfs/dbraw/zinc/12/91/24/446129124.db2.gz	SDDHFQDYYLYGME-UHFFFAOYSA-N	-1	3	328.284	1.832	20	5		EDBDHM
CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ncccc1[O-]	ZINC000354364041	446146588	/nfs/dbraw/zinc/14/65/88/446146588.db2.gz	AHEBFDBHHXKHQZ-UHFFFAOYSA-N	-1	3	344.327	1.513	20	5		EDBDHM
O=[N+]([O-])c1ccc(CS(=O)(=O)[N-][C@@H]2CNCCC2(F)F)cc1	ZINC000420446058	446623390	/nfs/dbraw/zinc/62/33/90/446623390.db2.gz	OCTHHJQUMCVTRZ-LLVKDONJSA-N	-1	3	335.332	1.011	20	5		EDBDHM
Cc1cc(C(=O)NCc2cnc3n2CCCC3)c([N+](=O)[O-])c(=O)[n-]1	ZINC000377142954	446946833	/nfs/dbraw/zinc/94/68/33/446946833.db2.gz	WJPOMYVEEHHMGO-UHFFFAOYSA-N	-1	3	331.332	1.467	20	5		EDBDHM
CC[C@H](C)CNC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000421922471	447279383	/nfs/dbraw/zinc/27/93/83/447279383.db2.gz	UJKZXSIDRUGQPA-JTQLQIEISA-N	-1	3	329.378	1.035	20	5		EDBDHM
CCc1n[nH]c([N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(OC)c2)n1	ZINC000451024585	447655008	/nfs/dbraw/zinc/65/50/08/447655008.db2.gz	ILYNBLMOCFMBHI-UHFFFAOYSA-N	-1	3	327.322	1.085	20	5		EDBDHM
CCN1C[C@H]([N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])CC1=O	ZINC000451871028	447769997	/nfs/dbraw/zinc/76/99/97/447769997.db2.gz	QNQCJWAPEJFULB-LLVKDONJSA-N	-1	3	341.389	1.111	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CCC2(CO)CC2)cc1[N+](=O)[O-]	ZINC000451939960	447793081	/nfs/dbraw/zinc/79/30/81/447793081.db2.gz	RXJHKWNVIWKDJZ-UHFFFAOYSA-N	-1	3	348.352	1.183	20	5		EDBDHM
COc1ccc(CNC(=O)NCc2ncccc2[O-])cc1[N+](=O)[O-]	ZINC000471687366	447809662	/nfs/dbraw/zinc/80/96/62/447809662.db2.gz	XFHFMJNLIJKTME-UHFFFAOYSA-N	-1	3	332.316	1.703	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-])CN1CCCC1	ZINC000525699983	448013539	/nfs/dbraw/zinc/01/35/39/448013539.db2.gz	GWNNWVINZGEADT-NSHDSACASA-N	-1	3	328.394	1.000	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-])N1CCC[C@H](C)C1	ZINC000525086518	447967178	/nfs/dbraw/zinc/96/71/78/447967178.db2.gz	AIFIHLVLJVJYNO-RYUDHWBXSA-N	-1	3	342.421	1.389	20	5		EDBDHM
COC(=O)CCc1csc([N-]C(=O)c2c[nH]nc2[N+](=O)[O-])n1	ZINC000514660405	448180799	/nfs/dbraw/zinc/18/07/99/448180799.db2.gz	IMORHYUZNQCVFK-UHFFFAOYSA-N	-1	3	325.306	1.132	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]c2ccc[nH]c2=O)c([N+](=O)[O-])c1	ZINC000582864698	448363959	/nfs/dbraw/zinc/36/39/59/448363959.db2.gz	XMSUTZMJTNIVQJ-UHFFFAOYSA-N	-1	3	325.302	1.505	20	5		EDBDHM
COC(=O)CC1([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])CC1	ZINC000573450473	448631704	/nfs/dbraw/zinc/63/17/04/448631704.db2.gz	SRLOBFJBMNYWAT-UHFFFAOYSA-N	-1	3	328.346	1.277	20	5		EDBDHM
CC(C)c1nc([C@@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)n[nH]1	ZINC000593569707	449078627	/nfs/dbraw/zinc/07/86/27/449078627.db2.gz	OJMQYXJOSAIEPY-MRVPVSSYSA-N	-1	3	340.365	1.271	20	5		EDBDHM
Cc1c(Cl)cc(S(=O)(=O)[N-][C@H](CO)CCF)cc1[N+](=O)[O-]	ZINC000593655851	449133137	/nfs/dbraw/zinc/13/31/37/449133137.db2.gz	CZSFHOWTOUNWCL-QMMMGPOBSA-N	-1	3	340.760	1.555	20	5		EDBDHM
CC[C@H](NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C1CC1	ZINC000598235024	449302873	/nfs/dbraw/zinc/30/28/73/449302873.db2.gz	VRBWLARKWOMTHN-NSHDSACASA-N	-1	3	341.389	1.178	20	5		EDBDHM
COC(=O)c1c(C)nc(=O)[n-]c1SCc1onc(C)c1[N+](=O)[O-]	ZINC000596027960	449325144	/nfs/dbraw/zinc/32/51/44/449325144.db2.gz	ZYBSHCHIOVWWNB-UHFFFAOYSA-N	-1	3	340.317	1.774	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1CCC[C@@H]1CO	ZINC000590764732	449284955	/nfs/dbraw/zinc/28/49/55/449284955.db2.gz	WVFLDSNIBDYWCV-NXEZZACHSA-N	-1	3	330.362	1.043	20	5		EDBDHM
CC(C)[C@H]1OCCC[C@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593558747	449348787	/nfs/dbraw/zinc/34/87/87/449348787.db2.gz	JZDFXRYOLVIEJK-SMDDNHRTSA-N	-1	3	343.405	1.719	20	5		EDBDHM
O=c1[n-]ccc(NCc2ccnc(N3CCOCC3)c2)c1[N+](=O)[O-]	ZINC000596074782	449349275	/nfs/dbraw/zinc/34/92/75/449349275.db2.gz	FGVBLIWDJUWTJF-UHFFFAOYSA-N	-1	3	331.332	1.539	20	5		EDBDHM
C[C@@H](Cc1ccsc1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593534439	449331377	/nfs/dbraw/zinc/33/13/77/449331377.db2.gz	NIIKIWJGJYSQBR-VIFPVBQESA-N	-1	3	327.387	1.961	20	5		EDBDHM
CC(C)(C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])N1CCCCC1	ZINC000594744872	449662116	/nfs/dbraw/zinc/66/21/16/449662116.db2.gz	CNEJWZZRJKYXCM-UHFFFAOYSA-N	-1	3	342.421	1.533	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1COC(C)(C)C1	ZINC000594789551	449698989	/nfs/dbraw/zinc/69/89/89/449698989.db2.gz	NCWFNCATYFOPLO-SECBINFHSA-N	-1	3	330.362	1.449	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CO)C2CCC2)c1C	ZINC000594800421	449711728	/nfs/dbraw/zinc/71/17/28/449711728.db2.gz	FQGSOIRJKJEYKC-GFCCVEGCSA-N	-1	3	328.390	1.651	20	5		EDBDHM
O=C(c1cc(=O)[n-]cn1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000599071498	449718045	/nfs/dbraw/zinc/71/80/45/449718045.db2.gz	XMCPZUCTQMQRNX-UHFFFAOYSA-N	-1	3	329.316	1.053	20	5		EDBDHM
CC[C@@H](O)C[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594786009	449694947	/nfs/dbraw/zinc/69/49/47/449694947.db2.gz	XGDCHOSPDOOSEV-SECBINFHSA-N	-1	3	325.346	1.192	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C1CC1	ZINC000594858892	449768470	/nfs/dbraw/zinc/76/84/70/449768470.db2.gz	ZKZALCRDSKQYNQ-JTQLQIEISA-N	-1	3	342.373	1.833	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCCOC(F)F)c(F)cc1[N+](=O)[O-]	ZINC000601412393	449928370	/nfs/dbraw/zinc/92/83/70/449928370.db2.gz	PHJRUNHNYFQRRC-UHFFFAOYSA-N	-1	3	342.295	1.950	20	5		EDBDHM
COc1cc(C[N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)on1	ZINC000595345884	450058358	/nfs/dbraw/zinc/05/83/58/450058358.db2.gz	QGMWGRZHMVFOKC-UHFFFAOYSA-N	-1	3	341.345	1.687	20	5		EDBDHM
CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000597696761	450203876	/nfs/dbraw/zinc/20/38/76/450203876.db2.gz	YHUYZVUAPVELPS-HUUCEWRRSA-N	-1	3	335.360	1.236	20	5		EDBDHM
O=C(Nc1ccc2c(c1)C(=O)NCC2)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000618374711	450183034	/nfs/dbraw/zinc/18/30/34/450183034.db2.gz	RZRIFUPYOQLLGX-UHFFFAOYSA-N	-1	3	328.284	1.234	20	5		EDBDHM
C/C=C/C[C@@H](CO)[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000619497306	450492668	/nfs/dbraw/zinc/49/26/68/450492668.db2.gz	FUSKIKYJYFESPD-FSIBCCDJSA-N	-1	3	330.362	1.209	20	5		EDBDHM
C[C@@H]1CCN(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000524790149	486871919	/nfs/dbraw/zinc/87/19/19/486871919.db2.gz	HYYOXUKOTLINBI-SNVBAGLBSA-N	-1	3	347.824	1.868	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)C1(CO)CC1	ZINC000594825828	486637157	/nfs/dbraw/zinc/63/71/57/486637157.db2.gz	CGCOSMRTWXXQRW-VIFPVBQESA-N	-1	3	330.362	1.043	20	5		EDBDHM
Cn1c(Cl)cnc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000728933539	578554627	/nfs/dbraw/zinc/55/46/27/578554627.db2.gz	PIFAMKNIZFSPMW-UHFFFAOYSA-N	-1	3	336.782	1.522	20	5		EDBDHM
Cc1c(NC(=O)CCN2CC[C@H](NC(=O)[O-])C2)cccc1[N+](=O)[O-]	ZINC000740048446	579283877	/nfs/dbraw/zinc/28/38/77/579283877.db2.gz	HKGAIJUZGZXRTK-NSHDSACASA-N	-1	3	336.348	1.574	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](O)c2ccco2)cc1C	ZINC000751204527	579797085	/nfs/dbraw/zinc/79/70/85/579797085.db2.gz	FTSVVRHMHNVJOK-LBPRGKRZSA-N	-1	3	340.357	1.817	20	5		EDBDHM
C[C@H](Sc1n[n-]c(CO)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000767083550	580181228	/nfs/dbraw/zinc/18/12/28/580181228.db2.gz	QCMVDUKHTCVTMZ-LURJTMIESA-N	-1	3	341.324	1.464	20	5		EDBDHM
CCCOC(=O)CC[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000767803799	580200214	/nfs/dbraw/zinc/20/02/14/580200214.db2.gz	FVKIAXPNKOKFEP-UHFFFAOYSA-N	-1	3	336.391	1.586	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@H](CO)c2ccccc2)cs1	ZINC000768855280	580222568	/nfs/dbraw/zinc/22/25/68/580222568.db2.gz	YIKZCLZMENBVPO-LLVKDONJSA-N	-1	3	342.398	1.711	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]CCCCC(N)=O)cc1[N+](=O)[O-]	ZINC000775579469	580394264	/nfs/dbraw/zinc/39/42/64/580394264.db2.gz	UMFXNMHFIPESGI-UHFFFAOYSA-N	-1	3	349.796	1.491	20	5		EDBDHM
Nc1ccc([N+](=O)[O-])cc1C(=O)NCc1nnc(C(F)(F)F)[n-]1	ZINC000787299101	580692208	/nfs/dbraw/zinc/69/22/08/580692208.db2.gz	FEHSIKWNOIFDJU-UHFFFAOYSA-N	-1	3	330.226	1.244	20	5		EDBDHM
Nc1ccc([N+](=O)[O-])cc1C(=O)NCc1n[n-]c(C(F)(F)F)n1	ZINC000787299101	580692209	/nfs/dbraw/zinc/69/22/09/580692209.db2.gz	FEHSIKWNOIFDJU-UHFFFAOYSA-N	-1	3	330.226	1.244	20	5		EDBDHM
Nc1ccc([N+](=O)[O-])cc1C(=O)NCc1nc(C(F)(F)F)n[n-]1	ZINC000787299101	580692210	/nfs/dbraw/zinc/69/22/10/580692210.db2.gz	FEHSIKWNOIFDJU-UHFFFAOYSA-N	-1	3	330.226	1.244	20	5		EDBDHM
Cc1n[n-]nc1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000791044573	580783426	/nfs/dbraw/zinc/78/34/26/580783426.db2.gz	MBWCLIHMHBPTLR-UHFFFAOYSA-N	-1	3	339.695	1.470	20	5		EDBDHM
CC[C@@H]1C(=O)N(CC)CCN1Cc1ccc([O-])c(OC)c1[N+](=O)[O-]	ZINC000893719975	591063803	/nfs/dbraw/zinc/06/38/03/591063803.db2.gz	UAROWQVOFIKMDB-GFCCVEGCSA-N	-1	3	337.376	1.752	20	5		EDBDHM
O=C(OCCn1cc([N+](=O)[O-])cn1)c1nn[n-]c1-c1ccccc1	ZINC000805551048	593466183	/nfs/dbraw/zinc/46/61/83/593466183.db2.gz	CZAWEGCQFDMMMP-UHFFFAOYSA-N	-1	3	328.288	1.433	20	5		EDBDHM
O=C(OCCn1cc([N+](=O)[O-])cn1)c1[n-]nnc1-c1ccccc1	ZINC000805551048	593466184	/nfs/dbraw/zinc/46/61/84/593466184.db2.gz	CZAWEGCQFDMMMP-UHFFFAOYSA-N	-1	3	328.288	1.433	20	5		EDBDHM
O=C(OCCn1cc([N+](=O)[O-])cn1)c1n[n-]nc1-c1ccccc1	ZINC000805551048	593466185	/nfs/dbraw/zinc/46/61/85/593466185.db2.gz	CZAWEGCQFDMMMP-UHFFFAOYSA-N	-1	3	328.288	1.433	20	5		EDBDHM
CCn1nc(C)c(C[N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)n1	ZINC000819887730	593774032	/nfs/dbraw/zinc/77/40/32/593774032.db2.gz	ONJDLJUOGRWMCU-UHFFFAOYSA-N	-1	3	339.377	1.134	20	5		EDBDHM
COc1ccc(NC(=O)c2cc(-c3nnn[n-]3)cn2C)c([N+](=O)[O-])c1	ZINC000821835809	593950873	/nfs/dbraw/zinc/95/08/73/593950873.db2.gz	RZAGTUVQYVVGTQ-UHFFFAOYSA-N	-1	3	343.303	1.374	20	5		EDBDHM
COc1ccc(NC(=O)c2cc(-c3nn[n-]n3)cn2C)c([N+](=O)[O-])c1	ZINC000821835809	593950874	/nfs/dbraw/zinc/95/08/74/593950874.db2.gz	RZAGTUVQYVVGTQ-UHFFFAOYSA-N	-1	3	343.303	1.374	20	5		EDBDHM
CC(C)COC[C@H](O)COc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-]	ZINC000824270387	593973253	/nfs/dbraw/zinc/97/32/53/593973253.db2.gz	DURWREKTTVDEIH-JTQLQIEISA-N	-1	3	337.336	1.187	20	5		EDBDHM
CC(C)COC[C@H](O)COc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-]	ZINC000824270387	593973255	/nfs/dbraw/zinc/97/32/55/593973255.db2.gz	DURWREKTTVDEIH-JTQLQIEISA-N	-1	3	337.336	1.187	20	5		EDBDHM
Cc1cccc([C@@H](O)CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)c1	ZINC000822288797	594024782	/nfs/dbraw/zinc/02/47/82/594024782.db2.gz	JPSOBDWHVARARG-ZDUSSCGKSA-N	-1	3	341.331	1.624	20	5		EDBDHM
Cc1cccc([C@@H](O)CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)c1	ZINC000822288797	594024783	/nfs/dbraw/zinc/02/47/83/594024783.db2.gz	JPSOBDWHVARARG-ZDUSSCGKSA-N	-1	3	341.331	1.624	20	5		EDBDHM
C[C@@H]1OCC[C@@H]1Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000825019934	594117211	/nfs/dbraw/zinc/11/72/11/594117211.db2.gz	HJMMNTDDYWNZGS-UFBFGSQYSA-N	-1	3	341.331	1.912	20	5		EDBDHM
C[C@@H]1OCC[C@@H]1Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000825019934	594117212	/nfs/dbraw/zinc/11/72/12/594117212.db2.gz	HJMMNTDDYWNZGS-UFBFGSQYSA-N	-1	3	341.331	1.912	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCNc2ncccc2-c2nnn[n-]2)s1	ZINC000823640155	594223973	/nfs/dbraw/zinc/22/39/73/594223973.db2.gz	VLTMLTDBKDZERV-UHFFFAOYSA-N	-1	3	332.349	1.755	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCNc2ncccc2-c2nn[n-]n2)s1	ZINC000823640155	594223974	/nfs/dbraw/zinc/22/39/74/594223974.db2.gz	VLTMLTDBKDZERV-UHFFFAOYSA-N	-1	3	332.349	1.755	20	5		EDBDHM
CN(C[C@H]1CCCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825909375	594276112	/nfs/dbraw/zinc/27/61/12/594276112.db2.gz	XFANNEYEKULLLP-YGRLFVJLSA-N	-1	3	332.364	1.762	20	5		EDBDHM
CN(C[C@H]1CCCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825909375	594276114	/nfs/dbraw/zinc/27/61/14/594276114.db2.gz	XFANNEYEKULLLP-YGRLFVJLSA-N	-1	3	332.364	1.762	20	5		EDBDHM
CN1CCc2ccc(Nc3ncc([N+](=O)[O-])cc3-c3nnn[n-]3)cc21	ZINC000826045060	594315808	/nfs/dbraw/zinc/31/58/08/594315808.db2.gz	ODQYVFNXJMWTEI-UHFFFAOYSA-N	-1	3	338.331	1.906	20	5		EDBDHM
CN1CCc2ccc(Nc3ncc([N+](=O)[O-])cc3-c3nn[n-]n3)cc21	ZINC000826045060	594315810	/nfs/dbraw/zinc/31/58/10/594315810.db2.gz	ODQYVFNXJMWTEI-UHFFFAOYSA-N	-1	3	338.331	1.906	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(Cc2cccc(-c3nnn[n-]3)c2F)c1=O	ZINC000826272416	594406405	/nfs/dbraw/zinc/40/64/05/594406405.db2.gz	ILZLPOGRWBFFSN-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(Cc2cccc(-c3nn[n-]n3)c2F)c1=O	ZINC000826272416	594406407	/nfs/dbraw/zinc/40/64/07/594406407.db2.gz	ILZLPOGRWBFFSN-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cn1ccnc1[C@H]1CCN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000826364190	594445777	/nfs/dbraw/zinc/44/57/77/594445777.db2.gz	NLLBNGGHJYWMEV-NSHDSACASA-N	-1	3	340.347	1.502	20	5		EDBDHM
Cn1ccnc1[C@H]1CCN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1	ZINC000826364190	594445778	/nfs/dbraw/zinc/44/57/78/594445778.db2.gz	NLLBNGGHJYWMEV-NSHDSACASA-N	-1	3	340.347	1.502	20	5		EDBDHM
NC(=O)C[C@H]1CCCCN1c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000826390964	594456604	/nfs/dbraw/zinc/45/66/04/594456604.db2.gz	SDNGDTSNGLWOAB-SECBINFHSA-N	-1	3	331.336	1.009	20	5		EDBDHM
NC(=O)C[C@H]1CCCCN1c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000826390964	594456605	/nfs/dbraw/zinc/45/66/05/594456605.db2.gz	SDNGDTSNGLWOAB-SECBINFHSA-N	-1	3	331.336	1.009	20	5		EDBDHM
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)c1ccc(-c2nnn[n-]2)[nH]1	ZINC000826440281	594478467	/nfs/dbraw/zinc/47/84/67/594478467.db2.gz	HASTZHNIVGDXGF-UHFFFAOYSA-N	-1	3	347.722	1.686	20	5		EDBDHM
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)c1ccc(-c2nn[n-]n2)[nH]1	ZINC000826440281	594478468	/nfs/dbraw/zinc/47/84/68/594478468.db2.gz	HASTZHNIVGDXGF-UHFFFAOYSA-N	-1	3	347.722	1.686	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1OC[C@@H](O)c1ccccc1	ZINC000826497293	594502128	/nfs/dbraw/zinc/50/21/28/594502128.db2.gz	BNLDYRHITWMZNU-CYBMUJFWSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1OC[C@@H](O)c1ccccc1	ZINC000826497293	594502129	/nfs/dbraw/zinc/50/21/29/594502129.db2.gz	BNLDYRHITWMZNU-CYBMUJFWSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC([C@H]3CCOC3)CC2)c(-c2nnn[n-]2)c1	ZINC000826500500	594503413	/nfs/dbraw/zinc/50/34/13/594503413.db2.gz	ABFCXWPPVNAATF-NSHDSACASA-N	-1	3	345.363	1.423	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC([C@H]3CCOC3)CC2)c(-c2nn[n-]n2)c1	ZINC000826500500	594503415	/nfs/dbraw/zinc/50/34/15/594503415.db2.gz	ABFCXWPPVNAATF-NSHDSACASA-N	-1	3	345.363	1.423	20	5		EDBDHM
CC1=C(C(=O)[O-])C[C@@H](CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)O1	ZINC000833585187	594880369	/nfs/dbraw/zinc/88/03/69/594880369.db2.gz	QPCUDPHFZNSTHY-YPMHNXCESA-N	-1	3	348.359	1.624	20	5		EDBDHM
CN1CCC[C@H]([N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000848581005	595408249	/nfs/dbraw/zinc/40/82/49/595408249.db2.gz	IXESFIZKPMQULI-JTQLQIEISA-N	-1	3	329.303	1.777	20	5		EDBDHM
CN1CC[C@H]([N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)CC1=O	ZINC000848592119	595411882	/nfs/dbraw/zinc/41/18/82/595411882.db2.gz	XFWHWEXDGGDQED-VIFPVBQESA-N	-1	3	343.286	1.303	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-][C@@H](CO)C1CC1	ZINC000849377356	595516389	/nfs/dbraw/zinc/51/63/89/595516389.db2.gz	CGEKWSHCCJCHPZ-LBPRGKRZSA-N	-1	3	337.357	1.192	20	5		EDBDHM
CS(=O)(=O)c1ccc(C(=O)[N-]OCC2CCC2)c([N+](=O)[O-])c1	ZINC000856345428	595960495	/nfs/dbraw/zinc/96/04/95/595960495.db2.gz	YELHRBXXVKGEGG-UHFFFAOYSA-N	-1	3	328.346	1.460	20	5		EDBDHM
CC(C)(CO)O[N-]C(=O)c1cc([N+](=O)[O-])ncc1Br	ZINC000857284433	596205111	/nfs/dbraw/zinc/20/51/11/596205111.db2.gz	LDWOKPNCSUJFIB-UHFFFAOYSA-N	-1	3	334.126	1.185	20	5		EDBDHM
C[C@@]1(C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CCCC[C@@H]1O	ZINC000119924217	596796584	/nfs/dbraw/zinc/79/65/84/596796584.db2.gz	XVLXEFDNZIEOGU-JQWIXIFHSA-N	-1	3	334.419	1.876	20	5		EDBDHM
C[C@]1(C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CCCC[C@H]1O	ZINC000119924363	596796912	/nfs/dbraw/zinc/79/69/12/596796912.db2.gz	XVLXEFDNZIEOGU-ZYHUDNBSSA-N	-1	3	334.419	1.876	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-])N(C)C1CC1	ZINC000170787958	697338967	/nfs/dbraw/zinc/33/89/67/697338967.db2.gz	CVMPAVSISZYIJE-VIFPVBQESA-N	-1	3	331.369	1.495	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2CCO[C@H]2C2CC2)c([N+](=O)[O-])s1	ZINC000921311905	697554645	/nfs/dbraw/zinc/55/46/45/697554645.db2.gz	HUVIGFJAHDYYSA-KOLCDFICSA-N	-1	3	332.403	1.811	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])N1CCCCC1	ZINC000184203856	235332153	/nfs/dbraw/zinc/33/21/53/235332153.db2.gz	PZGHOMLYRZTDSN-UHFFFAOYSA-N	-1	3	341.389	1.027	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@H](C)N(C)C2CC2)cc1[N+](=O)[O-]	ZINC000123606783	138319721	/nfs/dbraw/zinc/31/97/21/138319721.db2.gz	ZUDTZAYRUWKAOZ-QMMMGPOBSA-N	-1	3	333.435	1.726	20	5		EDBDHM
CCC[C@@H](C)[C@H](CO)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000566624517	306422448	/nfs/dbraw/zinc/42/24/48/306422448.db2.gz	ATLMWFCRBBKNHB-NEPJUHHUSA-N	-1	3	330.406	1.979	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C1CCOCC1	ZINC000132971076	205351266	/nfs/dbraw/zinc/35/12/66/205351266.db2.gz	WMDLFWJLVCMJFI-VIFPVBQESA-N	-1	3	332.353	1.827	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCO1	ZINC000157779383	206156380	/nfs/dbraw/zinc/15/63/80/206156380.db2.gz	YYFLJWWXMOGTPY-NEPJUHHUSA-N	-1	3	332.353	1.970	20	5		EDBDHM
Cc1ccc(-c2nnc(NC(=O)CCn3cc([N+](=O)[O-])nc3C)[n-]2)o1	ZINC000160301249	206290303	/nfs/dbraw/zinc/29/03/03/206290303.db2.gz	XPGKICUMJZYWNF-UHFFFAOYSA-N	-1	3	345.319	1.815	20	5		EDBDHM
Cc1ccc(-c2n[n-]c(NC(=O)CCn3cc([N+](=O)[O-])nc3C)n2)o1	ZINC000160301249	206290308	/nfs/dbraw/zinc/29/03/08/206290308.db2.gz	XPGKICUMJZYWNF-UHFFFAOYSA-N	-1	3	345.319	1.815	20	5		EDBDHM
Cc1ccc(-c2nc(NC(=O)CCn3cc([N+](=O)[O-])nc3C)n[n-]2)o1	ZINC000160301249	206290311	/nfs/dbraw/zinc/29/03/11/206290311.db2.gz	XPGKICUMJZYWNF-UHFFFAOYSA-N	-1	3	345.319	1.815	20	5		EDBDHM
O=C1[N-]C(=O)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C[C@H]12	ZINC000351883705	296357199	/nfs/dbraw/zinc/35/71/99/296357199.db2.gz	ZIIYKDKNXMEIMX-SNVBAGLBSA-N	-1	3	344.249	1.354	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCC[C@@H](C)CO)cc1C	ZINC000270245915	140066593	/nfs/dbraw/zinc/06/65/93/140066593.db2.gz	MHPYGSKVMWNLQW-SNVBAGLBSA-N	-1	3	330.406	1.899	20	5		EDBDHM
CN1CCC[C@@H]1C[N-]S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000271800541	140352211	/nfs/dbraw/zinc/35/22/11/140352211.db2.gz	WLQHAXYVCZOQSO-SNVBAGLBSA-N	-1	3	333.797	1.621	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CN(C2CC2)C[C@H]1C	ZINC000331586709	141052498	/nfs/dbraw/zinc/05/24/98/141052498.db2.gz	XFRBLNQDWAQRCE-YPMHNXCESA-N	-1	3	339.417	1.664	20	5		EDBDHM
C[C@@H]1CN(Cc2cc([O-])ccc2[N+](=O)[O-])CC[C@H]1N1CCN(C)CC1	ZINC000332403329	141176252	/nfs/dbraw/zinc/17/62/52/141176252.db2.gz	VLWBSEWFFXEBHL-RHSMWYFYSA-N	-1	3	348.447	1.758	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCCCC[C@H]2O)cc1[N+](=O)[O-]	ZINC000344944851	143029561	/nfs/dbraw/zinc/02/95/61/143029561.db2.gz	DJEJIRLZWVHCEM-MWLCHTKSSA-N	-1	3	334.419	1.937	20	5		EDBDHM
CNC(=O)[C@H]1CCC[C@@H]1[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000345513832	143100593	/nfs/dbraw/zinc/10/05/93/143100593.db2.gz	DPWMJFJJIBPLFQ-QWRGUYRKSA-N	-1	3	341.389	1.096	20	5		EDBDHM
COC1CCC([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000416548467	304330631	/nfs/dbraw/zinc/33/06/31/304330631.db2.gz	WZPQKPZYTFFMOP-UHFFFAOYSA-N	-1	3	332.353	1.970	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C2(CN(C)C)CCC2)c([N+](=O)[O-])c1	ZINC000355317473	292180837	/nfs/dbraw/zinc/18/08/37/292180837.db2.gz	CPQUOJGOXQODJU-UHFFFAOYSA-N	-1	3	327.406	1.666	20	5		EDBDHM
O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCc2nc[n-]c(=O)c2C1	ZINC000355234741	150176615	/nfs/dbraw/zinc/17/66/15/150176615.db2.gz	VBCCNGXVWZCBAE-UHFFFAOYSA-N	-1	3	339.311	1.770	20	5		EDBDHM
CCS(=O)(=O)[N-]Cc1nc(Cc2ccccc2[N+](=O)[O-])no1	ZINC000355685745	150359950	/nfs/dbraw/zinc/35/99/50/150359950.db2.gz	DADSLBBFFJECCF-UHFFFAOYSA-N	-1	3	326.334	1.008	20	5		EDBDHM
Cc1c(CNC(=O)CNC(=O)c2cccc([O-])c2)cccc1[N+](=O)[O-]	ZINC000360525724	152080827	/nfs/dbraw/zinc/08/08/27/152080827.db2.gz	BVCUETGWBBUZPE-UHFFFAOYSA-N	-1	3	343.339	1.655	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCOC(F)(F)F)c([N+](=O)[O-])c1	ZINC000353814639	286351109	/nfs/dbraw/zinc/35/11/09/286351109.db2.gz	LNOHRQKVFYZGNT-UHFFFAOYSA-N	-1	3	344.267	1.418	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H](CO)C2CC2)c1[N+](=O)[O-]	ZINC000352559297	162254359	/nfs/dbraw/zinc/25/43/59/162254359.db2.gz	HFNUPSBVRFZGGO-GFCCVEGCSA-N	-1	3	328.390	1.508	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CC1(O)CCCCCC1	ZINC000123456040	222281361	/nfs/dbraw/zinc/28/13/61/222281361.db2.gz	WYHXEAWAOGPXSM-UHFFFAOYSA-N	-1	3	328.390	1.958	20	5		EDBDHM
CC(C)N1CC[C@@H]([N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C1=O	ZINC000153870805	287633898	/nfs/dbraw/zinc/63/38/98/287633898.db2.gz	QMSYRWPZVHYJLN-CYBMUJFWSA-N	-1	3	341.389	1.024	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCOC(C)C	ZINC000276343116	273161488	/nfs/dbraw/zinc/16/14/88/273161488.db2.gz	KEPKFHKIETZUPK-UHFFFAOYSA-N	-1	3	346.361	1.085	20	5		EDBDHM
CC[C@@H](C)c1nc([C@H](C)NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)n[nH]1	ZINC000278047845	273243657	/nfs/dbraw/zinc/24/36/57/273243657.db2.gz	ZVQFQUNZWHQCLU-SFYZADRCSA-N	-1	3	334.336	1.818	20	5		EDBDHM
CCC(C)(C)NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000281076986	273432999	/nfs/dbraw/zinc/43/29/99/273432999.db2.gz	CCKVQVAAKCCRMB-UHFFFAOYSA-N	-1	3	329.378	1.178	20	5		EDBDHM
COCC1([N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])CCC1	ZINC000283797156	273966651	/nfs/dbraw/zinc/96/66/51/273966651.db2.gz	BBASWYBJVVIIIF-UHFFFAOYSA-N	-1	3	330.362	1.451	20	5		EDBDHM
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[n-]c1=O)N(C)Cc1ccccc1	ZINC000111631033	274223688	/nfs/dbraw/zinc/22/36/88/274223688.db2.gz	BIHOBMKEYKIHRD-LBPRGKRZSA-N	-1	3	344.371	1.946	20	5		EDBDHM
CC[C@H](C[C@H](C)CO)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000443327875	287912813	/nfs/dbraw/zinc/91/28/13/287912813.db2.gz	OGCSMIILNSKTEL-CMPLNLGQSA-N	-1	3	330.406	1.979	20	5		EDBDHM
CC(C)(C(=O)N1CCc2nc[n-]c(=O)c2C1)c1ccc([N+](=O)[O-])cc1	ZINC000269646001	278269008	/nfs/dbraw/zinc/26/90/08/278269008.db2.gz	AKRUXMFZXGJNNX-UHFFFAOYSA-N	-1	3	342.355	1.953	20	5		EDBDHM
O=C(c1cccc([O-])c1)N1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000060355972	280209133	/nfs/dbraw/zinc/20/91/33/280209133.db2.gz	WXFBJZPLOSLFSP-UHFFFAOYSA-N	-1	3	328.328	1.658	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)Cn1ccnc1	ZINC000298491804	303528780	/nfs/dbraw/zinc/52/87/80/303528780.db2.gz	JHAAAFRENYKQNT-JTQLQIEISA-N	-1	3	340.361	1.167	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCC2CC(O)C2)c(Cl)c1	ZINC000432293259	305090541	/nfs/dbraw/zinc/09/05/41/305090541.db2.gz	FRLDEJBCFOPPTP-UHFFFAOYSA-N	-1	3	334.781	1.688	20	5		EDBDHM
CSC1(CNC(=O)c2cccc([N+](=O)[O-])c2[O-])CCN(C)CC1	ZINC000436593948	305161695	/nfs/dbraw/zinc/16/16/95/305161695.db2.gz	CSJJDZORGMAOOC-UHFFFAOYSA-N	-1	3	339.417	1.858	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC2([S@](C)=O)CC2)c([N+](=O)[O-])c1	ZINC000443087138	305235122	/nfs/dbraw/zinc/23/51/22/305235122.db2.gz	IUILJDGSXBMSNG-FQEVSTJZSA-N	-1	3	332.403	1.093	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCC[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000452024122	305379442	/nfs/dbraw/zinc/37/94/42/305379442.db2.gz	XMDAPLQOFNJRQC-NSHDSACASA-N	-1	3	344.389	1.698	20	5		EDBDHM
Cc1nnc([C@H](C)[N-]c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])o1	ZINC000541189259	306044511	/nfs/dbraw/zinc/04/45/11/306044511.db2.gz	KHURPTMWGYIOCK-YFKPBYRVSA-N	-1	3	332.363	1.924	20	5		EDBDHM
Cc1c(C(=O)N2CCC[C@@H]2c2nc(=N)n(C)[n-]2)cccc1[N+](=O)[O-]	ZINC000550114993	306150853	/nfs/dbraw/zinc/15/08/53/306150853.db2.gz	JDQVWCLHQIOIAJ-GFCCVEGCSA-N	-1	3	330.348	1.422	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1ccc(C)nc1	ZINC000047542393	441203299	/nfs/dbraw/zinc/20/32/99/441203299.db2.gz	IIHLFNASGULSDW-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
Cc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c([O-])c1	ZINC000031370722	441523622	/nfs/dbraw/zinc/52/36/22/441523622.db2.gz	KGEMEYIDWLCCAA-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
Cn1cc(S(=O)(=O)[N-]CCc2ccc([N+](=O)[O-])cc2)nc1Cl	ZINC000123727529	441897876	/nfs/dbraw/zinc/89/78/76/441897876.db2.gz	VRVYGFZRKSXDJX-UHFFFAOYSA-N	-1	3	344.780	1.503	20	5		EDBDHM
CC[C@H](C)[C@H](O)C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000119358774	441930745	/nfs/dbraw/zinc/93/07/45/441930745.db2.gz	VBXJVJYZLJHFGE-TVQRCGJNSA-N	-1	3	330.406	1.897	20	5		EDBDHM
C[C@H](O)C[C@H](C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000120766063	442129371	/nfs/dbraw/zinc/12/93/71/442129371.db2.gz	OCGHLJROTOKYHX-IUCAKERBSA-N	-1	3	336.797	1.934	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CC[C@H](CO)CC1	ZINC000152271043	442190887	/nfs/dbraw/zinc/19/08/87/442190887.db2.gz	LMLJRDCUUCQECW-TXEJJXNPSA-N	-1	3	328.390	1.733	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2nc(-c3nccn3C)cs2)n1	ZINC000191677849	442488297	/nfs/dbraw/zinc/48/82/97/442488297.db2.gz	BKPCJHPLGZGEKP-UHFFFAOYSA-N	-1	3	347.360	1.921	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C2(CO)CCC2)c1	ZINC000186259315	442498570	/nfs/dbraw/zinc/49/85/70/442498570.db2.gz	AMMLSEKTUSOHGY-UHFFFAOYSA-N	-1	3	334.781	1.750	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]Cc1ncccc1F	ZINC000156695975	442510704	/nfs/dbraw/zinc/51/07/04/442510704.db2.gz	WMJWUMIZXKFSAR-UHFFFAOYSA-N	-1	3	325.321	1.916	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCN(C)C(=O)C2)c1C	ZINC000192858985	442692865	/nfs/dbraw/zinc/69/28/65/442692865.db2.gz	XVPWYCYTPVFKRJ-LLVKDONJSA-N	-1	3	341.389	1.111	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCC[C@@H]1CCO	ZINC000188915912	442842121	/nfs/dbraw/zinc/84/21/21/442842121.db2.gz	SZCIXYDHKVLZGL-VXGBXAGGSA-N	-1	3	328.390	1.733	20	5		EDBDHM
CC[C@H](C)[C@@H](O)C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000189999497	443045890	/nfs/dbraw/zinc/04/58/90/443045890.db2.gz	STCIJYCFSGFTNI-CABZTGNLSA-N	-1	3	330.406	1.897	20	5		EDBDHM
CCOC(=O)C(C)(C)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000268881280	443136190	/nfs/dbraw/zinc/13/61/90/443136190.db2.gz	RQDCCVRJPHXAKK-UHFFFAOYSA-N	-1	3	344.389	1.832	20	5		EDBDHM
CO[C@@H](C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000190758870	443178219	/nfs/dbraw/zinc/17/82/19/443178219.db2.gz	JELZLWWTFCFUFM-ZETCQYMHSA-N	-1	3	342.295	1.927	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000269342897	443287557	/nfs/dbraw/zinc/28/75/57/443287557.db2.gz	HAQGLJCPAKAEFX-VIFPVBQESA-N	-1	3	330.362	1.603	20	5		EDBDHM
O=C(C[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)N1CCCCC1	ZINC000272617595	443384468	/nfs/dbraw/zinc/38/44/68/443384468.db2.gz	XVAWIJYRYWJOOJ-UHFFFAOYSA-N	-1	3	341.314	1.815	20	5		EDBDHM
CCC(CC)[C@@H](O)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000269744623	443421061	/nfs/dbraw/zinc/42/10/61/443421061.db2.gz	FZBGMJNWMFJQBY-LBPRGKRZSA-N	-1	3	346.405	1.679	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H]2CCCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000269766549	443431954	/nfs/dbraw/zinc/43/19/54/443431954.db2.gz	LIFKLGAKYNMQMH-ZWNOBZJWSA-N	-1	3	344.389	1.433	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](CO)[C@H]2CCCO2)c1[N+](=O)[O-]	ZINC000447934620	320148360	/nfs/dbraw/zinc/14/83/60/320148360.db2.gz	ZQMMZNHKYMEXNX-VXGBXAGGSA-N	-1	3	344.389	1.030	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CO)[C@@H]2CCCO2)cc1C	ZINC000447939302	320148897	/nfs/dbraw/zinc/14/88/97/320148897.db2.gz	FEAUSGKNOWBXFW-YPMHNXCESA-N	-1	3	344.389	1.030	20	5		EDBDHM
COc1cc(C(=O)[N-]c2nc3n(n2)CCCC3)cc([N+](=O)[O-])c1OC	ZINC000457142717	320320633	/nfs/dbraw/zinc/32/06/33/320320633.db2.gz	HQVACAGYGVEJKF-UHFFFAOYSA-N	-1	3	347.331	1.792	20	5		EDBDHM
O=C(Nc1cc([C@@H]2CCCOC2)[nH]n1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000280463230	443717080	/nfs/dbraw/zinc/71/70/80/443717080.db2.gz	DZQKHLGUXKENJL-MRVPVSSYSA-N	-1	3	333.304	1.565	20	5		EDBDHM
CC[C@@H](C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC)OC	ZINC000289405416	444132233	/nfs/dbraw/zinc/13/22/33/444132233.db2.gz	AMDGLAAEEOYTCJ-JTQLQIEISA-N	-1	3	346.361	1.085	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCc2nccs2)c([N+](=O)[O-])c1	ZINC000337707214	444364265	/nfs/dbraw/zinc/36/42/65/444364265.db2.gz	KRGCPLBDNSODSB-UHFFFAOYSA-N	-1	3	327.387	1.881	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@H]1CCC[C@H](CO)C1	ZINC000320228905	444328760	/nfs/dbraw/zinc/32/87/60/444328760.db2.gz	HHLFWHSPQJUHIQ-RYUDHWBXSA-N	-1	3	328.390	1.672	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H](CO)CC2CCCC2)c(F)c1	ZINC000338029956	444491638	/nfs/dbraw/zinc/49/16/38/444491638.db2.gz	SBAKGMOLTFMPKU-LLVKDONJSA-N	-1	3	346.380	1.953	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCCN(C)[C@H]2C)cc1C	ZINC000343975634	444705194	/nfs/dbraw/zinc/70/51/94/444705194.db2.gz	IVNXAQOOGYYEPZ-STQMWFEESA-N	-1	3	341.433	1.973	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCc2ncc(C)cn2)cc1[N+](=O)[O-]	ZINC000342490048	444713340	/nfs/dbraw/zinc/71/33/40/444713340.db2.gz	OHAZTYAGNRQPSL-UHFFFAOYSA-N	-1	3	342.402	1.584	20	5		EDBDHM
CO[C@@H]1CCC[C@H]1C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000341191063	444720201	/nfs/dbraw/zinc/72/02/01/444720201.db2.gz	NCPZCZKNMGTZIC-WCQYABFASA-N	-1	3	328.390	1.997	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCCN(C)[C@H]1C	ZINC000344026565	444736868	/nfs/dbraw/zinc/73/68/68/444736868.db2.gz	GZOCCNTUVHPFCJ-CMPLNLGQSA-N	-1	3	343.405	1.364	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)c2nc(C)no2)c([N+](=O)[O-])c1	ZINC000338898492	444919916	/nfs/dbraw/zinc/91/99/16/444919916.db2.gz	FODAQHDFYWYWNB-ZETCQYMHSA-N	-1	3	342.333	1.334	20	5		EDBDHM
O=[N+]([O-])c1ccccc1NCC[N-]S(=O)(=O)c1cncc(F)c1	ZINC000339175551	445072972	/nfs/dbraw/zinc/07/29/72/445072972.db2.gz	WKUCNFBWEZCVBR-UHFFFAOYSA-N	-1	3	340.336	1.519	20	5		EDBDHM
O=C(NCCc1cccc([N+](=O)[O-])c1)c1cc(F)cc2nn[n-]c21	ZINC000337468124	445094155	/nfs/dbraw/zinc/09/41/55/445094155.db2.gz	PLRGACMSRVVAGW-UHFFFAOYSA-N	-1	3	329.291	1.978	20	5		EDBDHM
O=C(NCCc1cccc([N+](=O)[O-])c1)c1cc(F)cc2[n-]nnc21	ZINC000337468124	445094159	/nfs/dbraw/zinc/09/41/59/445094159.db2.gz	PLRGACMSRVVAGW-UHFFFAOYSA-N	-1	3	329.291	1.978	20	5		EDBDHM
O=C(NCCc1cccc([N+](=O)[O-])c1)c1cc(F)cc2n[n-]nc21	ZINC000337468124	445094161	/nfs/dbraw/zinc/09/41/61/445094161.db2.gz	PLRGACMSRVVAGW-UHFFFAOYSA-N	-1	3	329.291	1.978	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]CCOCC1CC1	ZINC000342046103	445142466	/nfs/dbraw/zinc/14/24/66/445142466.db2.gz	RDZCPFPLKNUIOC-UHFFFAOYSA-N	-1	3	334.781	1.953	20	5		EDBDHM
C/C=C\C[C@@H](CO)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000359989434	445517815	/nfs/dbraw/zinc/51/78/15/445517815.db2.gz	YAYKWQGMZDZYRD-RXNFCKPNSA-N	-1	3	328.390	1.817	20	5		EDBDHM
CCC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(=O)OC	ZINC000358610434	445674826	/nfs/dbraw/zinc/67/48/26/445674826.db2.gz	LOGNBSUSDNNVGV-JTQLQIEISA-N	-1	3	346.361	1.223	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2ccn(C)c2)c([N+](=O)[O-])c1	ZINC000358864490	445817755	/nfs/dbraw/zinc/81/77/55/445817755.db2.gz	XDWHKLBMZRILRW-UHFFFAOYSA-N	-1	3	325.346	1.420	20	5		EDBDHM
C/C=C\C[C@@H](CO)[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000351619202	446214021	/nfs/dbraw/zinc/21/40/21/446214021.db2.gz	LLALZZLLVNGTFW-XOULXFPDSA-N	-1	3	330.362	1.209	20	5		EDBDHM
Cc1cn2c(n1)CC[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C2	ZINC000365591338	446264939	/nfs/dbraw/zinc/26/49/39/446264939.db2.gz	BQELTGHKFPWHLF-NSHDSACASA-N	-1	3	336.373	1.393	20	5		EDBDHM
CC[C@@H](C[C@H](C)CO)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000443327876	447033396	/nfs/dbraw/zinc/03/33/96/447033396.db2.gz	OGCSMIILNSKTEL-JQWIXIFHSA-N	-1	3	330.406	1.979	20	5		EDBDHM
CC[C@H](C[C@H](C)CO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000443328617	447034001	/nfs/dbraw/zinc/03/40/01/447034001.db2.gz	QJTNNSDDBIKWPX-WDEREUQCSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CCc1cc(=O)[n-]c(CN2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)n1	ZINC000372473662	447072032	/nfs/dbraw/zinc/07/20/32/447072032.db2.gz	QQPCLXFUZMORGD-GFCCVEGCSA-N	-1	3	332.364	1.686	20	5		EDBDHM
O=[N+]([O-])c1ccc(-c2noc([N-][C@H](CO)[C@@H]3CCCOC3)n2)cc1	ZINC000413535198	447209269	/nfs/dbraw/zinc/20/92/69/447209269.db2.gz	DMYJYPWQXMOAMS-DGCLKSJQSA-N	-1	3	334.332	1.844	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCC1(CO)CC1	ZINC000395994205	447543800	/nfs/dbraw/zinc/54/38/00/447543800.db2.gz	NBKCRPIAKLLMEE-UHFFFAOYSA-N	-1	3	330.362	1.044	20	5		EDBDHM
CCn1ccc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)n1	ZINC000416578558	447652460	/nfs/dbraw/zinc/65/24/60/447652460.db2.gz	GYUQIMQQXYEUEI-UHFFFAOYSA-N	-1	3	340.361	1.298	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H]([C@@H](CO)C1CC1)C1CC1	ZINC000451858940	447764844	/nfs/dbraw/zinc/76/48/44/447764844.db2.gz	SHRFWTQVSGDPFA-WFASDCNBSA-N	-1	3	340.401	1.670	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2CC23CCOCC3)c(F)c1	ZINC000431293883	447796502	/nfs/dbraw/zinc/79/65/02/447796502.db2.gz	DFSKVZDWBYNIMU-JTQLQIEISA-N	-1	3	344.364	1.829	20	5		EDBDHM
CCO[C@H]1C[C@@H]([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2OC)C1	ZINC000591329583	448324862	/nfs/dbraw/zinc/32/48/62/448324862.db2.gz	PQWYMALFDNLLAH-AOOOYVTPSA-N	-1	3	330.362	1.449	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)[C@@H]1COC[C@@H]1OC)c1cccc([N+](=O)[O-])c1	ZINC000591699670	448460890	/nfs/dbraw/zinc/46/08/90/448460890.db2.gz	YNMNSXVGVZRRPK-HZSPNIEDSA-N	-1	3	344.389	1.379	20	5		EDBDHM
CS[C@@H]1CN(c2cc(C(=O)[O-])ccc2[N+](=O)[O-])C[C@H]1N(C)C	ZINC000578196031	448483130	/nfs/dbraw/zinc/48/31/30/448483130.db2.gz	WFLOSOIYPGCYIL-CHWSQXEVSA-N	-1	3	325.390	1.775	20	5		EDBDHM
O=C(c1c([O-])cccc1O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000538821898	448598878	/nfs/dbraw/zinc/59/88/78/448598878.db2.gz	JVWCLPWTRQUSHX-UHFFFAOYSA-N	-1	3	344.327	1.363	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1CCS[C@H]1C	ZINC000592117595	448694463	/nfs/dbraw/zinc/69/44/63/448694463.db2.gz	ZBPQITRKTWEAPY-DTWKUNHWSA-N	-1	3	332.403	1.776	20	5		EDBDHM
CN1Cc2ccccc2[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000593566562	449075750	/nfs/dbraw/zinc/07/57/50/449075750.db2.gz	KJBKNXBRVAEFLE-CQSZACIVSA-N	-1	3	348.384	1.455	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCCO[C@H]2CCCCO2)nc1	ZINC000593592894	449094673	/nfs/dbraw/zinc/09/46/73/449094673.db2.gz	YRYRGMGMUGZJFN-ZDUSSCGKSA-N	-1	3	345.377	1.201	20	5		EDBDHM
Cc1cccc(CCC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)n1	ZINC000593598330	449099354	/nfs/dbraw/zinc/09/93/54/449099354.db2.gz	KGAJVYFKFOGORQ-UHFFFAOYSA-N	-1	3	336.373	1.604	20	5		EDBDHM
CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000590401547	449148510	/nfs/dbraw/zinc/14/85/10/449148510.db2.gz	MYQGYSYGFRJDDC-KGLIPLIRSA-N	-1	3	335.360	1.236	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])ncn1	ZINC000611134010	449181542	/nfs/dbraw/zinc/18/15/42/449181542.db2.gz	JFWYTGHOZNOWPM-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
NC(=O)c1ccc(N2CCN(c3cc[n-]c(=O)c3[N+](=O)[O-])CC2)cc1	ZINC000596130191	449378404	/nfs/dbraw/zinc/37/84/04/449378404.db2.gz	NAICXQWQGPMZPK-UHFFFAOYSA-N	-1	3	343.343	1.121	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)N1CCC[C@H](C)C1	ZINC000593532126	449328967	/nfs/dbraw/zinc/32/89/67/449328967.db2.gz	WSTZWGOCWHXTGP-NWDGAFQWSA-N	-1	3	342.421	1.389	20	5		EDBDHM
O=c1[n-]ccc(NCc2cccc(N3CCOCC3)n2)c1[N+](=O)[O-]	ZINC000596195001	449407096	/nfs/dbraw/zinc/40/70/96/449407096.db2.gz	KMZPKZNCIIDWNW-UHFFFAOYSA-N	-1	3	331.332	1.539	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)[C@H]1CCCCO1	ZINC000594486120	449550938	/nfs/dbraw/zinc/55/09/38/449550938.db2.gz	DHIOMYKJMVCKLO-NWDGAFQWSA-N	-1	3	329.378	1.616	20	5		EDBDHM
CCOC[C@H](C)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594770447	449683186	/nfs/dbraw/zinc/68/31/86/449683186.db2.gz	HETXEWGZYSAGNX-JTQLQIEISA-N	-1	3	339.373	1.846	20	5		EDBDHM
C[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccc3ncccc3c2[N+](=O)[O-])CO1	ZINC000594794100	449705313	/nfs/dbraw/zinc/70/53/13/449705313.db2.gz	JRQNFTDNIGVMLZ-NXEZZACHSA-N	-1	3	337.357	1.599	20	5		EDBDHM
COC[C@@H](CC[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])OC	ZINC000594796328	449707047	/nfs/dbraw/zinc/70/70/47/449707047.db2.gz	WJWUYLOWYJFYJE-GFCCVEGCSA-N	-1	3	346.405	1.541	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](CO)C1CCC1	ZINC000594803900	449716398	/nfs/dbraw/zinc/71/63/98/449716398.db2.gz	HXRNOBUUHAPCBF-JTQLQIEISA-N	-1	3	330.362	1.043	20	5		EDBDHM
CO[C@H](C)[C@@H](C)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594776210	449688098	/nfs/dbraw/zinc/68/80/98/449688098.db2.gz	VSPZQVHPGIZQKU-NXEZZACHSA-N	-1	3	339.373	1.845	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@]2(C)CCO[C@@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000601390982	449905966	/nfs/dbraw/zinc/90/59/66/449905966.db2.gz	JXRZFBDXTOQPTI-RNCFNFMXSA-N	-1	3	332.353	1.888	20	5		EDBDHM
CO[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C1CCCCC1	ZINC000595377466	450091922	/nfs/dbraw/zinc/09/19/22/450091922.db2.gz	OHALCNNQXNXPMA-CYBMUJFWSA-N	-1	3	343.405	1.863	20	5		EDBDHM
CCn1nccc1C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000595414380	450126010	/nfs/dbraw/zinc/12/60/10/450126010.db2.gz	CHQWYZSWYKKKEE-UHFFFAOYSA-N	-1	3	338.389	1.907	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)C[C@H]1CCOC1	ZINC000610739949	450318115	/nfs/dbraw/zinc/31/81/15/450318115.db2.gz	YAJBQWZCBURKJR-WDEREUQCSA-N	-1	3	344.389	1.697	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]CCC(F)(F)F	ZINC000619488113	450488483	/nfs/dbraw/zinc/48/84/83/450488483.db2.gz	VKAABXULPRUYGZ-UHFFFAOYSA-N	-1	3	328.268	1.834	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1CCC[C@H]1CCO	ZINC000619498147	450492320	/nfs/dbraw/zinc/49/23/20/450492320.db2.gz	DFZJGRINSPLMEK-QWRGUYRKSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CS[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2[O-])C[C@H]1N(C)C	ZINC000271204098	518175043	/nfs/dbraw/zinc/17/50/43/518175043.db2.gz	XPTQCIYUSUUQRA-VXGBXAGGSA-N	-1	3	325.390	1.418	20	5		EDBDHM
CNC(=O)C1([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])CCCC1	ZINC000725839525	578287275	/nfs/dbraw/zinc/28/72/75/578287275.db2.gz	UWYLMJOSLCBKIK-UHFFFAOYSA-N	-1	3	341.389	1.240	20	5		EDBDHM
O=C(Nc1ccn(Cc2ccccn2)n1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000727167754	578520242	/nfs/dbraw/zinc/52/02/42/578520242.db2.gz	GEHAGKRXSAAZEU-UHFFFAOYSA-N	-1	3	340.299	1.588	20	5		EDBDHM
CC1(C)CN(CCNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CCO1	ZINC000736214690	578965492	/nfs/dbraw/zinc/96/54/92/578965492.db2.gz	UBDHCFBQVCNOJR-UHFFFAOYSA-N	-1	3	347.379	1.298	20	5		EDBDHM
CC1(C)CN(CCNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CCO1	ZINC000736214690	578965493	/nfs/dbraw/zinc/96/54/93/578965493.db2.gz	UBDHCFBQVCNOJR-UHFFFAOYSA-N	-1	3	347.379	1.298	20	5		EDBDHM
COc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)cn2)cc1[N+](=O)[O-]	ZINC000737071681	579044879	/nfs/dbraw/zinc/04/48/79/579044879.db2.gz	LPPMSSNMVKQBOF-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
COc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)cn2)cc1[N+](=O)[O-]	ZINC000737071681	579044880	/nfs/dbraw/zinc/04/48/80/579044880.db2.gz	LPPMSSNMVKQBOF-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H](C)C(C)(C)O)cc1[N+](=O)[O-]	ZINC000751283560	579800431	/nfs/dbraw/zinc/80/04/31/579800431.db2.gz	UVDSRMZLALPXBM-QMMMGPOBSA-N	-1	3	336.797	1.994	20	5		EDBDHM
CN(C(=O)c1n[n-]c2ccc([N+](=O)[O-])cc21)c1ccc(C(N)=O)cc1	ZINC000751372677	579803397	/nfs/dbraw/zinc/80/33/97/579803397.db2.gz	BMDSXNXHIAOQTG-UHFFFAOYSA-N	-1	3	339.311	1.847	20	5		EDBDHM
Cc1nc2sccc2c(=O)n1[N-]C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000751883628	579826201	/nfs/dbraw/zinc/82/62/01/579826201.db2.gz	OXDWKTCMQZTKBI-UHFFFAOYSA-N	-1	3	344.352	1.987	20	5		EDBDHM
CCOC(=O)[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000753374103	579878198	/nfs/dbraw/zinc/87/81/98/579878198.db2.gz	RDAVDDHAKNTIEJ-GFCCVEGCSA-N	-1	3	344.389	1.851	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)[n-]1	ZINC000763643336	580103146	/nfs/dbraw/zinc/10/31/46/580103146.db2.gz	VHWOZRVBQLWGMS-UHFFFAOYSA-N	-1	3	347.331	1.813	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)c[n-]1	ZINC000763643336	580103147	/nfs/dbraw/zinc/10/31/47/580103147.db2.gz	VHWOZRVBQLWGMS-UHFFFAOYSA-N	-1	3	347.331	1.813	20	5		EDBDHM
CCO[C@@H]1COCC[C@H]1[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768890995	580223677	/nfs/dbraw/zinc/22/36/77/580223677.db2.gz	KOXLIJAGZZKXQP-NXEZZACHSA-N	-1	3	336.391	1.129	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H](CO)CC2CC2)c1	ZINC000779913882	580502524	/nfs/dbraw/zinc/50/25/24/580502524.db2.gz	MPNJBIXLDLEJRZ-JTQLQIEISA-N	-1	3	348.808	1.996	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)OCc2noc(-c3ccccc3[O-])n2)n1	ZINC000784508012	580622487	/nfs/dbraw/zinc/62/24/87/580622487.db2.gz	YBPNASKFIIAQQQ-UHFFFAOYSA-N	-1	3	345.271	1.441	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C2COC(C)(C)OC2)c1[N+](=O)[O-]	ZINC000790871075	580780326	/nfs/dbraw/zinc/78/03/26/580780326.db2.gz	LWWMOLCPSCGAMW-UHFFFAOYSA-N	-1	3	344.389	1.641	20	5		EDBDHM
O=C(NC1CCN(C[C@H]2CCCO2)CC1)c1cc([O-])ccc1[N+](=O)[O-]	ZINC000796431288	580953761	/nfs/dbraw/zinc/95/37/61/580953761.db2.gz	NBXJQKKZQYYVRT-CQSZACIVSA-N	-1	3	349.387	1.674	20	5		EDBDHM
COCCN1CCN(Cc2ccc([O-])c(OC)c2[N+](=O)[O-])CC1	ZINC000891540891	591117158	/nfs/dbraw/zinc/11/71/58/591117158.db2.gz	UVBURXIXGWNTMY-UHFFFAOYSA-N	-1	3	325.365	1.073	20	5		EDBDHM
CC[S@@](=O)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000735082625	592975229	/nfs/dbraw/zinc/97/52/29/592975229.db2.gz	ZWBSXKYSMHJCAO-LJQANCHMSA-N	-1	3	340.810	1.295	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOC[C@@H]2CCCO2)c(-c2nnn[n-]2)c1	ZINC000738371658	599059805	/nfs/dbraw/zinc/05/98/05/599059805.db2.gz	WARGLBNQJZQMNM-NSHDSACASA-N	-1	3	334.336	1.382	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOC[C@@H]2CCCO2)c(-c2nn[n-]n2)c1	ZINC000738371658	599059808	/nfs/dbraw/zinc/05/98/08/599059808.db2.gz	WARGLBNQJZQMNM-NSHDSACASA-N	-1	3	334.336	1.382	20	5		EDBDHM
Cc1n[n-]nc1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000805545444	593465509	/nfs/dbraw/zinc/46/55/09/593465509.db2.gz	QHDUAFAVXOHEIU-SECBINFHSA-N	-1	3	333.304	1.514	20	5		EDBDHM
CCC[C@H](C)C(=O)NCC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000814285801	593581626	/nfs/dbraw/zinc/58/16/26/593581626.db2.gz	OQYFDJILXNXXBC-VIFPVBQESA-N	-1	3	349.434	1.487	20	5		EDBDHM
CC(C)(C)OC(=O)CCNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000819928602	593777721	/nfs/dbraw/zinc/77/77/21/593777721.db2.gz	RLRKGEKQOHPKDI-UHFFFAOYSA-N	-1	3	335.324	1.314	20	5		EDBDHM
CC(C)(C)OC(=O)CCNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000819928602	593777722	/nfs/dbraw/zinc/77/77/22/593777722.db2.gz	RLRKGEKQOHPKDI-UHFFFAOYSA-N	-1	3	335.324	1.314	20	5		EDBDHM
C[C@@H](CO)[C@H](C)Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820280201	593805796	/nfs/dbraw/zinc/80/57/96/593805796.db2.gz	ATHDQIYDWOCPRA-IUCAKERBSA-N	-1	3	343.347	1.752	20	5		EDBDHM
C[C@@H](CO)[C@H](C)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820280201	593805797	/nfs/dbraw/zinc/80/57/97/593805797.db2.gz	ATHDQIYDWOCPRA-IUCAKERBSA-N	-1	3	343.347	1.752	20	5		EDBDHM
COc1ccccc1CCNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000821890904	593961663	/nfs/dbraw/zinc/96/16/63/593961663.db2.gz	RFXFTYWYPOMXIE-UHFFFAOYSA-N	-1	3	341.331	1.833	20	5		EDBDHM
COc1ccccc1CCNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000821890904	593961666	/nfs/dbraw/zinc/96/16/66/593961666.db2.gz	RFXFTYWYPOMXIE-UHFFFAOYSA-N	-1	3	341.331	1.833	20	5		EDBDHM
CCCc1nnc(Sc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)o1	ZINC000821143391	593976288	/nfs/dbraw/zinc/97/62/88/593976288.db2.gz	UPAQLSWJIMFSMG-UHFFFAOYSA-N	-1	3	334.321	1.657	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(=O)n1CCOc1ccc(-c2nnn[n-]2)cc1	ZINC000822271438	594022370	/nfs/dbraw/zinc/02/23/70/594022370.db2.gz	ZTGAEQBPAQDVML-UHFFFAOYSA-N	-1	3	342.315	1.324	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(=O)n1CCOc1ccc(-c2nn[n-]n2)cc1	ZINC000822271438	594022372	/nfs/dbraw/zinc/02/23/72/594022372.db2.gz	ZTGAEQBPAQDVML-UHFFFAOYSA-N	-1	3	342.315	1.324	20	5		EDBDHM
O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(-c2nnn[n-]2)cc1Cl	ZINC000823122427	594156299	/nfs/dbraw/zinc/15/62/99/594156299.db2.gz	AUDJGQBNVIZEPU-UHFFFAOYSA-N	-1	3	348.710	1.264	20	5		EDBDHM
O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(-c2nn[n-]n2)cc1Cl	ZINC000823122427	594156301	/nfs/dbraw/zinc/15/63/01/594156301.db2.gz	AUDJGQBNVIZEPU-UHFFFAOYSA-N	-1	3	348.710	1.264	20	5		EDBDHM
CCOC(=O)CC[C@H](C)Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000825508395	594194432	/nfs/dbraw/zinc/19/44/32/594194432.db2.gz	YGPOJAKUPZTAJV-VIFPVBQESA-N	-1	3	334.336	1.919	20	5		EDBDHM
CCOC(=O)CC[C@H](C)Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000825508395	594194433	/nfs/dbraw/zinc/19/44/33/594194433.db2.gz	YGPOJAKUPZTAJV-VIFPVBQESA-N	-1	3	334.336	1.919	20	5		EDBDHM
O=C(OCc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc([N+](=O)[O-])o1	ZINC000823426379	594200728	/nfs/dbraw/zinc/20/07/28/594200728.db2.gz	GGINNFZEOUQGLN-UHFFFAOYSA-N	-1	3	333.235	1.864	20	5		EDBDHM
O=C(OCc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc([N+](=O)[O-])o1	ZINC000823426379	594200729	/nfs/dbraw/zinc/20/07/29/594200729.db2.gz	GGINNFZEOUQGLN-UHFFFAOYSA-N	-1	3	333.235	1.864	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCCC3(C2)OCCO3)c(-c2nnn[n-]2)c1	ZINC000823639529	594223987	/nfs/dbraw/zinc/22/39/87/594223987.db2.gz	CJQOGUXHUAUSKF-UHFFFAOYSA-N	-1	3	332.320	1.118	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCCC3(C2)OCCO3)c(-c2nn[n-]n2)c1	ZINC000823639529	594223988	/nfs/dbraw/zinc/22/39/88/594223988.db2.gz	CJQOGUXHUAUSKF-UHFFFAOYSA-N	-1	3	332.320	1.118	20	5		EDBDHM
O=[N+]([O-])c1ccc(OCCNCc2ccc(-c3nnn[n-]3)o2)cc1	ZINC000823643785	594224295	/nfs/dbraw/zinc/22/42/95/594224295.db2.gz	ATHFJBCWDJWQTQ-UHFFFAOYSA-N	-1	3	330.304	1.537	20	5		EDBDHM
O=[N+]([O-])c1ccc(OCCNCc2ccc(-c3nn[n-]n3)o2)cc1	ZINC000823643785	594224296	/nfs/dbraw/zinc/22/42/96/594224296.db2.gz	ATHFJBCWDJWQTQ-UHFFFAOYSA-N	-1	3	330.304	1.537	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@H]2CCOC3(CCC3)C2)c(-c2nnn[n-]2)c1	ZINC000823651103	594224729	/nfs/dbraw/zinc/22/47/29/594224729.db2.gz	GBTZFJAVEKLJND-VIFPVBQESA-N	-1	3	331.336	1.684	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@H]2CCOC3(CCC3)C2)c(-c2nn[n-]n2)c1	ZINC000823651103	594224730	/nfs/dbraw/zinc/22/47/30/594224730.db2.gz	GBTZFJAVEKLJND-VIFPVBQESA-N	-1	3	331.336	1.684	20	5		EDBDHM
CCc1nnc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)[nH]1	ZINC000825744958	594236163	/nfs/dbraw/zinc/23/61/63/594236163.db2.gz	HFVGIBXXFDHBBX-SSDOTTSWSA-N	-1	3	329.324	1.629	20	5		EDBDHM
CCc1nnc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)[nH]1	ZINC000825744958	594236164	/nfs/dbraw/zinc/23/61/64/594236164.db2.gz	HFVGIBXXFDHBBX-SSDOTTSWSA-N	-1	3	329.324	1.629	20	5		EDBDHM
Cn1c(CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])nnc1C1CC1	ZINC000826355415	594441489	/nfs/dbraw/zinc/44/14/89/594441489.db2.gz	YMUKZMKJNAEKQY-UHFFFAOYSA-N	-1	3	341.335	1.393	20	5		EDBDHM
Cn1c(CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])nnc1C1CC1	ZINC000826355415	594441491	/nfs/dbraw/zinc/44/14/91/594441491.db2.gz	YMUKZMKJNAEKQY-UHFFFAOYSA-N	-1	3	341.335	1.393	20	5		EDBDHM
O=C(NC1(c2cccc(-c3nnn[n-]3)c2)CC1)c1ccc([N+](=O)[O-])[nH]1	ZINC000826428127	594472346	/nfs/dbraw/zinc/47/23/46/594472346.db2.gz	PNUWLLSNYOJWBH-UHFFFAOYSA-N	-1	3	339.315	1.522	20	5		EDBDHM
O=C(NC1(c2cccc(-c3nn[n-]n3)c2)CC1)c1ccc([N+](=O)[O-])[nH]1	ZINC000826428127	594472348	/nfs/dbraw/zinc/47/23/48/594472348.db2.gz	PNUWLLSNYOJWBH-UHFFFAOYSA-N	-1	3	339.315	1.522	20	5		EDBDHM
O=[N+]([O-])c1cnc2c(c1)CN(Cc1cccc(-c3nnn[n-]3)c1)CC2	ZINC000826500708	594503727	/nfs/dbraw/zinc/50/37/27/594503727.db2.gz	JBKSMTUEJXDUDN-UHFFFAOYSA-N	-1	3	337.343	1.728	20	5		EDBDHM
O=[N+]([O-])c1cnc2c(c1)CN(Cc1cccc(-c3nn[n-]n3)c1)CC2	ZINC000826500708	594503729	/nfs/dbraw/zinc/50/37/29/594503729.db2.gz	JBKSMTUEJXDUDN-UHFFFAOYSA-N	-1	3	337.343	1.728	20	5		EDBDHM
CC1(C[N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)OCCO1	ZINC000848587951	595410538	/nfs/dbraw/zinc/41/05/38/595410538.db2.gz	ZLKHQRKUFWYIRK-UHFFFAOYSA-N	-1	3	332.259	1.446	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@H]2CCCC23OCCO3)cs1	ZINC000851814944	595932132	/nfs/dbraw/zinc/93/21/32/595932132.db2.gz	GZSUHGFBZKESAD-VIFPVBQESA-N	-1	3	334.375	1.230	20	5		EDBDHM
CCOC(=O)C1=CC[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000859317270	596047445	/nfs/dbraw/zinc/04/74/45/596047445.db2.gz	DGEDUWWIAASUQT-NSHDSACASA-N	-1	3	340.357	1.525	20	5		EDBDHM
Cc1nn(CC(=O)Nc2ccc(-c3nnn[n-]3)cc2)c(C)c1[N+](=O)[O-]	ZINC000123590087	596535609	/nfs/dbraw/zinc/53/56/09/596535609.db2.gz	YWIKOBAXKCWNHR-UHFFFAOYSA-N	-1	3	342.319	1.227	20	5		EDBDHM
Cc1nn(CC(=O)Nc2ccc(-c3nn[n-]n3)cc2)c(C)c1[N+](=O)[O-]	ZINC000123590087	596535612	/nfs/dbraw/zinc/53/56/12/596535612.db2.gz	YWIKOBAXKCWNHR-UHFFFAOYSA-N	-1	3	342.319	1.227	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]CCc2ccccc2O)cs1	ZINC000119812839	596743582	/nfs/dbraw/zinc/74/35/82/596743582.db2.gz	KDDXUZPHDUCLJJ-UHFFFAOYSA-N	-1	3	328.371	1.883	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2C[C@@H]3CCC[C@@H]3O2)c(F)c1	ZINC000872559526	596964660	/nfs/dbraw/zinc/96/46/60/596964660.db2.gz	YCBPEDSYERNPDA-GAFUQQFSSA-N	-1	3	344.364	1.970	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N[C@H](CO)Cc1ccccc1	ZINC000738358080	598244307	/nfs/dbraw/zinc/24/43/07/598244307.db2.gz	KQYHWQCHYDNLPQ-ZDUSSCGKSA-N	-1	3	340.343	1.790	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N[C@H](CO)Cc1ccccc1	ZINC000738358080	598244309	/nfs/dbraw/zinc/24/43/09/598244309.db2.gz	KQYHWQCHYDNLPQ-ZDUSSCGKSA-N	-1	3	340.343	1.790	20	5		EDBDHM
CC[C@@H](O)CCNc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820932613	606879458	/nfs/dbraw/zinc/87/94/58/606879458.db2.gz	PMGMRJULTPXZOP-SNVBAGLBSA-N	-1	3	343.347	1.896	20	5		EDBDHM
CC[C@@H](O)CCNc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820932613	606879460	/nfs/dbraw/zinc/87/94/60/606879460.db2.gz	PMGMRJULTPXZOP-SNVBAGLBSA-N	-1	3	343.347	1.896	20	5		EDBDHM
CCOC(=O)C[C@@H](C)CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825499287	608018031	/nfs/dbraw/zinc/01/80/31/608018031.db2.gz	JWTDHQQZAQXHCN-SECBINFHSA-N	-1	3	334.336	1.776	20	5		EDBDHM
CCOC(=O)C[C@@H](C)CNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825499287	608018032	/nfs/dbraw/zinc/01/80/32/608018032.db2.gz	JWTDHQQZAQXHCN-SECBINFHSA-N	-1	3	334.336	1.776	20	5		EDBDHM
CC(C)(C)OC(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000065795764	138174957	/nfs/dbraw/zinc/17/49/57/138174957.db2.gz	DEKAUVVZSOVLGG-UHFFFAOYSA-N	-1	3	345.377	1.398	20	5		EDBDHM
COc1nc(NC(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])n[n-]1	ZINC000413669205	304072981	/nfs/dbraw/zinc/07/29/81/304072981.db2.gz	SHBUIXJAVJVXJI-UHFFFAOYSA-N	-1	3	325.256	1.050	20	5		EDBDHM
COc1nnc(NC(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])[n-]1	ZINC000413669205	304072983	/nfs/dbraw/zinc/07/29/83/304072983.db2.gz	SHBUIXJAVJVXJI-UHFFFAOYSA-N	-1	3	325.256	1.050	20	5		EDBDHM
COc1n[n-]c(NC(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])n1	ZINC000413669205	304072986	/nfs/dbraw/zinc/07/29/86/304072986.db2.gz	SHBUIXJAVJVXJI-UHFFFAOYSA-N	-1	3	325.256	1.050	20	5		EDBDHM
CCC1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(=O)OC)CCC1	ZINC000273595720	201259672	/nfs/dbraw/zinc/25/96/72/201259672.db2.gz	QWALMHALOJFZEI-UHFFFAOYSA-N	-1	3	342.373	1.992	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](CO)C(C)(C)C)c([N+](=O)[O-])c1	ZINC000276649424	201297093	/nfs/dbraw/zinc/29/70/93/201297093.db2.gz	CVYRYRCKHMZWDS-GFCCVEGCSA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@]2(O)CCO[C@H]2C)cc1C	ZINC000278681110	201306648	/nfs/dbraw/zinc/30/66/48/201306648.db2.gz	ILQFMRHEWYHBMP-FZMZJTMJSA-N	-1	3	344.389	1.030	20	5		EDBDHM
CC[C@@H]1C[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC	ZINC000280497492	201324672	/nfs/dbraw/zinc/32/46/72/201324672.db2.gz	BSTVPODYSSAHFH-LDYMZIIASA-N	-1	3	328.346	1.458	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(C)(C)O	ZINC000293737926	201344117	/nfs/dbraw/zinc/34/41/17/201344117.db2.gz	HGMWLPMZNIZPTC-LBPRGKRZSA-N	-1	3	332.378	1.431	20	5		EDBDHM
Cc1nc(S(=O)(=O)[N-]C(C)(C)c2ccc([N+](=O)[O-])cc2)cn1C	ZINC000175891319	207169098	/nfs/dbraw/zinc/16/90/98/207169098.db2.gz	XMZFRZULSGJSKF-UHFFFAOYSA-N	-1	3	338.389	1.850	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@@]2(O)CCC[C@@H]2C)cc1[N+](=O)[O-]	ZINC000339093201	141955551	/nfs/dbraw/zinc/95/55/51/141955551.db2.gz	BCRINOOSZXVKPB-UFBFGSQYSA-N	-1	3	334.419	1.794	20	5		EDBDHM
Cn1ncc([N+](=O)[O-])c1C(=O)[N-]c1ccccc1SCCC(N)=O	ZINC000347163699	143289733	/nfs/dbraw/zinc/28/97/33/143289733.db2.gz	WMEFCPBVWLNFFW-UHFFFAOYSA-N	-1	3	349.372	1.548	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@@H]2C[C@H](C)O[C@@H]2C)c([N+](=O)[O-])c1	ZINC000416610548	304337783	/nfs/dbraw/zinc/33/77/83/304337783.db2.gz	WWGBRFVPVPPDJB-TUAOUCFPSA-N	-1	3	328.390	1.995	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H](C)c2csnn2)c([N+](=O)[O-])c1	ZINC000416642323	304340692	/nfs/dbraw/zinc/34/06/92/304340692.db2.gz	ZRBLFRLTIJQHDN-QMMMGPOBSA-N	-1	3	328.375	1.794	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](C2CC2)C(C)(C)CO)c([N+](=O)[O-])c1	ZINC000352574197	149070442	/nfs/dbraw/zinc/07/04/42/149070442.db2.gz	DGRRRIZEDFFAHT-CQSZACIVSA-N	-1	3	342.417	1.979	20	5		EDBDHM
Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1nnc(C(F)(F)F)[n-]1	ZINC000361012050	152278337	/nfs/dbraw/zinc/27/83/37/152278337.db2.gz	IAMYNRXVBGPOEJ-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1n[n-]c(C(F)(F)F)n1	ZINC000361012050	152278339	/nfs/dbraw/zinc/27/83/39/152278339.db2.gz	IAMYNRXVBGPOEJ-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1nc(C(F)(F)F)n[n-]1	ZINC000361012050	152278340	/nfs/dbraw/zinc/27/83/40/152278340.db2.gz	IAMYNRXVBGPOEJ-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
CC(=O)N1Cc2ccc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)cc2C1	ZINC000364206370	153173006	/nfs/dbraw/zinc/17/30/06/153173006.db2.gz	HNAMUKKOTIGKAO-UHFFFAOYSA-N	-1	3	342.311	1.810	20	5		EDBDHM
Cc1cnn([C@H]2CCN(C(=O)c3cc(C)[n-]c(=O)c3[N+](=O)[O-])C2)c1	ZINC000367838571	154293254	/nfs/dbraw/zinc/29/32/54/154293254.db2.gz	FXKWTSVCKJEBRY-NSHDSACASA-N	-1	3	331.332	1.596	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)[N-]c1ncn(-c2cccnc2)n1	ZINC000371828850	156127876	/nfs/dbraw/zinc/12/78/76/156127876.db2.gz	NABACYFADLECER-UHFFFAOYSA-N	-1	3	325.288	1.526	20	5		EDBDHM
Cc1ncc2c(n1)CC[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C2	ZINC000373941968	157073940	/nfs/dbraw/zinc/07/39/40/157073940.db2.gz	WTBBZJGRWZDSFZ-LBPRGKRZSA-N	-1	3	348.384	1.529	20	5		EDBDHM
Cc1ncc2c(n1)CC[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C2	ZINC000373941967	157074911	/nfs/dbraw/zinc/07/49/11/157074911.db2.gz	WTBBZJGRWZDSFZ-GFCCVEGCSA-N	-1	3	348.384	1.529	20	5		EDBDHM
O=C(Nc1cccc2c1OCC(=O)N2)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000378025336	158060305	/nfs/dbraw/zinc/06/03/05/158060305.db2.gz	LQGMIXNSDUQUTM-UHFFFAOYSA-N	-1	3	330.256	1.279	20	5		EDBDHM
COCC[C@@H](COC)[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000352521761	162228449	/nfs/dbraw/zinc/22/84/49/162228449.db2.gz	KXRSQRUMHSRDSH-VIFPVBQESA-N	-1	3	338.407	1.295	20	5		EDBDHM
CC(C)[C@H](O)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000122018954	287376713	/nfs/dbraw/zinc/37/67/13/287376713.db2.gz	XOGKTDWBSCVGJE-LLVKDONJSA-N	-1	3	336.797	1.934	20	5		EDBDHM
CCOC(=O)C(C)(C)[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000273707561	268075358	/nfs/dbraw/zinc/07/53/58/268075358.db2.gz	PDEOJCJKDBOWFF-UHFFFAOYSA-N	-1	3	330.362	1.356	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CCC(C)(C)O)c1	ZINC000274757278	268198471	/nfs/dbraw/zinc/19/84/71/268198471.db2.gz	RUABFUOIIKCYEP-UHFFFAOYSA-N	-1	3	336.797	1.996	20	5		EDBDHM
CCCC[C@@H]([N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C(=O)OC	ZINC000274019667	273065818	/nfs/dbraw/zinc/06/58/18/273065818.db2.gz	VZPCPHHAPCSCDY-CYBMUJFWSA-N	-1	3	344.389	1.746	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CCSC1	ZINC000276071428	273146964	/nfs/dbraw/zinc/14/69/64/273146964.db2.gz	DMJISYHUNFEWPB-QMMMGPOBSA-N	-1	3	346.386	1.165	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]Cc2nnc3ccccn32)c([N+](=O)[O-])c1	ZINC000088767686	272916696	/nfs/dbraw/zinc/91/66/96/272916696.db2.gz	FHMQYHJPKWBPPF-UHFFFAOYSA-N	-1	3	347.356	1.424	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC1([S@](C)=O)CCC1	ZINC000280762188	273395290	/nfs/dbraw/zinc/39/52/90/273395290.db2.gz	NNHCCVYPMZDEMJ-NRFANRHFSA-N	-1	3	346.430	1.483	20	5		EDBDHM
CC(C)[C@@H]([N-]S(C)(=O)=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1	ZINC000347999453	277760797	/nfs/dbraw/zinc/76/07/97/277760797.db2.gz	HWZHBHBNLUQOJJ-LLVKDONJSA-N	-1	3	333.341	1.246	20	5		EDBDHM
CCC(CC)([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(N)=O	ZINC000161213263	278590930	/nfs/dbraw/zinc/59/09/30/278590930.db2.gz	LHTOPLZEPRFNHU-UHFFFAOYSA-N	-1	3	329.378	1.226	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)[C@H](C)OC	ZINC000289457767	288704890	/nfs/dbraw/zinc/70/48/90/288704890.db2.gz	GFWYNWHFGUIOEA-BDAKNGLRSA-N	-1	3	346.361	1.083	20	5		EDBDHM
Cc1cc(C(=O)N2CCCC[C@@H]2c2ncon2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375089826	301091152	/nfs/dbraw/zinc/09/11/52/301091152.db2.gz	JEBWEMVAIQZLHO-SNVBAGLBSA-N	-1	3	333.304	1.754	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1C[C@H]2OCCC[C@H]12	ZINC000190632536	302049433	/nfs/dbraw/zinc/04/94/33/302049433.db2.gz	ICWPCTRIAONJEE-NQBHXWOUSA-N	-1	3	326.374	1.749	20	5		EDBDHM
CO[C@@H](C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C1CC1	ZINC000293932769	303040358	/nfs/dbraw/zinc/04/03/58/303040358.db2.gz	YXGYXMDYIFHJBR-ZDUSSCGKSA-N	-1	3	328.390	1.915	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@]1(O)CCC[C@@H]1C	ZINC000294563265	303124333	/nfs/dbraw/zinc/12/43/33/303124333.db2.gz	LPUCMZFAEBKECN-IINYFYTJSA-N	-1	3	344.389	1.433	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@H]2CCO[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000330653956	303772359	/nfs/dbraw/zinc/77/23/59/303772359.db2.gz	ZMCHBQSOESCHAU-RYUDHWBXSA-N	-1	3	328.390	1.997	20	5		EDBDHM
CC[C@H](C[C@H](C)CO)[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000443346035	305237976	/nfs/dbraw/zinc/23/79/76/305237976.db2.gz	UGPGUBNIUGLTGQ-WDEREUQCSA-N	-1	3	346.405	1.679	20	5		EDBDHM
O=C(Nc1cccc(N2CCNC2=O)c1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000444855558	305254122	/nfs/dbraw/zinc/25/41/22/305254122.db2.gz	XMXNJDXOCAUCDW-UHFFFAOYSA-N	-1	3	343.299	1.477	20	5		EDBDHM
Cc1n[nH]cc1CCC[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000451543493	305352281	/nfs/dbraw/zinc/35/22/81/305352281.db2.gz	CBCDOEFCRKLZMQ-UHFFFAOYSA-N	-1	3	344.418	1.907	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)[C@@H](OC)C1CC1	ZINC000451981556	305376121	/nfs/dbraw/zinc/37/61/21/305376121.db2.gz	FADKCHRJLKOJBG-LKFCYVNXSA-N	-1	3	344.389	1.695	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(C)C	ZINC000525189221	305823595	/nfs/dbraw/zinc/82/35/95/305823595.db2.gz	MPULMJKFVWHLDK-LLVKDONJSA-N	-1	3	332.378	1.553	20	5		EDBDHM
O=C(c1ccc(O)cc1[O-])N1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000554504695	306193611	/nfs/dbraw/zinc/19/36/11/306193611.db2.gz	DIVMOZAMPMMLIV-UHFFFAOYSA-N	-1	3	344.327	1.363	20	5		EDBDHM
CN1CCC[C@H](C[N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000108406201	441453016	/nfs/dbraw/zinc/45/30/16/441453016.db2.gz	OWXHQUZZHTXEBZ-SNVBAGLBSA-N	-1	3	331.369	1.354	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2CCC[C@H](O)C2)c(F)c1	ZINC000121767238	441777043	/nfs/dbraw/zinc/77/70/43/441777043.db2.gz	SRUVALWTOTYDKI-ONGXEEELSA-N	-1	3	332.353	1.563	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@H]2CCC[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000121829151	441789763	/nfs/dbraw/zinc/78/97/63/441789763.db2.gz	GKRYEQNYCRZOPK-NWDGAFQWSA-N	-1	3	328.390	1.733	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccco1	ZINC000175355359	442048608	/nfs/dbraw/zinc/04/86/08/442048608.db2.gz	PINOCHXWWMOKQI-CYBMUJFWSA-N	-1	3	340.357	1.995	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)Cn2cncn2)c1C	ZINC000120379324	442059698	/nfs/dbraw/zinc/05/96/98/442059698.db2.gz	NHTISZBXBBBMHT-JTQLQIEISA-N	-1	3	339.377	1.170	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2c3ccccc3C[C@@H]2O)c([N+](=O)[O-])c1	ZINC000151934059	442143337	/nfs/dbraw/zinc/14/33/37/442143337.db2.gz	NZTQIHSIPUMCRR-HOCLYGCPSA-N	-1	3	348.380	1.840	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1C[C@@H](C)N(C2CC2)C1	ZINC000126302469	442097276	/nfs/dbraw/zinc/09/72/76/442097276.db2.gz	NOYPBYGVDCMLBF-NEPJUHHUSA-N	-1	3	339.417	1.807	20	5		EDBDHM
CCOC(=O)CCC[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000166010592	442212741	/nfs/dbraw/zinc/21/27/41/442212741.db2.gz	RMCGCLKERZTIJW-UHFFFAOYSA-N	-1	3	346.361	1.225	20	5		EDBDHM
CCCc1[nH]nc(C(=O)[N-]c2nnc3n(C)[nH]c(CC)c2-3)c1[N+](=O)[O-]	ZINC000177487626	442349078	/nfs/dbraw/zinc/34/90/78/442349078.db2.gz	OXXIXEFXCFVBIF-UHFFFAOYSA-N	-1	3	346.351	1.695	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CCCC[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000133980611	442444294	/nfs/dbraw/zinc/44/42/94/442444294.db2.gz	DRXAVMBJBRHIEH-NEPJUHHUSA-N	-1	3	328.390	1.733	20	5		EDBDHM
O=C(Nc1ccc(Cn2cncn2)cc1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000187553038	442680978	/nfs/dbraw/zinc/68/09/78/442680978.db2.gz	KQJLGSAPHAGKKI-UHFFFAOYSA-N	-1	3	340.299	1.588	20	5		EDBDHM
CSC[C@@H](C)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000265475053	442786726	/nfs/dbraw/zinc/78/67/26/442786726.db2.gz	MQOYKONAFCYXGD-MRVPVSSYSA-N	-1	3	348.402	1.396	20	5		EDBDHM
C[C@@H](C[S@](C)=O)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000183209823	318520648	/nfs/dbraw/zinc/52/06/48/318520648.db2.gz	BXHHTOKTVHMXFI-IIYDVTGLSA-N	-1	3	340.810	1.294	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)c2nncn2C)c1C	ZINC000268777281	443105215	/nfs/dbraw/zinc/10/52/15/443105215.db2.gz	BNTIWBCHBYNMCA-JTQLQIEISA-N	-1	3	339.377	1.380	20	5		EDBDHM
O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)[N-]C[C@H]1CCCCN1	ZINC000237851993	443184060	/nfs/dbraw/zinc/18/40/60/443184060.db2.gz	QWFDCZPAUFWJRX-SECBINFHSA-N	-1	3	333.797	1.669	20	5		EDBDHM
CN(C)CCN(CC(=O)[O-])C(=O)Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000237124295	443159529	/nfs/dbraw/zinc/15/95/29/443159529.db2.gz	SGBVCWYPZWPTDW-UHFFFAOYSA-N	-1	3	343.767	1.266	20	5		EDBDHM
CCC(C)(C)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000264009792	443244892	/nfs/dbraw/zinc/24/48/92/443244892.db2.gz	RSDUKPIGONIWDY-UHFFFAOYSA-N	-1	3	330.362	1.833	20	5		EDBDHM
CCC(CC)(CC(=O)OC)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000267251066	443393799	/nfs/dbraw/zinc/39/37/99/443393799.db2.gz	IPASBJSSCPEHHJ-UHFFFAOYSA-N	-1	3	344.389	1.995	20	5		EDBDHM
COC(=O)[C@H]1CC[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000278714332	443410813	/nfs/dbraw/zinc/41/08/13/443410813.db2.gz	KVJOFYUVYREJIP-VHSXEESVSA-N	-1	3	328.346	1.215	20	5		EDBDHM
O=C1[N-]C(=O)[C@@]2(CCCN(c3ccc([N+](=O)[O-])c4cccnc43)C2)N1	ZINC000279071616	443508953	/nfs/dbraw/zinc/50/89/53/443508953.db2.gz	LUMGUWJLUJHGDW-INIZCTEOSA-N	-1	3	341.327	1.321	20	5		EDBDHM
Cc1cc(N2CCC[C@H]2C[C@@]2(C)NC(=O)[N-]C2=O)ccc1[N+](=O)[O-]	ZINC000286183805	443663352	/nfs/dbraw/zinc/66/33/52/443663352.db2.gz	AAGWMIOMHLUNAI-BLLLJJGKSA-N	-1	3	332.360	1.860	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](CO)C(C)(C)C)c1[N+](=O)[O-]	ZINC000276915455	443872875	/nfs/dbraw/zinc/87/28/75/443872875.db2.gz	XYBIAJGBMPRZOP-NSHDSACASA-N	-1	3	330.406	1.897	20	5		EDBDHM
COc1cc(CN[C@@H](CO)C[C@H](O)C(C)(C)C)c([N+](=O)[O-])cc1[O-]	ZINC000570806587	321358620	/nfs/dbraw/zinc/35/86/20/321358620.db2.gz	GNBVHVWVWPNWRT-ABAIWWIYSA-N	-1	3	342.392	1.557	20	5		EDBDHM
O=[N+]([O-])c1cc(Br)cnc1[N-]c1cnn(CCO)c1	ZINC000301687206	444185729	/nfs/dbraw/zinc/18/57/29/444185729.db2.gz	MCEUSFFPVWEUBV-UHFFFAOYSA-N	-1	3	328.126	1.685	20	5		EDBDHM
CC(C)(C)NC(=O)C[N-]c1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000301941494	444197382	/nfs/dbraw/zinc/19/73/82/444197382.db2.gz	WVOVSCNXXBMDNA-UHFFFAOYSA-N	-1	3	335.407	1.386	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CCC[C@H](O)C1	ZINC000323724083	444346163	/nfs/dbraw/zinc/34/61/63/444346163.db2.gz	OKAUKTUUBTZZHP-JQWIXIFHSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CC[C@H](OC)C1	ZINC000331022140	444362558	/nfs/dbraw/zinc/36/25/58/444362558.db2.gz	YZSBXGLDYJCNIC-ONGXEEELSA-N	-1	3	330.362	1.449	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H]1CCC[C@H](CO)C1	ZINC000320228901	444328931	/nfs/dbraw/zinc/32/89/31/444328931.db2.gz	HHLFWHSPQJUHIQ-NEPJUHHUSA-N	-1	3	328.390	1.672	20	5		EDBDHM
O=C1C[C@H]([N-]c2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]2CCCCN12	ZINC000337801963	444414732	/nfs/dbraw/zinc/41/47/32/444414732.db2.gz	IUSVVFVDNIXCTM-QWHCGFSZSA-N	-1	3	343.343	2.210	20	5		EDBDHM
CCCCS(=O)(=O)[N-]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000340584286	444449638	/nfs/dbraw/zinc/44/96/38/444449638.db2.gz	QBVRPOKMTHWKCU-UHFFFAOYSA-N	-1	3	340.361	1.864	20	5		EDBDHM
Cc1noc(C(C)(C)[N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)n1	ZINC000340734226	444493379	/nfs/dbraw/zinc/49/33/79/444493379.db2.gz	KVNITKREOMNXFE-UHFFFAOYSA-N	-1	3	340.361	1.641	20	5		EDBDHM
CC(C)c1ccc(CN2CCN3C(=O)[N-]C(=O)[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000332582433	444520116	/nfs/dbraw/zinc/52/01/16/444520116.db2.gz	BBAFTIPEMCXKCC-AWEZNQCLSA-N	-1	3	332.360	1.454	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CCCS1	ZINC000340889417	444560759	/nfs/dbraw/zinc/56/07/59/444560759.db2.gz	SVZZCSCBKHSISD-SNVBAGLBSA-N	-1	3	332.403	1.777	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1)c1nnc2n1CCC2	ZINC000341688316	444948857	/nfs/dbraw/zinc/94/88/57/444948857.db2.gz	JGKDWBVNLCFPIQ-ZETCQYMHSA-N	-1	3	343.390	1.234	20	5		EDBDHM
COC(=O)c1cccc2nc(NC(=O)Cn3ccc([N+](=O)[O-])n3)[n-]c21	ZINC000344446101	444977275	/nfs/dbraw/zinc/97/72/75/444977275.db2.gz	MJUPFQRLUODDQV-UHFFFAOYSA-N	-1	3	344.287	1.093	20	5		EDBDHM
COC(=O)c1cccc2[n-]c(NC(=O)Cn3ccc([N+](=O)[O-])n3)nc21	ZINC000344446101	444977279	/nfs/dbraw/zinc/97/72/79/444977279.db2.gz	MJUPFQRLUODDQV-UHFFFAOYSA-N	-1	3	344.287	1.093	20	5		EDBDHM
CCN1CCC[C@H](C[N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000330432126	444979521	/nfs/dbraw/zinc/97/95/21/444979521.db2.gz	JYLAYWLTKNTPIN-LLVKDONJSA-N	-1	3	345.396	1.744	20	5		EDBDHM
CS[C@@H]1CN(C(=O)c2cc([O-])ccc2[N+](=O)[O-])C[C@H]1N(C)C	ZINC000330603842	445057389	/nfs/dbraw/zinc/05/73/89/445057389.db2.gz	KORFRNBDSCCDMB-CHWSQXEVSA-N	-1	3	325.390	1.418	20	5		EDBDHM
O=C(Nc1ccc(Cn2ccnc2)cn1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000343359968	445209395	/nfs/dbraw/zinc/20/93/95/445209395.db2.gz	KLDJAGDQVJTALT-UHFFFAOYSA-N	-1	3	340.299	1.588	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C2CCC(C(N)=O)CC2)c([N+](=O)[O-])c1	ZINC000354505240	445268214	/nfs/dbraw/zinc/26/82/14/445268214.db2.gz	XFIUDEAJDHMEPC-UHFFFAOYSA-N	-1	3	341.389	1.226	20	5		EDBDHM
CCCC[C@@H]([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)C(=O)OC	ZINC000354703854	445345956	/nfs/dbraw/zinc/34/59/56/445345956.db2.gz	HJJBURBIQVXFNK-CYBMUJFWSA-N	-1	3	344.389	1.746	20	5		EDBDHM
CNC(=O)c1ccc(NCc2nnc(C(F)(F)F)[n-]2)c([N+](=O)[O-])c1	ZINC000359691348	445378130	/nfs/dbraw/zinc/37/81/30/445378130.db2.gz	YYYYYVWHGOVJNI-UHFFFAOYSA-N	-1	3	344.253	1.703	20	5		EDBDHM
CNC(=O)c1ccc(NCc2n[n-]c(C(F)(F)F)n2)c([N+](=O)[O-])c1	ZINC000359691348	445378135	/nfs/dbraw/zinc/37/81/35/445378135.db2.gz	YYYYYVWHGOVJNI-UHFFFAOYSA-N	-1	3	344.253	1.703	20	5		EDBDHM
CNC(=O)c1ccc(NCc2nc(C(F)(F)F)n[n-]2)c([N+](=O)[O-])c1	ZINC000359691348	445378139	/nfs/dbraw/zinc/37/81/39/445378139.db2.gz	YYYYYVWHGOVJNI-UHFFFAOYSA-N	-1	3	344.253	1.703	20	5		EDBDHM
CCO[C@@H]1C[C@H]([N-]c2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]1OC	ZINC000362675492	445493679	/nfs/dbraw/zinc/49/36/79/445493679.db2.gz	SHNMJXXRZBGTEY-YNEHKIRRSA-N	-1	3	334.332	2.249	20	5		EDBDHM
CCN1CC[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000359945759	445499365	/nfs/dbraw/zinc/49/93/65/445499365.db2.gz	SUDNZSDNLSMRJK-SECBINFHSA-N	-1	3	333.797	1.621	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]c1cc(C)c(=O)n(C)c1	ZINC000362856823	445582936	/nfs/dbraw/zinc/58/29/36/445582936.db2.gz	SULWAJAAQCXCIW-UHFFFAOYSA-N	-1	3	337.357	1.711	20	5		EDBDHM
O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)NCc1ncccc1[O-]	ZINC000350093078	445767715	/nfs/dbraw/zinc/76/77/15/445767715.db2.gz	WQKUHACPXVGKKI-UHFFFAOYSA-N	-1	3	342.315	1.571	20	5		EDBDHM
COc1cc(C(=O)Nc2c(C)[nH]c(=O)[n-]c2=O)cc([N+](=O)[O-])c1C	ZINC000358843956	445805994	/nfs/dbraw/zinc/80/59/94/445805994.db2.gz	VNKIUJQMDBTXHP-UHFFFAOYSA-N	-1	3	334.288	1.674	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@H]1CCN(C2CC2)C1	ZINC000354281472	446079451	/nfs/dbraw/zinc/07/94/51/446079451.db2.gz	KKQIDQUURCPCBV-JTQLQIEISA-N	-1	3	345.808	1.763	20	5		EDBDHM
CC(=O)NCc1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc1	ZINC000444997174	447153731	/nfs/dbraw/zinc/15/37/31/447153731.db2.gz	NCZZHDDMROFMFE-UHFFFAOYSA-N	-1	3	330.300	1.584	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2nc(C)c(C(=O)OC)s2)n1	ZINC000427106075	447544797	/nfs/dbraw/zinc/54/47/97/447544797.db2.gz	DBIFDEXBWASRJU-UHFFFAOYSA-N	-1	3	339.333	1.615	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CS[C@@H](C)C1	ZINC000416593919	447656294	/nfs/dbraw/zinc/65/62/94/447656294.db2.gz	PNDYLZAQWVQVEO-DTWKUNHWSA-N	-1	3	332.403	1.776	20	5		EDBDHM
Cc1nnc([C@@H](C)[N-]S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)o1	ZINC000531839639	448157290	/nfs/dbraw/zinc/15/72/90/448157290.db2.gz	XVCDZYSXLPKJOS-SECBINFHSA-N	-1	3	340.361	1.943	20	5		EDBDHM
Cc1nnc([C@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)o1	ZINC000531585905	448111329	/nfs/dbraw/zinc/11/13/29/448111329.db2.gz	NDFXZBHEJLCNBE-QMMMGPOBSA-N	-1	3	326.334	1.634	20	5		EDBDHM
Cc1cc(N2CCN(CC(C)(C)O)CC2)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000566292077	448437041	/nfs/dbraw/zinc/43/70/41/448437041.db2.gz	XBBUUZHOQISJMJ-UHFFFAOYSA-N	-1	3	337.376	1.494	20	5		EDBDHM
CC[C@@H](C)C[C@@H](CO)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000592081734	448668056	/nfs/dbraw/zinc/66/80/56/448668056.db2.gz	CFRMLNFPHDQFME-PWSUYJOCSA-N	-1	3	330.406	1.979	20	5		EDBDHM
O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCc2c(=O)[n-]cnc2C1	ZINC000574843359	448968433	/nfs/dbraw/zinc/96/84/33/448968433.db2.gz	SUVTZZKHKFBJEK-UHFFFAOYSA-N	-1	3	346.368	1.767	20	5		EDBDHM
COc1cc(C(=O)[N-]c2nnc(C3CC3)n2C)c([N+](=O)[O-])cc1OC	ZINC000597898311	449137950	/nfs/dbraw/zinc/13/79/50/449137950.db2.gz	ZKYGYOOCSXMRRJ-UHFFFAOYSA-N	-1	3	347.331	1.870	20	5		EDBDHM
CC(C)c1[nH]nc(C(=O)[N-]c2n[nH]c3[nH]c(=O)ccc23)c1[N+](=O)[O-]	ZINC000590390103	449144829	/nfs/dbraw/zinc/14/48/29/449144829.db2.gz	SGECMZOTKBAAHF-UHFFFAOYSA-N	-1	3	331.292	1.671	20	5		EDBDHM
CCOc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)N1CCCOCC1	ZINC000593213747	449173249	/nfs/dbraw/zinc/17/32/49/449173249.db2.gz	VQFZKNYKPSCILN-UHFFFAOYSA-N	-1	3	345.377	1.373	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2cccc(C(=O)OC)c2OC)n1	ZINC000593284959	449206131	/nfs/dbraw/zinc/20/61/31/449206131.db2.gz	MWDZMNRXDVNIGY-UHFFFAOYSA-N	-1	3	348.315	1.859	20	5		EDBDHM
O=[N+]([O-])c1ccc([O-])cc1CN1CCCN(C[C@H]2CCCO2)CC1	ZINC000611254010	449238622	/nfs/dbraw/zinc/23/86/22/449238622.db2.gz	DNWLZSMXHGEQQB-MRXNPFEDSA-N	-1	3	335.404	1.987	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H](CCO)C2CCCCC2)nc1	ZINC000593553754	449344629	/nfs/dbraw/zinc/34/46/29/449344629.db2.gz	PDNGJCDGWJDJLE-CYBMUJFWSA-N	-1	3	343.405	1.599	20	5		EDBDHM
Cc1noc(C)c1[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593545444	449337726	/nfs/dbraw/zinc/33/77/26/449337726.db2.gz	SLAOFYFQDYSOHP-QMMMGPOBSA-N	-1	3	326.334	1.634	20	5		EDBDHM
CO[C@@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)c2cccc([N+](=O)[O-])c2[O-])C1	ZINC000600629796	449465691	/nfs/dbraw/zinc/46/56/91/449465691.db2.gz	VRPMSRHXTHBERG-KWCYVHTRSA-N	-1	3	349.387	1.672	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)N1CCC(OC)CC1	ZINC000594695418	449628340	/nfs/dbraw/zinc/62/83/40/449628340.db2.gz	FYFIXKJEAGOYNS-UHFFFAOYSA-N	-1	3	345.377	1.371	20	5		EDBDHM
C[C@@H]1C[C@@H]([N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])c2ncnn21	ZINC000594808608	449720645	/nfs/dbraw/zinc/72/06/45/449720645.db2.gz	MPDDQCQRKLLAIW-MWLCHTKSSA-N	-1	3	337.361	1.312	20	5		EDBDHM
COc1cc(CNC[C@H](OC)[C@@H]2CCOC2)c([N+](=O)[O-])cc1[O-]	ZINC000594949513	449818388	/nfs/dbraw/zinc/81/83/88/449818388.db2.gz	DHFVPKITWXVQLE-BMIGLBTASA-N	-1	3	326.349	1.450	20	5		EDBDHM
Cc1nc(C)c(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2C)o1	ZINC000599316498	449886586	/nfs/dbraw/zinc/88/65/86/449886586.db2.gz	IMYKSSBFCVYXPV-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
CC[C@@H](C)N(C)CC[N-]S(=O)(=O)c1cc(C)sc1[N+](=O)[O-]	ZINC000601338643	449847300	/nfs/dbraw/zinc/84/73/00/449847300.db2.gz	JSPDEUUWWLKKBS-SECBINFHSA-N	-1	3	335.451	1.973	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@]23C[C@H]2COC3(C)C)c([N+](=O)[O-])c1	ZINC000599397301	449943447	/nfs/dbraw/zinc/94/34/47/449943447.db2.gz	OUMUQAFLQJGKHJ-LKFCYVNXSA-N	-1	3	342.373	1.449	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN2CC=C(C)CC2)c([N+](=O)[O-])s1	ZINC000601392976	449907065	/nfs/dbraw/zinc/90/70/65/449907065.db2.gz	XQLLPEZHBJDUOW-UHFFFAOYSA-N	-1	3	345.446	1.895	20	5		EDBDHM
CC[C@]1([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)CCOC1	ZINC000601402469	449918354	/nfs/dbraw/zinc/91/83/54/449918354.db2.gz	NDAPKMQIJCHIMT-ZDUSSCGKSA-N	-1	3	332.353	1.890	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN2CC=CCC2)c([N+](=O)[O-])s1	ZINC000601406512	449922246	/nfs/dbraw/zinc/92/22/46/449922246.db2.gz	CJNBKWGTQCRZAC-UHFFFAOYSA-N	-1	3	331.419	1.505	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2CCN2C2CCCC2)nc1	ZINC000599464214	449996535	/nfs/dbraw/zinc/99/65/35/449996535.db2.gz	KHGSYFGJDAFLSD-GFCCVEGCSA-N	-1	3	340.405	1.285	20	5		EDBDHM
CCC[C@@H](C)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000609121031	449961494	/nfs/dbraw/zinc/96/14/94/449961494.db2.gz	XFIMQTLZOBPHLU-SECBINFHSA-N	-1	3	330.362	1.833	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2C[C@H]2c2ccsc2)nc1	ZINC000599468366	449998252	/nfs/dbraw/zinc/99/82/52/449998252.db2.gz	FBJKFPPUIJRJBQ-WDEREUQCSA-N	-1	3	325.371	1.886	20	5		EDBDHM
O=[N+]([O-])c1ncccc1S(=O)(=O)[N-]CCCN1CCCCC1	ZINC000610259635	450172651	/nfs/dbraw/zinc/17/26/51/450172651.db2.gz	AMWBCMQASSAEKJ-UHFFFAOYSA-N	-1	3	328.394	1.144	20	5		EDBDHM
Cc1ccc([C@H](C)NC(=O)CC[C@@H]2NC(=O)[N-]C2=O)cc1[N+](=O)[O-]	ZINC000610599272	450270486	/nfs/dbraw/zinc/27/04/86/450270486.db2.gz	GIHAYXSCCOPOFY-ONGXEEELSA-N	-1	3	334.332	1.069	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)nc1=N	ZINC000619871479	450348426	/nfs/dbraw/zinc/34/84/26/450348426.db2.gz	KBCBABWPIQDYHR-LBPRGKRZSA-N	-1	3	330.348	1.042	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1CCCSC1	ZINC000619489363	450488182	/nfs/dbraw/zinc/48/81/82/450488182.db2.gz	XCDGIFQBYLPWDL-SECBINFHSA-N	-1	3	332.403	1.777	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](CO)C(C)(C)C	ZINC000619499320	450492907	/nfs/dbraw/zinc/49/29/07/450492907.db2.gz	QVUXCJAWTPUNAQ-NSHDSACASA-N	-1	3	332.378	1.289	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cc3nnn[n-]3)cc2)n1	ZINC000427624357	491003772	/nfs/dbraw/zinc/00/37/72/491003772.db2.gz	ZONNXVUURXMOFT-UHFFFAOYSA-N	-1	3	342.319	1.167	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cc3nn[n-]n3)cc2)n1	ZINC000427624357	491003773	/nfs/dbraw/zinc/00/37/73/491003773.db2.gz	ZONNXVUURXMOFT-UHFFFAOYSA-N	-1	3	342.319	1.167	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)[C@H]1CCCO1	ZINC000339450330	535807422	/nfs/dbraw/zinc/80/74/22/535807422.db2.gz	ACVIFQBWLRJWHZ-VXGBXAGGSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CO[C@@H](C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(F)(F)F	ZINC000733320804	578759378	/nfs/dbraw/zinc/75/93/78/578759378.db2.gz	VEQOSLGZZHTNDL-VIFPVBQESA-N	-1	3	342.295	1.759	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])n[nH]1	ZINC000738391952	579188709	/nfs/dbraw/zinc/18/87/09/579188709.db2.gz	RWZIPBYWYPSNQV-UHFFFAOYSA-N	-1	3	338.389	1.976	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])[nH]n1	ZINC000738391952	579188711	/nfs/dbraw/zinc/18/87/11/579188711.db2.gz	RWZIPBYWYPSNQV-UHFFFAOYSA-N	-1	3	338.389	1.976	20	5		EDBDHM
CNC(=O)[C@@H]([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000778049006	580455475	/nfs/dbraw/zinc/45/54/75/580455475.db2.gz	HFFIFYUICXNNMC-NSHDSACASA-N	-1	3	329.303	1.573	20	5		EDBDHM
Cc1cccc(F)c1S(=O)(=O)[N-]N=c1[nH]cccc1[N+](=O)[O-]	ZINC000775284785	580387229	/nfs/dbraw/zinc/38/72/29/580387229.db2.gz	ZDSKUMJJLGMFET-UHFFFAOYSA-N	-1	3	326.309	1.743	20	5		EDBDHM
Cc1cccc(F)c1S(=O)(=O)NN=c1[n-]cccc1[N+](=O)[O-]	ZINC000775284785	580387230	/nfs/dbraw/zinc/38/72/30/580387230.db2.gz	ZDSKUMJJLGMFET-UHFFFAOYSA-N	-1	3	326.309	1.743	20	5		EDBDHM
O=C([N-][C@H](CO)C1CCOCC1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000782744930	580584264	/nfs/dbraw/zinc/58/42/64/580584264.db2.gz	NGVPNIALCTYNFL-CYBMUJFWSA-N	-1	3	344.314	1.590	20	5		EDBDHM
CCCCCCOC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000796272884	580949765	/nfs/dbraw/zinc/94/97/65/580949765.db2.gz	FVYVYPQEMSJVJF-UHFFFAOYSA-N	-1	3	344.389	1.997	20	5		EDBDHM
C[C@H]1CCNC(=O)[C@H]1[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000799428423	581027879	/nfs/dbraw/zinc/02/78/79/581027879.db2.gz	LVOBXXBJPPIUQY-KWQFWETISA-N	-1	3	327.287	1.327	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2COC[C@H]2C2CC2)c([N+](=O)[O-])s1	ZINC000908405770	592482745	/nfs/dbraw/zinc/48/27/45/592482745.db2.gz	LIXJDQITHHRIAW-VHSXEESVSA-N	-1	3	332.403	1.668	20	5		EDBDHM
Cc1cc(C)n(C2CN(c3ncc([N+](=O)[O-])cc3-c3nnn[n-]3)C2)n1	ZINC000737255488	593072749	/nfs/dbraw/zinc/07/27/49/593072749.db2.gz	ILTJLGRWDKFSKL-UHFFFAOYSA-N	-1	3	341.335	1.045	20	5		EDBDHM
Cc1cc(C)n(C2CN(c3ncc([N+](=O)[O-])cc3-c3nn[n-]n3)C2)n1	ZINC000737255488	593072750	/nfs/dbraw/zinc/07/27/50/593072750.db2.gz	ILTJLGRWDKFSKL-UHFFFAOYSA-N	-1	3	341.335	1.045	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@H](C)OC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)on1	ZINC000838280748	593148947	/nfs/dbraw/zinc/14/89/47/593148947.db2.gz	GNOMMLRJBKFWFA-ZANVPECISA-N	-1	3	349.299	1.495	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@H](C)OC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)on1	ZINC000838280745	593149002	/nfs/dbraw/zinc/14/90/02/593149002.db2.gz	GNOMMLRJBKFWFA-TVQRCGJNSA-N	-1	3	349.299	1.495	20	5		EDBDHM
COCCCO[N-]C(=O)Cc1ccc([N+](=O)[O-])cc1Br	ZINC000805045155	593328989	/nfs/dbraw/zinc/32/89/89/593328989.db2.gz	JYTUCHLOZNFFCF-UHFFFAOYSA-N	-1	3	347.165	1.984	20	5		EDBDHM
CN(C)CCN(CC(=O)[O-])C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000820539642	593827647	/nfs/dbraw/zinc/82/76/47/593827647.db2.gz	UWNORDDQQXJQGC-UHFFFAOYSA-N	-1	3	345.302	1.161	20	5		EDBDHM
Cc1cn2cc(Nc3nccc(-c4nnn[n-]4)c3[N+](=O)[O-])ccc2n1	ZINC000822388909	594042092	/nfs/dbraw/zinc/04/20/92/594042092.db2.gz	FZIXMOARPGRMDH-UHFFFAOYSA-N	-1	3	337.303	1.870	20	5		EDBDHM
Cc1cn2cc(Nc3nccc(-c4nn[n-]n4)c3[N+](=O)[O-])ccc2n1	ZINC000822388909	594042093	/nfs/dbraw/zinc/04/20/93/594042093.db2.gz	FZIXMOARPGRMDH-UHFFFAOYSA-N	-1	3	337.303	1.870	20	5		EDBDHM
C[C@H](OC(=O)c1c([N+](=O)[O-])cnn1C)c1ccc(-c2nnn[n-]2)cc1	ZINC000824713968	594060978	/nfs/dbraw/zinc/06/09/78/594060978.db2.gz	LPLZMXLUHPBFMY-QMMMGPOBSA-N	-1	3	343.303	1.426	20	5		EDBDHM
C[C@H](OC(=O)c1c([N+](=O)[O-])cnn1C)c1ccc(-c2nn[n-]n2)cc1	ZINC000824713968	594060980	/nfs/dbraw/zinc/06/09/80/594060980.db2.gz	LPLZMXLUHPBFMY-QMMMGPOBSA-N	-1	3	343.303	1.426	20	5		EDBDHM
O=C1CN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])[C@H]2CCCC[C@H]2N1	ZINC000823535805	594215024	/nfs/dbraw/zinc/21/50/24/594215024.db2.gz	IADIOIPKLZMJBV-MNOVXSKESA-N	-1	3	343.347	1.022	20	5		EDBDHM
O=C1CN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])[C@H]2CCCC[C@H]2N1	ZINC000823535805	594215025	/nfs/dbraw/zinc/21/50/25/594215025.db2.gz	IADIOIPKLZMJBV-MNOVXSKESA-N	-1	3	343.347	1.022	20	5		EDBDHM
O=[N+]([O-])c1c(-c2nnn[n-]2)ccnc1N1CCN(C2CCCC2)CC1	ZINC000823620219	594221860	/nfs/dbraw/zinc/22/18/60/594221860.db2.gz	IHYPLDWBTQHOSV-UHFFFAOYSA-N	-1	3	344.379	1.235	20	5		EDBDHM
O=[N+]([O-])c1c(-c2nn[n-]n2)ccnc1N1CCN(C2CCCC2)CC1	ZINC000823620219	594221861	/nfs/dbraw/zinc/22/18/61/594221861.db2.gz	IHYPLDWBTQHOSV-UHFFFAOYSA-N	-1	3	344.379	1.235	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCOC[C@@H]1c1ccco1	ZINC000823629807	594222918	/nfs/dbraw/zinc/22/29/18/594222918.db2.gz	HUOWXILJOLJLEW-CYBMUJFWSA-N	-1	3	342.315	1.946	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCOC[C@@H]1c1ccco1	ZINC000823629807	594222919	/nfs/dbraw/zinc/22/29/19/594222919.db2.gz	HUOWXILJOLJLEW-CYBMUJFWSA-N	-1	3	342.315	1.946	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCOCc2ccccc2)c(-c2nnn[n-]2)c1	ZINC000823651502	594224761	/nfs/dbraw/zinc/22/47/61/594224761.db2.gz	MMBRJOWQGLXGKS-UHFFFAOYSA-N	-1	3	341.331	1.799	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCOCc2ccccc2)c(-c2nn[n-]n2)c1	ZINC000823651502	594224762	/nfs/dbraw/zinc/22/47/62/594224762.db2.gz	MMBRJOWQGLXGKS-UHFFFAOYSA-N	-1	3	341.331	1.799	20	5		EDBDHM
O=[N+]([O-])c1cnn(Cc2ccc(-c3nnn[n-]3)cc2OC(F)F)c1	ZINC000823652315	594224961	/nfs/dbraw/zinc/22/49/61/594224961.db2.gz	ZQUYVJLFBIYGFK-UHFFFAOYSA-N	-1	3	337.246	1.621	20	5		EDBDHM
O=[N+]([O-])c1cnn(Cc2ccc(-c3nn[n-]n3)cc2OC(F)F)c1	ZINC000823652315	594224962	/nfs/dbraw/zinc/22/49/62/594224962.db2.gz	ZQUYVJLFBIYGFK-UHFFFAOYSA-N	-1	3	337.246	1.621	20	5		EDBDHM
Nc1ccc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c([O-])c1	ZINC000829938074	594296204	/nfs/dbraw/zinc/29/62/04/594296204.db2.gz	RVVBVOMTCGBPNY-LLVKDONJSA-N	-1	3	343.343	1.604	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCNc2cnccc2-c2nnn[n-]2)cc1	ZINC000826499050	594502747	/nfs/dbraw/zinc/50/27/47/594502747.db2.gz	TXVKCAGBNVEYGK-UHFFFAOYSA-N	-1	3	326.320	1.694	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCNc2cnccc2-c2nn[n-]n2)cc1	ZINC000826499050	594502750	/nfs/dbraw/zinc/50/27/50/594502750.db2.gz	TXVKCAGBNVEYGK-UHFFFAOYSA-N	-1	3	326.320	1.694	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCn3ccnc32)c(Cl)c1	ZINC000831739081	594697962	/nfs/dbraw/zinc/69/79/62/594697962.db2.gz	QHJALCDPKXGEJR-JTQLQIEISA-N	-1	3	342.764	1.868	20	5		EDBDHM
CCOC(=O)[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000832455352	594751634	/nfs/dbraw/zinc/75/16/34/594751634.db2.gz	DWIWKSATPASBDE-ZJUUUORDSA-N	-1	3	348.402	1.666	20	5		EDBDHM
COC(=O)[C@@H](C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)CC1CC1	ZINC000845992518	595116156	/nfs/dbraw/zinc/11/61/56/595116156.db2.gz	QLGFVOPRORIKRI-SECBINFHSA-N	-1	3	348.402	1.524	20	5		EDBDHM
C[C@@H](Cn1ccnc1)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848580686	595408489	/nfs/dbraw/zinc/40/84/89/595408489.db2.gz	DXUVWGWEXGTRHY-JTQLQIEISA-N	-1	3	340.286	1.968	20	5		EDBDHM
C[C@](O)(C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000848582358	595408580	/nfs/dbraw/zinc/40/85/80/595408580.db2.gz	BKEWTBBSSHSKNR-ZDUSSCGKSA-N	-1	3	330.287	1.844	20	5		EDBDHM
O=C([N-]C[C@@H](O)C1CCC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848590678	595411297	/nfs/dbraw/zinc/41/12/97/595411297.db2.gz	HEGMDIMWKAUDGP-GFCCVEGCSA-N	-1	3	330.287	1.844	20	5		EDBDHM
C[C@H]([N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C	ZINC000848592279	595411828	/nfs/dbraw/zinc/41/18/28/595411828.db2.gz	HNRMSFQXDFYASG-QMMMGPOBSA-N	-1	3	331.275	1.159	20	5		EDBDHM
CCN1C[C@H]([N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)CC1=O	ZINC000848591793	595411849	/nfs/dbraw/zinc/41/18/49/595411849.db2.gz	OFJNXHNURIHTGJ-SECBINFHSA-N	-1	3	343.286	1.303	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])N1CCCCC1	ZINC000849371798	595514647	/nfs/dbraw/zinc/51/46/47/595514647.db2.gz	WJLWAIOWVFAPHQ-LLVKDONJSA-N	-1	3	328.394	1.143	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-][C@@H]1COC2(CCC2)C1	ZINC000849448486	595529787	/nfs/dbraw/zinc/52/97/87/595529787.db2.gz	ZITPSGZEGGZLIM-LBPRGKRZSA-N	-1	3	326.374	1.726	20	5		EDBDHM
CSc1ccc([N+](=O)[O-])c(C(=O)[N-]OCCN2CCCC2=O)c1	ZINC000856038184	595880842	/nfs/dbraw/zinc/88/08/42/595880842.db2.gz	ZZJQZUJYJWXSIA-UHFFFAOYSA-N	-1	3	339.373	1.601	20	5		EDBDHM
Cn1cccc([N-]S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1=O	ZINC000114119638	595950273	/nfs/dbraw/zinc/95/02/73/595950273.db2.gz	ATMONRIMDMUUAZ-UHFFFAOYSA-N	-1	3	343.748	1.748	20	5		EDBDHM
O=C([O-])[C@]12COC[C@H]1CN(Cc1ccc([N+](=O)[O-])c(Cl)c1)C2	ZINC000854243250	596012989	/nfs/dbraw/zinc/01/29/89/596012989.db2.gz	ZJSUPYGSFVQHDH-QMTHXVAHSA-N	-1	3	326.736	1.781	20	5		EDBDHM
CCOCCO[N-]C(=O)Cc1ccc(Br)c([N+](=O)[O-])c1	ZINC000867490826	596395105	/nfs/dbraw/zinc/39/51/05/596395105.db2.gz	CRDZAHAFNJPUMZ-UHFFFAOYSA-N	-1	3	347.165	1.984	20	5		EDBDHM
C[C@@H]1C[C@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CN1C1CC1	ZINC000119953939	596797554	/nfs/dbraw/zinc/79/75/54/596797554.db2.gz	HUXKPGRQLFIOEC-BDAKNGLRSA-N	-1	3	331.419	1.560	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCC[C@H](C2OCCO2)C1	ZINC000738358824	598313867	/nfs/dbraw/zinc/31/38/67/598313867.db2.gz	OXYLCRONQKNKFO-NSHDSACASA-N	-1	3	346.347	1.364	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCC[C@H](C2OCCO2)C1	ZINC000738358824	598313869	/nfs/dbraw/zinc/31/38/69/598313869.db2.gz	OXYLCRONQKNKFO-NSHDSACASA-N	-1	3	346.347	1.364	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCC[C@H](n2cncn2)C1	ZINC000738357586	598340755	/nfs/dbraw/zinc/34/07/55/598340755.db2.gz	FUVMFIHOHWJPEC-NSHDSACASA-N	-1	3	341.335	1.208	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCC[C@H](n2cncn2)C1	ZINC000738357586	598340756	/nfs/dbraw/zinc/34/07/56/598340756.db2.gz	FUVMFIHOHWJPEC-NSHDSACASA-N	-1	3	341.335	1.208	20	5		EDBDHM
CCn1cc(S(=O)(=O)[N-]c2c(F)cccc2F)c([N+](=O)[O-])n1	ZINC000435726892	305146380	/nfs/dbraw/zinc/14/63/80/305146380.db2.gz	CAFYCUKYXKFENP-UHFFFAOYSA-N	-1	3	332.288	1.890	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCCC[C@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000125074040	138331805	/nfs/dbraw/zinc/33/18/05/138331805.db2.gz	VWFWHMJZCFPHCC-RKDXNWHRSA-N	-1	3	347.418	1.287	20	5		EDBDHM
Cn1ncc2c1ncc(C(=O)NCc1ccc([N+](=O)[O-])cc1)c2[O-]	ZINC000132595657	138379455	/nfs/dbraw/zinc/37/94/55/138379455.db2.gz	FOYYPLKKVGGLTL-UHFFFAOYSA-N	-1	3	327.300	1.512	20	5		EDBDHM
COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(-c3nccn3C)[n-]n2)c1	ZINC000119738659	201080446	/nfs/dbraw/zinc/08/04/46/201080446.db2.gz	VBZXAXGJSYLPIL-UHFFFAOYSA-N	-1	3	342.315	1.979	20	5		EDBDHM
COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(-c3nccn3C)n[n-]2)c1	ZINC000119738659	201080449	/nfs/dbraw/zinc/08/04/49/201080449.db2.gz	VBZXAXGJSYLPIL-UHFFFAOYSA-N	-1	3	342.315	1.979	20	5		EDBDHM
CC1CCN(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)CC1	ZINC000066333458	201158220	/nfs/dbraw/zinc/15/82/20/201158220.db2.gz	LXTLQXGBGLMYQJ-UHFFFAOYSA-N	-1	3	333.435	1.667	20	5		EDBDHM
CCC(C)(C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC	ZINC000273204952	201254993	/nfs/dbraw/zinc/25/49/93/201254993.db2.gz	SUSAGHKKEBMDSQ-UHFFFAOYSA-N	-1	3	330.362	1.848	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](CO)C1CCCC1	ZINC000289459204	201338108	/nfs/dbraw/zinc/33/81/08/201338108.db2.gz	GTAZBRBBUUFOOY-GFCCVEGCSA-N	-1	3	344.389	1.433	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CCC[C@]2(C)CO)c([N+](=O)[O-])c1	ZINC000132720901	223357738	/nfs/dbraw/zinc/35/77/38/223357738.db2.gz	NPMKJTPDALNVDO-UONOGXRCSA-N	-1	3	328.390	1.733	20	5		EDBDHM
CS[C@H](CO)[C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000223589198	139021249	/nfs/dbraw/zinc/02/12/49/139021249.db2.gz	WBYZPMBYHQCQDJ-GMSGAONNSA-N	-1	3	338.382	1.125	20	5		EDBDHM
CCC(=O)N1CC[C@H]([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000133192668	205359392	/nfs/dbraw/zinc/35/93/92/205359392.db2.gz	KDDFWJVGVNBMJM-NSHDSACASA-N	-1	3	341.389	1.192	20	5		EDBDHM
CN(C)c1ncccc1[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000187732659	272952269	/nfs/dbraw/zinc/95/22/69/272952269.db2.gz	UPURCIDVWGUASY-UHFFFAOYSA-N	-1	3	336.373	1.998	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1CCC(C)(C)O1	ZINC000494276401	255243992	/nfs/dbraw/zinc/24/39/92/255243992.db2.gz	IIFQYOFMFVBUHB-NSHDSACASA-N	-1	3	344.389	1.839	20	5		EDBDHM
CCOc1cccc(N2CCN(C(C)(C)C(=O)[O-])CC2)c1[N+](=O)[O-]	ZINC000571288153	306561429	/nfs/dbraw/zinc/56/14/29/306561429.db2.gz	QCVHHNYPCKEGDM-UHFFFAOYSA-N	-1	3	337.376	1.979	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H](O)CC(C)(C)C	ZINC000269828853	140001959	/nfs/dbraw/zinc/00/19/59/140001959.db2.gz	XEZNDNXXUBKHKH-LLVKDONJSA-N	-1	3	346.405	1.679	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])CC1	ZINC000270801725	140171806	/nfs/dbraw/zinc/17/18/06/140171806.db2.gz	JQFIHOJZTGOIQK-UHFFFAOYSA-N	-1	3	328.346	1.196	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCO[C@@H](C)C1	ZINC000271248595	140263894	/nfs/dbraw/zinc/26/38/94/140263894.db2.gz	JYEBQJWMSMNIBO-VHSXEESVSA-N	-1	3	330.362	1.449	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CCO[C@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000340605928	142442949	/nfs/dbraw/zinc/44/29/49/142442949.db2.gz	WUASJXYRPXLACC-FZMZJTMJSA-N	-1	3	326.374	1.749	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)n[nH]1	ZINC000416486210	304323388	/nfs/dbraw/zinc/32/33/88/304323388.db2.gz	DNPHHKGEIJVMAO-UHFFFAOYSA-N	-1	3	339.377	1.371	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CC[C@@H](F)C1	ZINC000344921273	143026968	/nfs/dbraw/zinc/02/69/68/143026968.db2.gz	UOVLSJNHOXHHCZ-BDAKNGLRSA-N	-1	3	346.336	1.550	20	5		EDBDHM
COCc1nc(Sc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])n[n-]1	ZINC000345175206	143061232	/nfs/dbraw/zinc/06/12/32/143061232.db2.gz	QCSQYJRQQKCNTQ-UHFFFAOYSA-N	-1	3	344.374	1.414	20	5		EDBDHM
CCN1CCC([N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])CC1	ZINC000345354364	143081553	/nfs/dbraw/zinc/08/15/53/143081553.db2.gz	MBQCWUWPDOJWEJ-UHFFFAOYSA-N	-1	3	341.433	1.974	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1ccc[nH]1	ZINC000345485381	143096898	/nfs/dbraw/zinc/09/68/98/143096898.db2.gz	XNRWCBNTJJIIHO-UHFFFAOYSA-N	-1	3	339.329	1.188	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H](C)C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000416625748	304338041	/nfs/dbraw/zinc/33/80/41/304338041.db2.gz	SJUKRHZXGVKCME-SSDOTTSWSA-N	-1	3	335.407	1.156	20	5		EDBDHM
O=C([N-]c1n[nH]c(SCCO)n1)c1ccc([N+](=O)[O-])cc1F	ZINC000355419564	150261318	/nfs/dbraw/zinc/26/13/18/150261318.db2.gz	LJHGETLUFSUCMR-UHFFFAOYSA-N	-1	3	327.297	1.189	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCOC1	ZINC000355716213	150371854	/nfs/dbraw/zinc/37/18/54/150371854.db2.gz	QKGHRZRYSRQRGW-VHSXEESVSA-N	-1	3	332.353	1.827	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]Cc2nnc(C3CC3)o2)cc1[N+](=O)[O-]	ZINC000358903938	151538476	/nfs/dbraw/zinc/53/84/76/151538476.db2.gz	NCXTXSLNSVRJSX-UHFFFAOYSA-N	-1	3	344.374	1.704	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CCN(C)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000360654681	152140742	/nfs/dbraw/zinc/14/07/42/152140742.db2.gz	VPKJNSRUGBKCRL-VXGBXAGGSA-N	-1	3	327.406	1.664	20	5		EDBDHM
C/C=C/C[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OCC	ZINC000361421077	152389805	/nfs/dbraw/zinc/38/98/05/152389805.db2.gz	RBCAXDLFKJUOSD-TZNOJPMFSA-N	-1	3	342.373	1.771	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cnc1N1CC(S(=O)(=O)[N-]c2ccccc2)C1	ZINC000364020566	153125144	/nfs/dbraw/zinc/12/51/44/153125144.db2.gz	RBBCHDJAVAAHST-UHFFFAOYSA-N	-1	3	348.384	1.929	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCC(=O)OC(C)C)c1C	ZINC000360167767	292292176	/nfs/dbraw/zinc/29/21/76/292292176.db2.gz	DKYYAHIGYPKIMG-UHFFFAOYSA-N	-1	3	344.389	1.832	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)c1ncc(C)o1	ZINC000352088968	161968187	/nfs/dbraw/zinc/96/81/87/161968187.db2.gz	FTMIQULJKALZGA-VIFPVBQESA-N	-1	3	341.345	1.939	20	5		EDBDHM
COCC[C@@H](COC)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000352531771	292630500	/nfs/dbraw/zinc/63/05/00/292630500.db2.gz	RRHTVDSHNSQWGD-NSHDSACASA-N	-1	3	332.378	1.233	20	5		EDBDHM
CN1CC=C(C[N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000273984803	273064773	/nfs/dbraw/zinc/06/47/73/273064773.db2.gz	QXGRVCXMRDEAMQ-UHFFFAOYSA-N	-1	3	329.353	1.274	20	5		EDBDHM
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H]1OC	ZINC000274729719	273098038	/nfs/dbraw/zinc/09/80/38/273098038.db2.gz	GRTPHTOJISLYAU-WZRBSPASSA-N	-1	3	348.352	1.205	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2CCOC[C@H]2C)c1[N+](=O)[O-]	ZINC000277747539	273222445	/nfs/dbraw/zinc/22/24/45/273222445.db2.gz	KNHQQHIFDRDXLR-NEPJUHHUSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC1(C)CCOCC1	ZINC000267825309	281262147	/nfs/dbraw/zinc/26/21/47/281262147.db2.gz	TUASNAIWUUAIDD-UHFFFAOYSA-N	-1	3	328.390	1.998	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@](C)(OC)C1CC1	ZINC000291789539	289180538	/nfs/dbraw/zinc/18/05/38/289180538.db2.gz	XRPDHYRHVNSBPZ-AWEZNQCLSA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cc1cc(C(=O)N2CCC[C@H]2c2nncn2C)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375103806	301098730	/nfs/dbraw/zinc/09/87/30/301098730.db2.gz	YLGYHMAUKYSCPJ-JTQLQIEISA-N	-1	3	332.320	1.110	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1C[C@@H]2OCCC[C@@H]12	ZINC000249764651	302049274	/nfs/dbraw/zinc/04/92/74/302049274.db2.gz	ICWPCTRIAONJEE-LOWVWBTDSA-N	-1	3	326.374	1.749	20	5		EDBDHM
C[C@H]1CN(C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)CCN(C2CCC2)C1	ZINC000293778040	303017590	/nfs/dbraw/zinc/01/75/90/303017590.db2.gz	VUZNYTGRMZNVEI-LLVKDONJSA-N	-1	3	334.376	1.642	20	5		EDBDHM
COC(=O)c1nc([N-]C(=O)c2n[nH]cc2[N+](=O)[O-])sc1C1CC1	ZINC000430391447	305052313	/nfs/dbraw/zinc/05/23/13/305052313.db2.gz	ZJPOMWWHHPYDPI-UHFFFAOYSA-N	-1	3	337.317	1.691	20	5		EDBDHM
O=C(Nc1ccc(N2CCCC2=O)cn1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000435692008	305145617	/nfs/dbraw/zinc/14/56/17/305145617.db2.gz	IKKUFFQMANLOHJ-UHFFFAOYSA-N	-1	3	343.299	1.470	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000523694390	305812158	/nfs/dbraw/zinc/81/21/58/305812158.db2.gz	ONXWIJGOKLSZRT-JTQLQIEISA-N	-1	3	329.316	1.318	20	5		EDBDHM
O=C(C=Cc1ccccc1[N+](=O)[O-])N1CCc2nc[n-]c(=O)c2C1	ZINC000493687147	447366631	/nfs/dbraw/zinc/36/66/31/447366631.db2.gz	GZVZTCOVFCMKRR-WAYWQWQTSA-N	-1	3	326.312	1.689	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1(C2CC2)CC1	ZINC000542267153	306052668	/nfs/dbraw/zinc/05/26/68/306052668.db2.gz	BOHJWIVAQLFXKK-UHFFFAOYSA-N	-1	3	340.357	1.602	20	5		EDBDHM
O=c1nc(Cn2cccc([N+](=O)[O-])c2=O)[n-]c2sc3c(c21)CCC3	ZINC000102204795	441166913	/nfs/dbraw/zinc/16/69/13/441166913.db2.gz	UJTBMYDEHZKELR-UHFFFAOYSA-N	-1	3	344.352	1.592	20	5		EDBDHM
O=C(COc1ccccc1[N+](=O)[O-])Nc1nnc(-c2ccccn2)[n-]1	ZINC000047343326	441178211	/nfs/dbraw/zinc/17/82/11/441178211.db2.gz	LWQPDXUZPIEMPS-UHFFFAOYSA-N	-1	3	340.299	1.792	20	5		EDBDHM
O=C(COc1ccccc1[N+](=O)[O-])Nc1nc(-c2ccccn2)n[n-]1	ZINC000047343326	441178214	/nfs/dbraw/zinc/17/82/14/441178214.db2.gz	LWQPDXUZPIEMPS-UHFFFAOYSA-N	-1	3	340.299	1.792	20	5		EDBDHM
O=C(COc1ccccc1[N+](=O)[O-])Nc1n[n-]c(-c2ccccn2)n1	ZINC000047343326	441178219	/nfs/dbraw/zinc/17/82/19/441178219.db2.gz	LWQPDXUZPIEMPS-UHFFFAOYSA-N	-1	3	340.299	1.792	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1scnc1C	ZINC000104745617	441203927	/nfs/dbraw/zinc/20/39/27/441203927.db2.gz	QQFPSHDRHOBROT-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCCC(C)(C)CO	ZINC000121706267	441763069	/nfs/dbraw/zinc/76/30/69/441763069.db2.gz	CEPYTCZYQQZAJT-UHFFFAOYSA-N	-1	3	330.406	1.980	20	5		EDBDHM
CCC(CC)[C@@H](O)C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000119155641	441920129	/nfs/dbraw/zinc/92/01/29/441920129.db2.gz	IVQNZISCRCFZHS-ZDUSSCGKSA-N	-1	3	330.406	1.979	20	5		EDBDHM
CC[C@@H](C)[C@H](O)C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000119358648	441930447	/nfs/dbraw/zinc/93/04/47/441930447.db2.gz	VBXJVJYZLJHFGE-NOZJJQNGSA-N	-1	3	330.406	1.897	20	5		EDBDHM
CN(C)CCN(C[C@H]1CCCO1)C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000153678441	442296196	/nfs/dbraw/zinc/29/61/96/442296196.db2.gz	HYALDEBJXFBVEI-GFCCVEGCSA-N	-1	3	337.376	1.483	20	5		EDBDHM
COCCCN1CCC(NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC1	ZINC000171126370	442317002	/nfs/dbraw/zinc/31/70/02/442317002.db2.gz	KFFYCMDGJDQPHL-UHFFFAOYSA-N	-1	3	337.376	1.531	20	5		EDBDHM
O=C(Nc1nncn1-c1ccccc1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000189550312	442976843	/nfs/dbraw/zinc/97/68/43/442976843.db2.gz	OCKOQHWBHNZLFV-UHFFFAOYSA-N	-1	3	326.272	1.528	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCCCNC2=O)cc1C	ZINC000299060744	318872900	/nfs/dbraw/zinc/87/29/00/318872900.db2.gz	SGUBXDRZSXQPFQ-LLVKDONJSA-N	-1	3	341.389	1.159	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CCC[C@@H]1O	ZINC000269307693	443275782	/nfs/dbraw/zinc/27/57/82/443275782.db2.gz	UPUZHCKIKUNIAA-KOLCDFICSA-N	-1	3	330.362	1.043	20	5		EDBDHM
O=C1[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C[C@@H]2CCCCN12	ZINC000416514773	319437847	/nfs/dbraw/zinc/43/78/47/319437847.db2.gz	IUASZROBYICAKF-WDEREUQCSA-N	-1	3	339.373	1.027	20	5		EDBDHM
COCC1(C[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])CCC1	ZINC000282514298	443361947	/nfs/dbraw/zinc/36/19/47/443361947.db2.gz	ZWGYXUFINCYCBB-UHFFFAOYSA-N	-1	3	328.390	1.998	20	5		EDBDHM
CN1CC=C(C[N-]S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1	ZINC000272191825	443552535	/nfs/dbraw/zinc/55/25/35/443552535.db2.gz	FYOHKCHBBGSLAH-UHFFFAOYSA-N	-1	3	345.808	1.788	20	5		EDBDHM
CCOC(CC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])OCC	ZINC000276427858	443702753	/nfs/dbraw/zinc/70/27/53/443702753.db2.gz	WKOOWLJTQYFYLT-UHFFFAOYSA-N	-1	3	332.378	1.662	20	5		EDBDHM
CO[C@H]1C[C@@H](CN2CCCC2)N(C(=O)c2ccc([N+](=O)[O-])cc2[O-])C1	ZINC000285041739	443833822	/nfs/dbraw/zinc/83/38/22/443833822.db2.gz	AIUBVFWNLQRYEW-KBPBESRZSA-N	-1	3	349.387	1.626	20	5		EDBDHM
CCC[C@]1([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)CCOC1	ZINC000285154021	443876126	/nfs/dbraw/zinc/87/61/26/443876126.db2.gz	ADGTZZCCLBWGBH-AWEZNQCLSA-N	-1	3	344.389	1.841	20	5		EDBDHM
COC(=O)c1c[n-]c(C(=O)OC)c1NC(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000297584051	444304653	/nfs/dbraw/zinc/30/46/53/444304653.db2.gz	BWWWVIHBVKPIIQ-UHFFFAOYSA-N	-1	3	341.320	1.362	20	5		EDBDHM
CC[C@@H](C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC	ZINC000316878651	444312906	/nfs/dbraw/zinc/31/29/06/444312906.db2.gz	LNBYKGHXTZQSKX-SECBINFHSA-N	-1	3	330.362	1.706	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@](C)(O)C2CC2)cc1C	ZINC000319463131	444324356	/nfs/dbraw/zinc/32/43/56/444324356.db2.gz	QDTJAUUKIFSHHT-AWEZNQCLSA-N	-1	3	328.390	1.651	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1(CO)CCCC1	ZINC000322864615	444341414	/nfs/dbraw/zinc/34/14/14/444341414.db2.gz	WEGQUDNLENSTIX-UHFFFAOYSA-N	-1	3	344.389	1.434	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)N[C@H]2CCN3CCCC[C@@H]23)ccc1[O-]	ZINC000321396726	444335708	/nfs/dbraw/zinc/33/57/08/444335708.db2.gz	ZCJJSGWOUOXMEJ-RYUDHWBXSA-N	-1	3	341.389	1.206	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CN(C2CC2)C[C@@H]1C	ZINC000331586701	444479312	/nfs/dbraw/zinc/47/93/12/444479312.db2.gz	XFRBLNQDWAQRCE-AAEUAGOBSA-N	-1	3	339.417	1.664	20	5		EDBDHM
Cn1[n-]c([C@H]2CCCN2C(=O)Cc2ccccc2[N+](=O)[O-])nc1=N	ZINC000581442699	322178883	/nfs/dbraw/zinc/17/88/83/322178883.db2.gz	QYSSDHPFPHWKQW-GFCCVEGCSA-N	-1	3	330.348	1.042	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H](OC)C(C)(C)C	ZINC000342304892	444621501	/nfs/dbraw/zinc/62/15/01/444621501.db2.gz	HZMXXAURLSAHKW-ZDUSSCGKSA-N	-1	3	346.405	1.943	20	5		EDBDHM
CO[C@@H]1CCC[C@H]1C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000341213768	444732662	/nfs/dbraw/zinc/73/26/62/444732662.db2.gz	JRCVMFYPUHWZQX-WCQYABFASA-N	-1	3	328.390	1.997	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CN(C(C)C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000342546990	444739553	/nfs/dbraw/zinc/73/95/53/444739553.db2.gz	GECVNUPNYVFLQP-GXSJLCMTSA-N	-1	3	347.462	1.972	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC(C)(C)OC	ZINC000336871735	444816626	/nfs/dbraw/zinc/81/66/26/444816626.db2.gz	HPLAHWNPIXMNFP-UHFFFAOYSA-N	-1	3	346.361	1.085	20	5		EDBDHM
C[C@@]1(c2cccc(NC(=O)c3ccc([N+](=O)[O-])o3)c2)NC(=O)[N-]C1=O	ZINC000342941567	444955578	/nfs/dbraw/zinc/95/55/78/444955578.db2.gz	YQROYEAUZSOIBH-HNNXBMFYSA-N	-1	3	344.283	1.495	20	5		EDBDHM
O=C(Nc1ccc(OCCCO)cc1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000343394815	445215080	/nfs/dbraw/zinc/21/50/80/445215080.db2.gz	AFHCTCQOISQNJQ-UHFFFAOYSA-N	-1	3	333.300	1.709	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H](C)Cn2cccn2)cc1[N+](=O)[O-]	ZINC000343467507	445228015	/nfs/dbraw/zinc/22/80/15/445228015.db2.gz	MPVZCUFXIILRED-QMMMGPOBSA-N	-1	3	330.391	1.528	20	5		EDBDHM
COC(=O)c1cc([N-]C(=O)c2ccc(OC)nn2)cc([N+](=O)[O-])c1	ZINC000348643292	445343135	/nfs/dbraw/zinc/34/31/35/445343135.db2.gz	LTAPGKIKUCBRRN-UHFFFAOYSA-N	-1	3	332.272	1.432	20	5		EDBDHM
CCc1nnc(C[N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)o1	ZINC000357233808	445496564	/nfs/dbraw/zinc/49/65/64/445496564.db2.gz	MQSAIHFGFHRBSN-UHFFFAOYSA-N	-1	3	326.334	1.160	20	5		EDBDHM
CC(C)n1ncnc1C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000357239571	445500383	/nfs/dbraw/zinc/50/03/83/445500383.db2.gz	OYPFPQVUWZSGET-UHFFFAOYSA-N	-1	3	339.377	1.387	20	5		EDBDHM
Cc1cc(C)c(S(=O)(=O)NCc2ncccc2[O-])cc1[N+](=O)[O-]	ZINC000360035938	445539080	/nfs/dbraw/zinc/53/90/80/445539080.db2.gz	CTEUSQHMJVNAKZ-UHFFFAOYSA-N	-1	3	337.357	1.791	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC[C@H](O)C(F)(F)F	ZINC000349976206	445739967	/nfs/dbraw/zinc/73/99/67/445739967.db2.gz	PDORXUIMIAKRTF-VIFPVBQESA-N	-1	3	342.295	1.495	20	5		EDBDHM
COc1cc([N-]C(=O)c2ccc([N+](=O)[O-])o2)cc(S(C)(=O)=O)c1	ZINC000356528171	445842609	/nfs/dbraw/zinc/84/26/09/445842609.db2.gz	ZSKFNUKDVQQHPC-UHFFFAOYSA-N	-1	3	340.313	1.852	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCOCC2CCC2)c([N+](=O)[O-])c1	ZINC000582155707	325786162	/nfs/dbraw/zinc/78/61/62/325786162.db2.gz	FGGDCWSQGMMXMK-UHFFFAOYSA-N	-1	3	328.390	1.998	20	5		EDBDHM
O=C(Nc1cnn(C[C@@H]2CCCO2)c1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000365670400	446294776	/nfs/dbraw/zinc/29/47/76/446294776.db2.gz	SWQLVUQLJMYYMH-NSHDSACASA-N	-1	3	333.304	1.323	20	5		EDBDHM
Cc1cc(C(=O)N2CCC(n3ccnc3)CC2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000367393680	446541239	/nfs/dbraw/zinc/54/12/39/446541239.db2.gz	FWEPOPOJSDDZDQ-UHFFFAOYSA-N	-1	3	331.332	1.678	20	5		EDBDHM
O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1cccc2nn[n-]c21	ZINC000525864631	448042258	/nfs/dbraw/zinc/04/22/58/448042258.db2.gz	OONPSRACYKJRCX-UHFFFAOYSA-N	-1	3	327.300	1.675	20	5		EDBDHM
O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1cccc2[n-]nnc21	ZINC000525864631	448042261	/nfs/dbraw/zinc/04/22/61/448042261.db2.gz	OONPSRACYKJRCX-UHFFFAOYSA-N	-1	3	327.300	1.675	20	5		EDBDHM
O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1cccc2n[n-]nc21	ZINC000525864631	448042265	/nfs/dbraw/zinc/04/22/65/448042265.db2.gz	OONPSRACYKJRCX-UHFFFAOYSA-N	-1	3	327.300	1.675	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1cc(C)nn1C	ZINC000585740386	448753963	/nfs/dbraw/zinc/75/39/63/448753963.db2.gz	LRYQZFXARCYXML-UHFFFAOYSA-N	-1	3	340.361	1.124	20	5		EDBDHM
CN1CCC2(CC1)CN(C(=O)c1cc([O-])ccc1[N+](=O)[O-])CCO2	ZINC000592898958	449042584	/nfs/dbraw/zinc/04/25/84/449042584.db2.gz	OWHRDEIGYKULGL-UHFFFAOYSA-N	-1	3	335.360	1.237	20	5		EDBDHM
COC(=O)[C@H](CCF)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000593631608	449118365	/nfs/dbraw/zinc/11/83/65/449118365.db2.gz	CSCIPGUPTNWIFZ-JTQLQIEISA-N	-1	3	348.352	1.391	20	5		EDBDHM
CC[C@@H](C)N(CC)C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000597855103	449124721	/nfs/dbraw/zinc/12/47/21/449124721.db2.gz	HZZJSJYJKJGOAU-LLVKDONJSA-N	-1	3	343.405	1.520	20	5		EDBDHM
CCOc1cc([N+](=O)[O-])c(C(=O)[N-]c2nnc3nc[nH]n23)cc1OC	ZINC000590553158	449188022	/nfs/dbraw/zinc/18/80/22/449188022.db2.gz	XQMYGLXEMACCOC-UHFFFAOYSA-N	-1	3	347.291	1.020	20	5		EDBDHM
O=C(c1ccccn1)N1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596074190	449349761	/nfs/dbraw/zinc/34/97/61/449349761.db2.gz	ZYTMKEGOXPSMMW-UHFFFAOYSA-N	-1	3	329.316	1.053	20	5		EDBDHM
CCOC(=O)[C@]1(COC)CCCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1	ZINC000596219928	449422870	/nfs/dbraw/zinc/42/28/70/449422870.db2.gz	HSBVJFVQPKUPFL-OAHLLOKOSA-N	-1	3	339.348	1.492	20	5		EDBDHM
COc1ccc(OCCN2CC[C@](OC)(C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000600677089	449487196	/nfs/dbraw/zinc/48/71/96/449487196.db2.gz	ZHUVNGORMLNFTJ-OAHLLOKOSA-N	-1	3	340.332	1.158	20	5		EDBDHM
O=C(Nc1ccc2c(c1)NC(=O)CO2)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000614294000	449546006	/nfs/dbraw/zinc/54/60/06/449546006.db2.gz	HRAHWQOHPLTJOZ-UHFFFAOYSA-N	-1	3	330.256	1.279	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]CC[C@@H]1CC1(F)F	ZINC000598623348	449500025	/nfs/dbraw/zinc/50/00/25/449500025.db2.gz	WUAAYVMKIIEFHV-MRVPVSSYSA-N	-1	3	336.316	1.927	20	5		EDBDHM
O=C(NC[C@@H]1CCN1Cc1ccccc1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000598780007	449597012	/nfs/dbraw/zinc/59/70/12/449597012.db2.gz	NBYZJNKWHPACJJ-ZDUSSCGKSA-N	-1	3	342.355	1.700	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H](CO)CC1CC1	ZINC000594862467	449773239	/nfs/dbraw/zinc/77/32/39/449773239.db2.gz	CARUOOOCXFMIHA-LLVKDONJSA-N	-1	3	344.389	1.290	20	5		EDBDHM
COc1cc(CNCCC(=O)Nc2ccccn2)c([N+](=O)[O-])cc1[O-]	ZINC000608782106	449936129	/nfs/dbraw/zinc/93/61/29/449936129.db2.gz	NJEXNZWCVRAYDJ-UHFFFAOYSA-N	-1	3	346.343	1.822	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](CO)CCC(C)C	ZINC000599408823	449952603	/nfs/dbraw/zinc/95/26/03/449952603.db2.gz	BGVHBHCAYRKJCD-NSHDSACASA-N	-1	3	346.405	1.679	20	5		EDBDHM
CO[C@H]1C[C@@H](C[N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C1	ZINC000599518268	450039097	/nfs/dbraw/zinc/03/90/97/450039097.db2.gz	ONSOGVGMFHFBCP-TXEJJXNPSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])n[nH]1	ZINC000610005214	450126809	/nfs/dbraw/zinc/12/68/09/450126809.db2.gz	HTFBQNRLMOBNKW-UHFFFAOYSA-N	-1	3	330.753	1.758	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])[nH]n1	ZINC000610005214	450126813	/nfs/dbraw/zinc/12/68/13/450126813.db2.gz	HTFBQNRLMOBNKW-UHFFFAOYSA-N	-1	3	330.753	1.758	20	5		EDBDHM
NC(=O)c1ccc(F)c([N-]C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c1	ZINC000603762319	450347511	/nfs/dbraw/zinc/34/75/11/450347511.db2.gz	GYPHIKCBZVARMX-UHFFFAOYSA-N	-1	3	347.258	1.814	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](CO)CC(C)(C)C	ZINC000619492469	450489754	/nfs/dbraw/zinc/48/97/54/450489754.db2.gz	QIKKLFCTPYPUTG-SNVBAGLBSA-N	-1	3	346.405	1.679	20	5		EDBDHM
NC(=O)C1(CNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CCCC1	ZINC000737737800	578325672	/nfs/dbraw/zinc/32/56/72/578325672.db2.gz	FUGOQGXDRRBCPZ-UHFFFAOYSA-N	-1	3	331.336	1.233	20	5		EDBDHM
NC(=O)C1(CNc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CCCC1	ZINC000737737800	578325673	/nfs/dbraw/zinc/32/56/73/578325673.db2.gz	FUGOQGXDRRBCPZ-UHFFFAOYSA-N	-1	3	331.336	1.233	20	5		EDBDHM
Cc1nc2n(n1)C[C@@H](Nc1ccc(-c3nnn[n-]3)cc1[N+](=O)[O-])CC2	ZINC000737490296	579097614	/nfs/dbraw/zinc/09/76/14/579097614.db2.gz	RVHAWXXKEZVACV-JTQLQIEISA-N	-1	3	341.335	1.102	20	5		EDBDHM
Cc1nc2n(n1)C[C@@H](Nc1ccc(-c3nn[n-]n3)cc1[N+](=O)[O-])CC2	ZINC000737490296	579097616	/nfs/dbraw/zinc/09/76/16/579097616.db2.gz	RVHAWXXKEZVACV-JTQLQIEISA-N	-1	3	341.335	1.102	20	5		EDBDHM
O=C(C=Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2nnn[n-]2)cn1	ZINC000737796009	579129953	/nfs/dbraw/zinc/12/99/53/579129953.db2.gz	DPMWHMCMAADQSR-BAQGIRSFSA-N	-1	3	337.299	1.822	20	5		EDBDHM
O=C(C=Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2nn[n-]n2)cn1	ZINC000737796009	579129955	/nfs/dbraw/zinc/12/99/55/579129955.db2.gz	DPMWHMCMAADQSR-BAQGIRSFSA-N	-1	3	337.299	1.822	20	5		EDBDHM
O=C(CNC(=O)c1ccc([O-])cc1)OCc1ccc([N+](=O)[O-])cc1F	ZINC000746974284	579620179	/nfs/dbraw/zinc/62/01/79/579620179.db2.gz	GMKRKOHJDZJCPW-UHFFFAOYSA-N	-1	3	348.286	1.913	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H]2CCOC2=O)cc1[N+](=O)[O-]	ZINC000752232515	579842716	/nfs/dbraw/zinc/84/27/16/579842716.db2.gz	YXPHEJHLVXHAFH-QMMMGPOBSA-N	-1	3	334.737	1.150	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H]2CCN(C)C2)cc1[N+](=O)[O-]	ZINC000752235814	579842758	/nfs/dbraw/zinc/84/27/58/579842758.db2.gz	OZHQPIBULNONRA-VIFPVBQESA-N	-1	3	333.797	1.539	20	5		EDBDHM
O=[N+]([O-])c1ccc[nH]c1=N[N-]S(=O)(=O)c1cncc(Cl)c1	ZINC000768285226	580210138	/nfs/dbraw/zinc/21/01/38/580210138.db2.gz	MIWNAKVDCHDIKE-UHFFFAOYSA-N	-1	3	329.725	1.344	20	5		EDBDHM
O=[N+]([O-])c1ccc[n-]c1=NNS(=O)(=O)c1cncc(Cl)c1	ZINC000768285226	580210139	/nfs/dbraw/zinc/21/01/39/580210139.db2.gz	MIWNAKVDCHDIKE-UHFFFAOYSA-N	-1	3	329.725	1.344	20	5		EDBDHM
CCOC(=O)[C@@](C)(O)C[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000768733309	580219230	/nfs/dbraw/zinc/21/92/30/580219230.db2.gz	QVMQOQRNXRUVPQ-ZDUSSCGKSA-N	-1	3	346.286	1.117	20	5		EDBDHM
CCOC(=O)[C@](C)(O)C[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000768733306	580219239	/nfs/dbraw/zinc/21/92/39/580219239.db2.gz	QVMQOQRNXRUVPQ-CYBMUJFWSA-N	-1	3	346.286	1.117	20	5		EDBDHM
C[C@H](CO[C@H]1CCOC1)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768855445	580222652	/nfs/dbraw/zinc/22/26/52/580222652.db2.gz	YUTXPNBNJBTDTQ-BDAKNGLRSA-N	-1	3	336.391	1.129	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)n[nH]1	ZINC000771759701	580293000	/nfs/dbraw/zinc/29/30/00/580293000.db2.gz	UKJGMMGYSBJDKD-UHFFFAOYSA-N	-1	3	342.352	1.806	20	5		EDBDHM
O=C(OCCn1cc([N+](=O)[O-])ccc1=O)c1cc([O-])ccc1Cl	ZINC000785868497	580655203	/nfs/dbraw/zinc/65/52/03/580655203.db2.gz	GPKOWYPISIXYER-UHFFFAOYSA-N	-1	3	338.703	1.973	20	5		EDBDHM
CCOC(=O)[C@H](C)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000790836199	580779684	/nfs/dbraw/zinc/77/96/84/580779684.db2.gz	MXWLXTKGGZCABJ-JTQLQIEISA-N	-1	3	330.362	1.442	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2C[C@H](C)OC2=O)c1[N+](=O)[O-]	ZINC000809383412	593335759	/nfs/dbraw/zinc/33/57/59/593335759.db2.gz	XIERPDFRBJSZJR-UWVGGRQHSA-N	-1	3	328.346	1.194	20	5		EDBDHM
CC(C)OC(=O)[C@H](C)C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768844884	593442356	/nfs/dbraw/zinc/44/23/56/593442356.db2.gz	XMZHLYIBNPBWOI-MRVPVSSYSA-N	-1	3	336.391	1.522	20	5		EDBDHM
C[C@H](C(=O)OC(C)(C)C)N(C)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000819884180	593773577	/nfs/dbraw/zinc/77/35/77/593773577.db2.gz	SWRGDEOFLBIICV-SECBINFHSA-N	-1	3	348.363	1.941	20	5		EDBDHM
C[C@H](C(=O)OC(C)(C)C)N(C)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000819884180	593773578	/nfs/dbraw/zinc/77/35/78/593773578.db2.gz	SWRGDEOFLBIICV-SECBINFHSA-N	-1	3	348.363	1.941	20	5		EDBDHM
O=C([O-])CN1CCC[C@@H]1COC(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000821531198	593856158	/nfs/dbraw/zinc/85/61/58/593856158.db2.gz	KENPDJDSUNNZLD-SNVBAGLBSA-N	-1	3	342.735	1.954	20	5		EDBDHM
CCO[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)C12CCC2	ZINC000821361429	594027629	/nfs/dbraw/zinc/02/76/29/594027629.db2.gz	USWIONWONJYILS-NWDGAFQWSA-N	-1	3	345.363	1.930	20	5		EDBDHM
CCO[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)C12CCC2	ZINC000821361429	594027630	/nfs/dbraw/zinc/02/76/30/594027630.db2.gz	USWIONWONJYILS-NWDGAFQWSA-N	-1	3	345.363	1.930	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N[C@@H]3CCCOC3)cc(-c3nnn[n-]3)c2c1	ZINC000823644625	594224243	/nfs/dbraw/zinc/22/42/43/594224243.db2.gz	JQGJNWNTPRYYOH-SECBINFHSA-N	-1	3	341.331	1.914	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N[C@@H]3CCCOC3)cc(-c3nn[n-]n3)c2c1	ZINC000823644625	594224244	/nfs/dbraw/zinc/22/42/44/594224244.db2.gz	JQGJNWNTPRYYOH-SECBINFHSA-N	-1	3	341.331	1.914	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)N1CCc2ccc(-c3nnn[n-]3)cc21	ZINC000826362990	594445297	/nfs/dbraw/zinc/44/52/97/594445297.db2.gz	RFSKABBQPSSRQM-UHFFFAOYSA-N	-1	3	339.315	1.316	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)N1CCc2ccc(-c3nn[n-]n3)cc21	ZINC000826362990	594445299	/nfs/dbraw/zinc/44/52/99/594445299.db2.gz	RFSKABBQPSSRQM-UHFFFAOYSA-N	-1	3	339.315	1.316	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CC[C@H]([C@@H]2CCOC2)C1	ZINC000826497672	594502906	/nfs/dbraw/zinc/50/29/06/594502906.db2.gz	PMCLPLLXUOXUKP-NWDGAFQWSA-N	-1	3	330.348	1.638	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CC[C@H]([C@@H]2CCOC2)C1	ZINC000826497672	594502908	/nfs/dbraw/zinc/50/29/08/594502908.db2.gz	PMCLPLLXUOXUKP-NWDGAFQWSA-N	-1	3	330.348	1.638	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCn3ccnc32)cc1C	ZINC000831737785	594697837	/nfs/dbraw/zinc/69/78/37/594697837.db2.gz	HUCNFBIOBOZFCP-LLVKDONJSA-N	-1	3	336.373	1.831	20	5		EDBDHM
CC[C@H](C)CO[N-]C(=O)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000836790857	594998318	/nfs/dbraw/zinc/99/83/18/594998318.db2.gz	VOLJRAGRXRPUNX-VIFPVBQESA-N	-1	3	330.362	1.706	20	5		EDBDHM
O=C([N-][C@@H]1C=C[C@H](CO)C1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848586696	595410206	/nfs/dbraw/zinc/41/02/06/595410206.db2.gz	CBAQETLXHYXBGS-VHSXEESVSA-N	-1	3	328.271	1.620	20	5		EDBDHM
COCC[C@H](COC)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848588845	595411025	/nfs/dbraw/zinc/41/10/25/595411025.db2.gz	ASJXUEFRVDTWNS-SNVBAGLBSA-N	-1	3	348.302	1.734	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@H]2CCO[C@@H](C3CC3)C2)cs1	ZINC000120324828	596440118	/nfs/dbraw/zinc/44/01/18/596440118.db2.gz	KESZRYZVSLDBOG-GXSJLCMTSA-N	-1	3	332.403	1.892	20	5		EDBDHM
C[C@H](CO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1Br	ZINC000122799399	596650698	/nfs/dbraw/zinc/65/06/98/596650698.db2.gz	BNRSXTWSFIWCCI-ZCFIWIBFSA-N	-1	3	339.167	1.016	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2cn3c(n2)CCCC3)c(-c2nnn[n-]2)c1	ZINC000738373704	598395444	/nfs/dbraw/zinc/39/54/44/598395444.db2.gz	FWTWKJPJOVTDQF-UHFFFAOYSA-N	-1	3	341.335	1.315	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2cn3c(n2)CCCC3)c(-c2nn[n-]n2)c1	ZINC000738373704	598395446	/nfs/dbraw/zinc/39/54/46/598395446.db2.gz	FWTWKJPJOVTDQF-UHFFFAOYSA-N	-1	3	341.335	1.315	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@H](c3ncc[nH]3)C2)c(-c2nnn[n-]2)c1	ZINC000738370222	598501099	/nfs/dbraw/zinc/50/10/99/598501099.db2.gz	RTMYKUZFGPONSL-VIFPVBQESA-N	-1	3	341.335	1.277	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@H](c3ncc[nH]3)C2)c(-c2nn[n-]n2)c1	ZINC000738370222	598501101	/nfs/dbraw/zinc/50/11/01/598501101.db2.gz	RTMYKUZFGPONSL-VIFPVBQESA-N	-1	3	341.335	1.277	20	5		EDBDHM
C[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C(=O)O1	ZINC000917866140	697094853	/nfs/dbraw/zinc/09/48/53/697094853.db2.gz	MDLYXRYOJVHJON-RCOVLWMOSA-N	-1	3	334.737	1.231	20	5		EDBDHM
Cc1c(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)cnn1[C@H]1CCOC1	ZINC000412373961	304003022	/nfs/dbraw/zinc/00/30/22/304003022.db2.gz	DFWZKWNWVISCRD-VIFPVBQESA-N	-1	3	333.304	1.414	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCO1	ZINC000157779226	206155990	/nfs/dbraw/zinc/15/59/90/206155990.db2.gz	YYFLJWWXMOGTPY-RYUDHWBXSA-N	-1	3	332.353	1.970	20	5		EDBDHM
CC[C@@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000157939605	206163570	/nfs/dbraw/zinc/16/35/70/206163570.db2.gz	AWANHBMPZQPPTK-ZETCQYMHSA-N	-1	3	342.295	1.663	20	5		EDBDHM
C[C@H]1CCNC(=O)[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000195479174	299998045	/nfs/dbraw/zinc/99/80/45/299998045.db2.gz	GTWRYGXDGPIIRX-CPCISQLKSA-N	-1	3	347.780	1.051	20	5		EDBDHM
CC(C)c1nc(S(=O)(=O)[N-]Cc2cccc([N+](=O)[O-])c2)cn1C	ZINC000568371061	306479858	/nfs/dbraw/zinc/47/98/58/306479858.db2.gz	WGLUVMDXZOROKH-UHFFFAOYSA-N	-1	3	338.389	1.930	20	5		EDBDHM
COC(=O)[C@H]1C[C@@H]([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C1	ZINC000416612558	251082832	/nfs/dbraw/zinc/08/28/32/251082832.db2.gz	DDZWRYXQVQPVMB-OCAPTIKFSA-N	-1	3	334.375	1.195	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CCn2cccc2)cc1[N+](=O)[O-]	ZINC000491589744	255131723	/nfs/dbraw/zinc/13/17/23/255131723.db2.gz	UAIVWFSWFAIRPC-UHFFFAOYSA-N	-1	3	343.336	1.523	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CCC(C)(C)O1	ZINC000494366993	255247910	/nfs/dbraw/zinc/24/79/10/255247910.db2.gz	JLRIERDICNLXDN-LLVKDONJSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1ncc(S(=O)(=O)[N-]CCc2cccc([N+](=O)[O-])c2)s1	ZINC000270281921	140072960	/nfs/dbraw/zinc/07/29/60/140072960.db2.gz	URUJZXCVOUETOH-UHFFFAOYSA-N	-1	3	327.387	1.881	20	5		EDBDHM
CCOC(=O)C(C)(C)[N-]S(=O)(=O)CCc1ccccc1[N+](=O)[O-]	ZINC000271137574	140243838	/nfs/dbraw/zinc/24/38/38/140243838.db2.gz	UMDHJDVFAJHHMR-UHFFFAOYSA-N	-1	3	344.389	1.398	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@H]1CCO[C@@H](C)C1	ZINC000271238169	140261696	/nfs/dbraw/zinc/26/16/96/140261696.db2.gz	CQTFUNNWWPXLJR-RYUDHWBXSA-N	-1	3	328.390	1.997	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCCOCC2)c([N+](=O)[O-])c1	ZINC000271954796	140378606	/nfs/dbraw/zinc/37/86/06/140378606.db2.gz	KVUCNHSASZXINV-JTQLQIEISA-N	-1	3	330.362	1.451	20	5		EDBDHM
C[C@@](O)(C[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)C(F)(F)F	ZINC000340595037	142441179	/nfs/dbraw/zinc/44/11/79/142441179.db2.gz	GYZDNSLCOSOZHI-SNVBAGLBSA-N	-1	3	342.295	1.328	20	5		EDBDHM
O=C(Nc1cccc(N2CCC2=O)c1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000344886615	143023813	/nfs/dbraw/zinc/02/38/13/143023813.db2.gz	HGKZLXDBQJQKKS-UHFFFAOYSA-N	-1	3	328.284	1.684	20	5		EDBDHM
Cc1ncc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c(=O)[n-]1	ZINC000345116290	143052471	/nfs/dbraw/zinc/05/24/71/143052471.db2.gz	CGHUTUDXUYGZLV-UHFFFAOYSA-N	-1	3	336.735	1.911	20	5		EDBDHM
Cc1ncc(CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c(=O)[n-]1	ZINC000345118194	143052576	/nfs/dbraw/zinc/05/25/76/143052576.db2.gz	DUOMCXYUHIJGCW-UHFFFAOYSA-N	-1	3	327.300	1.810	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@]2(C)CCC(=O)N2)cc1C	ZINC000416504104	304325917	/nfs/dbraw/zinc/32/59/17/304325917.db2.gz	ZADDVPARGYZAPM-AWEZNQCLSA-N	-1	3	341.389	1.159	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C(C)(C)CN(C)C)c1C	ZINC000416507777	304326589	/nfs/dbraw/zinc/32/65/89/304326589.db2.gz	MDOUHQLWEDBOTF-UHFFFAOYSA-N	-1	3	329.422	1.830	20	5		EDBDHM
O=C(NCc1ncccc1[O-])c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21	ZINC000352499658	162214786	/nfs/dbraw/zinc/21/47/86/162214786.db2.gz	HCFXFULVPVIXBO-UHFFFAOYSA-N	-1	3	340.295	1.879	20	5		EDBDHM
CC(C)C(=O)NCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000055977526	287229733	/nfs/dbraw/zinc/22/97/33/287229733.db2.gz	REDZOWABMKXULS-UHFFFAOYSA-N	-1	3	349.796	1.299	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@H](O)C(C)C)cc1C	ZINC000122029544	287376860	/nfs/dbraw/zinc/37/68/60/287376860.db2.gz	ADKBMYQXGLFCRZ-ZDUSSCGKSA-N	-1	3	330.406	1.897	20	5		EDBDHM
CS[C@@H]1CN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)C[C@@H]1N(C)C	ZINC000273305675	268019925	/nfs/dbraw/zinc/01/99/25/268019925.db2.gz	GLXDVFBCLDIGTR-WCQYABFASA-N	-1	3	325.390	1.418	20	5		EDBDHM
C/C=C/C[C@@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000274682398	268182845	/nfs/dbraw/zinc/18/28/45/268182845.db2.gz	SNSFWUBXMXHRGH-FSIBCCDJSA-N	-1	3	330.362	1.209	20	5		EDBDHM
C/C=C/C[C@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000274682399	268183440	/nfs/dbraw/zinc/18/34/40/268183440.db2.gz	SNSFWUBXMXHRGH-HMDXOVGESA-N	-1	3	330.362	1.209	20	5		EDBDHM
COC(=O)Cc1n[n-]c(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)n1	ZINC000275948059	268386925	/nfs/dbraw/zinc/38/69/25/268386925.db2.gz	ZKVFMXSUOZDWNP-UHFFFAOYSA-N	-1	3	347.331	1.804	20	5		EDBDHM
COC(=O)Cc1nnc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)[n-]1	ZINC000275948059	268386926	/nfs/dbraw/zinc/38/69/26/268386926.db2.gz	ZKVFMXSUOZDWNP-UHFFFAOYSA-N	-1	3	347.331	1.804	20	5		EDBDHM
COC(=O)Cc1nc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)n[n-]1	ZINC000275948059	268386927	/nfs/dbraw/zinc/38/69/27/268386927.db2.gz	ZKVFMXSUOZDWNP-UHFFFAOYSA-N	-1	3	347.331	1.804	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)C(C)C	ZINC000276088571	268395898	/nfs/dbraw/zinc/39/58/98/268395898.db2.gz	HJFWJFHBKJCRRY-SECBINFHSA-N	-1	3	330.362	1.704	20	5		EDBDHM
Cc1nnc([C@@H](C)[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)s1	ZINC000273965871	273062953	/nfs/dbraw/zinc/06/29/53/273062953.db2.gz	ONLXIARACRERFB-SSDOTTSWSA-N	-1	3	328.375	1.794	20	5		EDBDHM
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@@H]1OC	ZINC000274124584	273071144	/nfs/dbraw/zinc/07/11/44/273071144.db2.gz	VOHAWYLOQOYGGB-NDMJEZRESA-N	-1	3	330.362	1.066	20	5		EDBDHM
CCOC(C)(C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000275924702	273135374	/nfs/dbraw/zinc/13/53/74/273135374.db2.gz	HAXYUIDKAHLUPR-UHFFFAOYSA-N	-1	3	332.378	1.697	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)[C@@H](C)OC	ZINC000276057332	273144814	/nfs/dbraw/zinc/14/48/14/273144814.db2.gz	IHKCAQKDNGBYPX-DTWKUNHWSA-N	-1	3	346.361	1.083	20	5		EDBDHM
COc1cc(CNCC2(S(C)(=O)=O)CCC2)c([N+](=O)[O-])cc1[O-]	ZINC000279768709	273325666	/nfs/dbraw/zinc/32/56/66/273325666.db2.gz	JZUSQWWUOVPXES-UHFFFAOYSA-N	-1	3	344.389	1.366	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C2(CN(C)C)CCC2)c1C	ZINC000281537850	273488460	/nfs/dbraw/zinc/48/84/60/273488460.db2.gz	NDUIZRHFGZLFIA-UHFFFAOYSA-N	-1	3	341.433	1.974	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H]1CCOC[C@@H]1C	ZINC000285622474	274599041	/nfs/dbraw/zinc/59/90/41/274599041.db2.gz	NJEFXUMAVBLFCS-RYUDHWBXSA-N	-1	3	328.390	1.854	20	5		EDBDHM
CC1(C)CC[C@H]1[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000286565367	288035546	/nfs/dbraw/zinc/03/55/46/288035546.db2.gz	DOUKWVTUJRRXQG-CYBMUJFWSA-N	-1	3	342.373	1.833	20	5		EDBDHM
C[C@H](CN1CCC[C@@H](C)C1)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000189151724	279309647	/nfs/dbraw/zinc/30/96/47/279309647.db2.gz	NBTZURGZISWNGR-CHWSQXEVSA-N	-1	3	341.433	1.994	20	5		EDBDHM
CC1(C)CC[C@H]1NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000287176080	288172718	/nfs/dbraw/zinc/17/27/18/288172718.db2.gz	OJZLLQVNIZZXQU-GFCCVEGCSA-N	-1	3	341.389	1.178	20	5		EDBDHM
Cc1cc(C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375103442	301141829	/nfs/dbraw/zinc/14/18/29/301141829.db2.gz	WLBSPXZRZQLTHL-BIMULSAOSA-N	-1	3	333.344	1.691	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1CCC[C@@H]2OCC[C@H]21	ZINC000246022117	304810275	/nfs/dbraw/zinc/81/02/75/304810275.db2.gz	NSVFKVFAOJPAPZ-LOWVWBTDSA-N	-1	3	326.374	1.831	20	5		EDBDHM
COc1ccncc1C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000431573630	305079885	/nfs/dbraw/zinc/07/98/85/305079885.db2.gz	CBDHEWPWXRVGDQ-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])[C@@H]1CCCO1	ZINC000433457533	305109591	/nfs/dbraw/zinc/10/95/91/305109591.db2.gz	PRKYCIJYWGJVSA-AAEUAGOBSA-N	-1	3	344.389	1.376	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CC[C@H](C(N)=O)C2)c1C	ZINC000452053031	305380639	/nfs/dbraw/zinc/38/06/39/305380639.db2.gz	CEAPZLIGRNSHAN-WDEREUQCSA-N	-1	3	341.389	1.144	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(=O)NC	ZINC000452089816	305382147	/nfs/dbraw/zinc/38/21/47/305382147.db2.gz	RNIJPOZSWSIPRJ-SNVBAGLBSA-N	-1	3	329.378	1.015	20	5		EDBDHM
COCCCCC[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000058509207	441200177	/nfs/dbraw/zinc/20/01/77/441200177.db2.gz	SEKLIJFHWUOZDJ-UHFFFAOYSA-N	-1	3	332.378	1.698	20	5		EDBDHM
C[C@H](COCC(F)(F)F)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000065793881	441486402	/nfs/dbraw/zinc/48/64/02/441486402.db2.gz	CPBSHRCARCKIBM-MRVPVSSYSA-N	-1	3	342.295	1.841	20	5		EDBDHM
Cn1cc(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cn1	ZINC000056094975	441688777	/nfs/dbraw/zinc/68/87/77/441688777.db2.gz	NNEQEXFPHLLMMA-UHFFFAOYSA-N	-1	3	344.780	1.503	20	5		EDBDHM
CC[C@@H](CCO)C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000121464307	441710766	/nfs/dbraw/zinc/71/07/66/441710766.db2.gz	XFDYMWSJXJTRHN-LBPRGKRZSA-N	-1	3	330.406	1.899	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1ccc(=O)n(C)c1	ZINC000057122859	441787575	/nfs/dbraw/zinc/78/75/75/441787575.db2.gz	QIYAYROGAFXPHI-UHFFFAOYSA-N	-1	3	339.329	1.103	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCc2cnn(C)c2)c1C	ZINC000119738362	441948233	/nfs/dbraw/zinc/94/82/33/441948233.db2.gz	YTAWWAZFMULCFA-UHFFFAOYSA-N	-1	3	338.389	1.466	20	5		EDBDHM
C[C@]1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCCC[C@@H]1O	ZINC000124805913	441955229	/nfs/dbraw/zinc/95/52/29/441955229.db2.gz	MOHAPAYESDVKQO-UONOGXRCSA-N	-1	3	346.380	1.953	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2C[C@H]3CC[C@@H]2O3)cc1C	ZINC000151037935	441994557	/nfs/dbraw/zinc/99/45/57/441994557.db2.gz	CPRHOUXIUDGDEH-WZRBSPASSA-N	-1	3	326.374	1.810	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](C)C[C@@H](C)O)c1C	ZINC000120703113	442120129	/nfs/dbraw/zinc/12/01/29/442120129.db2.gz	INZVOVDRYMHSDV-GXSJLCMTSA-N	-1	3	330.406	1.897	20	5		EDBDHM
CC(=O)N1CC[C@@H]([N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C1	ZINC000126726914	442137885	/nfs/dbraw/zinc/13/78/85/442137885.db2.gz	RGWOPIOHSQCDGP-GFCCVEGCSA-N	-1	3	341.389	1.111	20	5		EDBDHM
CC(C)(C)C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000129503132	442319614	/nfs/dbraw/zinc/31/96/14/442319614.db2.gz	LRAPDCNFJOCDRE-UHFFFAOYSA-N	-1	3	329.378	1.035	20	5		EDBDHM
CCN1CCN([C@H](C)CNC(=O)c2cc([N+](=O)[O-])ccc2[O-])CC1	ZINC000179495551	442466370	/nfs/dbraw/zinc/46/63/70/442466370.db2.gz	QKODBYLNAOHMBK-GFCCVEGCSA-N	-1	3	336.392	1.056	20	5		EDBDHM
O=C(NCc1ccc(-c2nnn[n-]2)cc1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000135425751	442594696	/nfs/dbraw/zinc/59/46/96/442594696.db2.gz	DEUBYVVPBYOKBG-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=C(NCc1ccc(-c2nn[n-]n2)cc1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000135425751	442594703	/nfs/dbraw/zinc/59/47/03/442594703.db2.gz	DEUBYVVPBYOKBG-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)c2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000266226481	443064831	/nfs/dbraw/zinc/06/48/31/443064831.db2.gz	SXTRDFIVDHHQFV-VIFPVBQESA-N	-1	3	340.361	1.376	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC2(CCO)CC2)c1[N+](=O)[O-]	ZINC000190171878	443066587	/nfs/dbraw/zinc/06/65/87/443066587.db2.gz	KFHZIWFLOCSFOD-UHFFFAOYSA-N	-1	3	328.390	1.653	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H](OC)C(C)C)c([N+](=O)[O-])c1	ZINC000266722437	443219567	/nfs/dbraw/zinc/21/95/67/443219567.db2.gz	JUFXGBZPJACMDH-GFCCVEGCSA-N	-1	3	332.378	1.553	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1	ZINC000440354221	320073525	/nfs/dbraw/zinc/07/35/25/320073525.db2.gz	JXUGQZZMGUKFQJ-UHFFFAOYSA-N	-1	3	347.331	1.935	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])N[C@@H]1CC=CCC1	ZINC000280954358	443782925	/nfs/dbraw/zinc/78/29/25/443782925.db2.gz	MQXYJRBJYHTTSF-LLVKDONJSA-N	-1	3	339.373	1.098	20	5		EDBDHM
CCOCCCC[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000298837125	443881988	/nfs/dbraw/zinc/88/19/88/443881988.db2.gz	DWEULAWSKGMUGP-UHFFFAOYSA-N	-1	3	332.378	1.698	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H]2CCCN2C)cc1C	ZINC000299207695	443983101	/nfs/dbraw/zinc/98/31/01/443983101.db2.gz	AOSJYFDBXXWVPS-GFCCVEGCSA-N	-1	3	327.406	1.584	20	5		EDBDHM
CC(C)C[C@H](CN(C)C)[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000324022664	444349115	/nfs/dbraw/zinc/34/91/15/444349115.db2.gz	RYIKHZYWSOUOFK-LLVKDONJSA-N	-1	3	347.412	1.989	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(=O)[nH]c1	ZINC000320655274	444331270	/nfs/dbraw/zinc/33/12/70/444331270.db2.gz	XDJQBUZYNITMCQ-UHFFFAOYSA-N	-1	3	325.302	1.505	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@H]2CCOC2)c1C	ZINC000343991610	444714353	/nfs/dbraw/zinc/71/43/53/444714353.db2.gz	LIHJUKFPBDDZQG-LBPRGKRZSA-N	-1	3	328.390	1.917	20	5		EDBDHM
CS[C@@H](CO)[C@@H](C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000342493962	444715313	/nfs/dbraw/zinc/71/53/13/444715313.db2.gz	SISAPWVKFXMVQO-MUWHJKNJSA-N	-1	3	340.448	1.355	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCCN(C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000342500850	444719298	/nfs/dbraw/zinc/71/92/98/444719298.db2.gz	DEGIFRVCLNUMFO-WCBMZHEXSA-N	-1	3	333.435	1.726	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCC(=O)NC2(C)C)cc1[N+](=O)[O-]	ZINC000338429443	444690553	/nfs/dbraw/zinc/69/05/53/444690553.db2.gz	KHUSLNPTEBQMLU-SECBINFHSA-N	-1	3	347.418	1.300	20	5		EDBDHM
C[C@H](NC(=O)c1cc(=O)[n-]c(N(C)C)n1)c1ccccc1[N+](=O)[O-]	ZINC000338819375	444869101	/nfs/dbraw/zinc/86/91/01/444869101.db2.gz	XNZUUVSSKLTGDK-VIFPVBQESA-N	-1	3	331.332	1.647	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2noc(C3CC3)n2)c(F)c1	ZINC000343116859	445076701	/nfs/dbraw/zinc/07/67/01/445076701.db2.gz	JGTVFZFJLFCEGM-UHFFFAOYSA-N	-1	3	342.308	1.473	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-][C@@H]1CCC[C@H]1F)OCCO2	ZINC000339118042	445040036	/nfs/dbraw/zinc/04/00/36/445040036.db2.gz	DLGCNEXSEJKQLV-RKDXNWHRSA-N	-1	3	346.336	1.535	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCNc1ccccn1	ZINC000345223859	445174278	/nfs/dbraw/zinc/17/42/78/445174278.db2.gz	BLQFYOZFGHNFIX-UHFFFAOYSA-N	-1	3	336.373	1.689	20	5		EDBDHM
CC[C@H](C)[C@@H]([N-]S(C)(=O)=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1	ZINC000348013429	445261364	/nfs/dbraw/zinc/26/13/64/445261364.db2.gz	OORAXDRWHNFPCK-QPUJVOFHSA-N	-1	3	347.368	1.636	20	5		EDBDHM
Cc1ccc(NC(=O)C(=O)NCc2ncccc2[O-])cc1[N+](=O)[O-]	ZINC000351895618	445360957	/nfs/dbraw/zinc/36/09/57/445360957.db2.gz	UYJUMYJUFXJYBP-UHFFFAOYSA-N	-1	3	330.300	1.259	20	5		EDBDHM
CCC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)C(=O)OC	ZINC000358594129	445666020	/nfs/dbraw/zinc/66/60/20/445666020.db2.gz	DJKJOBDVRBLACA-JTQLQIEISA-N	-1	3	346.361	1.223	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CC[C@H](O)C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000350022532	445751243	/nfs/dbraw/zinc/75/12/43/445751243.db2.gz	YHTSFMWGVRBSOE-JTQLQIEISA-N	-1	3	342.295	1.495	20	5		EDBDHM
COC(=O)CC[C@@H](N)C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000423744268	446675300	/nfs/dbraw/zinc/67/53/00/446675300.db2.gz	NMNFWVUXWOXYJN-SSDOTTSWSA-N	-1	3	331.712	1.173	20	5		EDBDHM
O=C(Nc1nnc(SCCO)[n-]1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000412191069	446892418	/nfs/dbraw/zinc/89/24/18/446892418.db2.gz	JFIWAKSJFVMHKU-WDEREUQCSA-N	-1	3	349.372	1.540	20	5		EDBDHM
O=C(Nc1nc(SCCO)n[n-]1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000412191069	446892424	/nfs/dbraw/zinc/89/24/24/446892424.db2.gz	JFIWAKSJFVMHKU-WDEREUQCSA-N	-1	3	349.372	1.540	20	5		EDBDHM
O=C(Nc1n[n-]c(SCCO)n1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000412191069	446892431	/nfs/dbraw/zinc/89/24/31/446892431.db2.gz	JFIWAKSJFVMHKU-WDEREUQCSA-N	-1	3	349.372	1.540	20	5		EDBDHM
CC[C@H](C)[C@@](C)(O)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000443305196	447028079	/nfs/dbraw/zinc/02/80/79/447028079.db2.gz	KOZDEJMIICFDKW-HZMBPMFUSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2ccccc2S(C)(=O)=O)n1	ZINC000427110563	447546122	/nfs/dbraw/zinc/54/61/22/447546122.db2.gz	LXEMONCVUXBUJY-UHFFFAOYSA-N	-1	3	338.345	1.467	20	5		EDBDHM
COCC[C@@H](C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000416596417	447657184	/nfs/dbraw/zinc/65/71/84/447657184.db2.gz	YWVYJCBTPXWYRR-SNVBAGLBSA-N	-1	3	332.378	1.554	20	5		EDBDHM
CCN1C[C@@H]([N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])CC1=O	ZINC000451871029	447769650	/nfs/dbraw/zinc/76/96/50/447769650.db2.gz	QNQCJWAPEJFULB-NSHDSACASA-N	-1	3	341.389	1.111	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC(C)(C)C(C)(C)O)c([N+](=O)[O-])c1	ZINC000452030425	447804969	/nfs/dbraw/zinc/80/49/69/447804969.db2.gz	HAGKDUONPAEJJO-UHFFFAOYSA-N	-1	3	330.406	1.979	20	5		EDBDHM
CN1CCN(CCCCNC(=O)c2cc([O-])ccc2[N+](=O)[O-])CC1	ZINC000576058934	447962695	/nfs/dbraw/zinc/96/26/95/447962695.db2.gz	WUVHVOABINKGDF-UHFFFAOYSA-N	-1	3	336.392	1.058	20	5		EDBDHM
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)Nc1ccc([O-])c([N+](=O)[O-])c1	ZINC000577176053	448225405	/nfs/dbraw/zinc/22/54/05/448225405.db2.gz	MAIMOBYZXDWDDT-CKUKBARFSA-N	-1	3	335.360	1.771	20	5		EDBDHM
CC1CCN(C[C@H](O)CNc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1	ZINC000569344381	449006281	/nfs/dbraw/zinc/00/62/81/449006281.db2.gz	IKWUZUIZLNMYDN-CYBMUJFWSA-N	-1	3	337.376	1.798	20	5		EDBDHM
CC(C)Cn1ccnc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593573492	449082416	/nfs/dbraw/zinc/08/24/16/449082416.db2.gz	CQCXBCJTIFAKRN-UHFFFAOYSA-N	-1	3	339.377	1.321	20	5		EDBDHM
COC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCC(C)CC1	ZINC000593585316	449091417	/nfs/dbraw/zinc/09/14/17/449091417.db2.gz	FDMXXSGYZBZQPQ-UHFFFAOYSA-N	-1	3	343.405	1.863	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC2(c3ccccn3)CCC2)nc1	ZINC000593595659	449096692	/nfs/dbraw/zinc/09/66/92/449096692.db2.gz	RCYKHORYLAMHIH-UHFFFAOYSA-N	-1	3	348.384	1.785	20	5		EDBDHM
O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CCc2c(=O)[n-]cnc2C1	ZINC000593597171	449098286	/nfs/dbraw/zinc/09/82/86/449098286.db2.gz	VGXRJDBVPMOKRK-UHFFFAOYSA-N	-1	3	332.291	1.357	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2nnc(C3CC3)s2)nc1	ZINC000593608359	449105425	/nfs/dbraw/zinc/10/54/25/449105425.db2.gz	NBOQFERHHRDRRI-UHFFFAOYSA-N	-1	3	341.374	1.197	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C2CCN(C)CC2)c(F)cc1[N+](=O)[O-]	ZINC000590589689	449205144	/nfs/dbraw/zinc/20/51/44/449205144.db2.gz	MKLGLBGEYDPQNK-UHFFFAOYSA-N	-1	3	331.369	1.415	20	5		EDBDHM
O=C(Nc1nc(CCO)cs1)c1n[n-]c2ccc([N+](=O)[O-])cc21	ZINC000590558424	449190418	/nfs/dbraw/zinc/19/04/18/449190418.db2.gz	ONKXJECFMUPQTA-UHFFFAOYSA-N	-1	3	333.329	1.715	20	5		EDBDHM
CC(C)(C)OC(=O)CCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593559753	449349953	/nfs/dbraw/zinc/34/99/53/449349953.db2.gz	YTOKRJVCSJJLMP-UHFFFAOYSA-N	-1	3	345.377	1.390	20	5		EDBDHM
O=[N+]([O-])c1ncccc1S(=O)(=O)[N-][C@H]1CCCN2CCCC[C@@H]12	ZINC000594485253	449549144	/nfs/dbraw/zinc/54/91/44/449549144.db2.gz	YEOJQAUFMXYOOK-RYUDHWBXSA-N	-1	3	340.405	1.285	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCCN3CCCC[C@@H]23)s1	ZINC000594485121	449549794	/nfs/dbraw/zinc/54/97/94/449549794.db2.gz	WTWRJSZAEKIUCX-MNOVXSKESA-N	-1	3	345.446	1.952	20	5		EDBDHM
O=C([O-])c1ccc([N+](=O)[O-])c(CN2CC[C@@H](Cn3ccnn3)C2)c1	ZINC000594734385	449656162	/nfs/dbraw/zinc/65/61/62/449656162.db2.gz	ZGUKUJNGJGISLF-LLVKDONJSA-N	-1	3	331.332	1.407	20	5		EDBDHM
C[C@@H]1CCC[C@H](C)N1CC[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594754537	449669616	/nfs/dbraw/zinc/66/96/16/449669616.db2.gz	LWXMIRASELAORI-TXEJJXNPSA-N	-1	3	342.421	1.531	20	5		EDBDHM
C[C@@H](CO)[C@H](C)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594756777	449671674	/nfs/dbraw/zinc/67/16/74/449671674.db2.gz	AHIWAUQAGKMANS-UWVGGRQHSA-N	-1	3	339.373	1.438	20	5		EDBDHM
COC1CC(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000594790669	449700642	/nfs/dbraw/zinc/70/06/42/449700642.db2.gz	WGYIFFFAJOLMQQ-UHFFFAOYSA-N	-1	3	332.353	1.827	20	5		EDBDHM
O=[N+]([O-])c1cccnc1S(=O)(=O)[N-][C@H]1CCCN2CCCC[C@@H]12	ZINC000594793626	449704051	/nfs/dbraw/zinc/70/40/51/449704051.db2.gz	FRZJMFMJSIFUHD-RYUDHWBXSA-N	-1	3	340.405	1.285	20	5		EDBDHM
CC1(C)CCCN1CC[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594782759	449693931	/nfs/dbraw/zinc/69/39/31/449693931.db2.gz	OEZGFOAHIJSNCK-UHFFFAOYSA-N	-1	3	328.394	1.143	20	5		EDBDHM
C[C@@H]1CCC[C@@H](C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])O1	ZINC000594851263	449759302	/nfs/dbraw/zinc/75/93/02/449759302.db2.gz	INLRITIVMANTJN-YPMHNXCESA-N	-1	3	328.390	1.972	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2CN(C3CC3)C[C@@H]2C)c([N+](=O)[O-])s1	ZINC000601370368	449884669	/nfs/dbraw/zinc/88/46/69/449884669.db2.gz	XTZDJXDBCIOFGG-GZMMTYOYSA-N	-1	3	345.446	1.726	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F)C1CC1	ZINC000601375331	449889847	/nfs/dbraw/zinc/88/98/47/449889847.db2.gz	HYVHOWMUBPPMOX-NSHDSACASA-N	-1	3	332.353	1.746	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-]	ZINC000618153203	450030128	/nfs/dbraw/zinc/03/01/28/450030128.db2.gz	JICBYKHZDOQVNV-SSDOTTSWSA-N	-1	3	331.254	1.933	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2C(=O)NCC2(C)C)c1[N+](=O)[O-]	ZINC000595357236	450073346	/nfs/dbraw/zinc/07/33/46/450073346.db2.gz	YDJHRKZJVVFMMU-LBPRGKRZSA-N	-1	3	341.389	1.015	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCNCc1nccs1	ZINC000609741403	450090016	/nfs/dbraw/zinc/09/00/16/450090016.db2.gz	CJDQBLFXJRPANR-UHFFFAOYSA-N	-1	3	342.402	1.119	20	5		EDBDHM
CCc1cc([N-]C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)no1	ZINC000610075874	450136158	/nfs/dbraw/zinc/13/61/58/450136158.db2.gz	USFIKUZVYMURNT-UHFFFAOYSA-N	-1	3	339.329	1.801	20	5		EDBDHM
CCOC(=O)c1[n-]c(C)nc1NC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000610109294	450141506	/nfs/dbraw/zinc/14/15/06/450141506.db2.gz	RSZRJTPMVFGPMH-UHFFFAOYSA-N	-1	3	348.315	1.821	20	5		EDBDHM
CCOC(=O)c1nc(C)[n-]c1NC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000610109294	450141513	/nfs/dbraw/zinc/14/15/13/450141513.db2.gz	RSZRJTPMVFGPMH-UHFFFAOYSA-N	-1	3	348.315	1.821	20	5		EDBDHM
CCOC(=O)c1nnc(CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)[n-]1	ZINC000615920308	450271681	/nfs/dbraw/zinc/27/16/81/450271681.db2.gz	VNGUASDJJQLUCN-UHFFFAOYSA-N	-1	3	333.304	1.128	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]c1c[nH]c(=O)cc1C	ZINC000619467750	450482449	/nfs/dbraw/zinc/48/24/49/450482449.db2.gz	BAXHNRIRUKRZBN-UHFFFAOYSA-N	-1	3	339.329	1.813	20	5		EDBDHM
CC[C@H](CCO)C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000094960472	536090474	/nfs/dbraw/zinc/09/04/74/536090474.db2.gz	ZBRJCWULHBXNHX-SECBINFHSA-N	-1	3	336.797	1.935	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)c2ccc[nH]2)c([N+](=O)[O-])c1	ZINC000760402939	580029991	/nfs/dbraw/zinc/02/99/91/580029991.db2.gz	GSSLLFBFZMZFLX-SECBINFHSA-N	-1	3	325.346	1.971	20	5		EDBDHM
C[C@H](CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)Cn1ccnc1	ZINC000736025455	578947285	/nfs/dbraw/zinc/94/72/85/578947285.db2.gz	GVNBXBAUHZJVCF-SECBINFHSA-N	-1	3	329.324	1.115	20	5		EDBDHM
C[C@H](CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)Cn1ccnc1	ZINC000736025455	578947286	/nfs/dbraw/zinc/94/72/86/578947286.db2.gz	GVNBXBAUHZJVCF-SECBINFHSA-N	-1	3	329.324	1.115	20	5		EDBDHM
CCOC(=O)C1(CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CCC1	ZINC000736591027	579003956	/nfs/dbraw/zinc/00/39/56/579003956.db2.gz	PERFZPDJYMETCS-UHFFFAOYSA-N	-1	3	346.347	1.920	20	5		EDBDHM
CCOC(=O)C1(CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CCC1	ZINC000736591027	579003957	/nfs/dbraw/zinc/00/39/57/579003957.db2.gz	PERFZPDJYMETCS-UHFFFAOYSA-N	-1	3	346.347	1.920	20	5		EDBDHM
C[C@H]1C[C@@H](N(C)C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CCN1C	ZINC000736758211	579017944	/nfs/dbraw/zinc/01/79/44/579017944.db2.gz	BZBWJYCFGOLORS-GWCFXTLKSA-N	-1	3	335.360	1.848	20	5		EDBDHM
COCCCNc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000736986195	579038292	/nfs/dbraw/zinc/03/82/92/579038292.db2.gz	JLPQZVRGLDTNCS-UHFFFAOYSA-N	-1	3	329.320	1.772	20	5		EDBDHM
COCCCNc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000736986195	579038293	/nfs/dbraw/zinc/03/82/93/579038293.db2.gz	JLPQZVRGLDTNCS-UHFFFAOYSA-N	-1	3	329.320	1.772	20	5		EDBDHM
O=C(NC1CC1)[C@H]1CCCN1c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000738022822	579151312	/nfs/dbraw/zinc/15/13/12/579151312.db2.gz	TUFMSJAKRBSLKW-CYBMUJFWSA-N	-1	3	343.347	1.022	20	5		EDBDHM
O=C(NC1CC1)[C@H]1CCCN1c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000738022822	579151314	/nfs/dbraw/zinc/15/13/14/579151314.db2.gz	TUFMSJAKRBSLKW-CYBMUJFWSA-N	-1	3	343.347	1.022	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C2(C(N)=O)CCC2)cc1[N+](=O)[O-]	ZINC000747902981	579662420	/nfs/dbraw/zinc/66/24/20/579662420.db2.gz	YBNIQBXLIBWHBN-UHFFFAOYSA-N	-1	3	347.780	1.243	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H](O)c2ccco2)c([N+](=O)[O-])c1	ZINC000751205893	579797390	/nfs/dbraw/zinc/79/73/90/579797390.db2.gz	WUDDZDULJUTDNG-LLVKDONJSA-N	-1	3	342.329	1.208	20	5		EDBDHM
O=[N+]([O-])c1cccc(CC[N-]S(=O)(=O)c2cccc3nonc32)c1	ZINC000758445524	579982772	/nfs/dbraw/zinc/98/27/72/579982772.db2.gz	VFWWQQLRLLJFIM-UHFFFAOYSA-N	-1	3	348.340	1.652	20	5		EDBDHM
O=C1CCCCN1CCC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768834374	580221685	/nfs/dbraw/zinc/22/16/85/580221685.db2.gz	BTVNNFFEYFWXSC-UHFFFAOYSA-N	-1	3	347.418	1.337	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]3OCC[C@H]32)cs1	ZINC000768857314	580222702	/nfs/dbraw/zinc/22/27/02/580222702.db2.gz	JCTZZPQTTNFFRX-AXFHLTTASA-N	-1	3	332.403	1.892	20	5		EDBDHM
CO[C@@H]1[C@H](C)[C@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1(C)C	ZINC000768888958	580223578	/nfs/dbraw/zinc/22/35/78/580223578.db2.gz	OBSZOEDLOLVOMH-PPKCKEKNSA-N	-1	3	334.419	1.994	20	5		EDBDHM
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@@H]1OC	ZINC000772956643	580324135	/nfs/dbraw/zinc/32/41/35/580324135.db2.gz	CANBPGVYQSMBNB-NGZCFLSTSA-N	-1	3	336.391	1.127	20	5		EDBDHM
O=C(NC1CCN(C[C@H]2CCCO2)CC1)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000772983297	580324761	/nfs/dbraw/zinc/32/47/61/580324761.db2.gz	YQMLRWYZVJPQOR-CQSZACIVSA-N	-1	3	349.387	1.674	20	5		EDBDHM
O=C(NCCc1ccccc1[N+](=O)[O-])c1cc2n[n-]nc2cc1F	ZINC000781947792	580560980	/nfs/dbraw/zinc/56/09/80/580560980.db2.gz	RRIARMAXYCBHBK-UHFFFAOYSA-N	-1	3	329.291	1.978	20	5		EDBDHM
CC(C)CCOC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000796274978	580949808	/nfs/dbraw/zinc/94/98/08/580949808.db2.gz	USEORIRGHLQWCH-UHFFFAOYSA-N	-1	3	330.362	1.462	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCN(C)[C@H](C)C2)cc1F	ZINC000866871504	590781084	/nfs/dbraw/zinc/78/10/84/590781084.db2.gz	OCUOJMPMUANKDR-MNOVXSKESA-N	-1	3	345.396	1.803	20	5		EDBDHM
COC[C@@H]1CN(Cc2ccc([O-])c(OC)c2[N+](=O)[O-])C[C@@H](C)O1	ZINC000893899799	591128729	/nfs/dbraw/zinc/12/87/29/591128729.db2.gz	JBMRNHHOIAJZGP-PWSUYJOCSA-N	-1	3	326.349	1.545	20	5		EDBDHM
Cn1c2ccccc2nc1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000017333334	591293501	/nfs/dbraw/zinc/29/35/01/591293501.db2.gz	HZGVCDZNZVLCMU-UHFFFAOYSA-N	-1	3	346.368	1.960	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@H]2C[C@H](C)OC2=O)c1	ZINC000841521597	593153617	/nfs/dbraw/zinc/15/36/17/593153617.db2.gz	FOZIVFOLLMWLCD-JGVFFNPUSA-N	-1	3	348.764	1.539	20	5		EDBDHM
CC(C)NC(=O)[C@H](C)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000839904429	593211649	/nfs/dbraw/zinc/21/16/49/593211649.db2.gz	RYFUJKNEBOXKIN-VIFPVBQESA-N	-1	3	329.303	1.716	20	5		EDBDHM
COc1cccc2c(C(=O)OCCn3cc([N+](=O)[O-])cn3)[n-]nc21	ZINC000808672953	593279165	/nfs/dbraw/zinc/27/91/65/593279165.db2.gz	IHRADMHHFDZTEG-UHFFFAOYSA-N	-1	3	331.288	1.533	20	5		EDBDHM
COc1cccc2c(C(=O)OCCn3cc([N+](=O)[O-])cn3)n[n-]c21	ZINC000808672953	593279167	/nfs/dbraw/zinc/27/91/67/593279167.db2.gz	IHRADMHHFDZTEG-UHFFFAOYSA-N	-1	3	331.288	1.533	20	5		EDBDHM
COC(=O)c1cc(C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)c[n-]1	ZINC000814531407	593592179	/nfs/dbraw/zinc/59/21/79/593592179.db2.gz	RHJFIFBLKZWBAN-UHFFFAOYSA-N	-1	3	332.268	1.749	20	5		EDBDHM
C[C@@H](Nc1ncc([N+](=O)[O-])c(N)n1)c1cccc(-c2nnn[n-]2)c1	ZINC000820461715	593820171	/nfs/dbraw/zinc/82/01/71/593820171.db2.gz	QLXPCDIKTLWMAP-SSDOTTSWSA-N	-1	3	327.308	1.320	20	5		EDBDHM
C[C@@H](Nc1ncc([N+](=O)[O-])c(N)n1)c1cccc(-c2nn[n-]n2)c1	ZINC000820461715	593820172	/nfs/dbraw/zinc/82/01/72/593820172.db2.gz	QLXPCDIKTLWMAP-SSDOTTSWSA-N	-1	3	327.308	1.320	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1OC(=O)c1cc(-c2nnn[n-]2)cn1C	ZINC000821845547	593953013	/nfs/dbraw/zinc/95/30/13/593953013.db2.gz	HTVOVTNRODKTAV-UHFFFAOYSA-N	-1	3	344.287	1.341	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1OC(=O)c1cc(-c2nn[n-]n2)cn1C	ZINC000821845547	593953014	/nfs/dbraw/zinc/95/30/14/593953014.db2.gz	HTVOVTNRODKTAV-UHFFFAOYSA-N	-1	3	344.287	1.341	20	5		EDBDHM
Cc1nccn1CCCCNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000822479266	594054964	/nfs/dbraw/zinc/05/49/64/594054964.db2.gz	ZALGQNJNELTXET-UHFFFAOYSA-N	-1	3	343.351	1.567	20	5		EDBDHM
Cc1nccn1CCCCNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000822479266	594054965	/nfs/dbraw/zinc/05/49/65/594054965.db2.gz	ZALGQNJNELTXET-UHFFFAOYSA-N	-1	3	343.351	1.567	20	5		EDBDHM
O=[N+]([O-])c1c(-c2nnn[n-]2)ccnc1NCCN1CCCCCC1	ZINC000823625143	594222582	/nfs/dbraw/zinc/22/25/82/594222582.db2.gz	QIVURNBDCOKDQP-UHFFFAOYSA-N	-1	3	332.368	1.458	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCO[C@@H]3CCCC[C@@H]32)c(-c2nnn[n-]2)c1	ZINC000823639901	594223775	/nfs/dbraw/zinc/22/37/75/594223775.db2.gz	LHKUZZJJGQGRQK-UONOGXRCSA-N	-1	3	330.348	1.923	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCO[C@@H]3CCCC[C@@H]32)c(-c2nn[n-]n2)c1	ZINC000823639901	594223776	/nfs/dbraw/zinc/22/37/76/594223776.db2.gz	LHKUZZJJGQGRQK-UONOGXRCSA-N	-1	3	330.348	1.923	20	5		EDBDHM
O=[N+]([O-])c1ccccc1NCCNc1ccc(-c2nnn[n-]2)nc1	ZINC000823647949	594224439	/nfs/dbraw/zinc/22/44/39/594224439.db2.gz	QQEARFAJARGTPS-UHFFFAOYSA-N	-1	3	326.320	1.694	20	5		EDBDHM
O=[N+]([O-])c1ccccc1NCCNc1ccc(-c2nn[n-]n2)nc1	ZINC000823647949	594224440	/nfs/dbraw/zinc/22/44/40/594224440.db2.gz	QQEARFAJARGTPS-UHFFFAOYSA-N	-1	3	326.320	1.694	20	5		EDBDHM
C[C@H]1C[C@@H](NC(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CN1C1CC1	ZINC000828177378	594359231	/nfs/dbraw/zinc/35/92/31/594359231.db2.gz	PGTSFOCQLYNZSZ-JOYOIKCWSA-N	-1	3	333.344	1.648	20	5		EDBDHM
Cc1nn(CN(C)c2ccccc2-c2nnn[n-]2)c(C)c1[N+](=O)[O-]	ZINC000826335002	594430805	/nfs/dbraw/zinc/43/08/05/594430805.db2.gz	SWGNAIHRIWRWET-UHFFFAOYSA-N	-1	3	328.336	1.682	20	5		EDBDHM
Cc1nn(CN(C)c2ccccc2-c2nn[n-]n2)c(C)c1[N+](=O)[O-]	ZINC000826335002	594430806	/nfs/dbraw/zinc/43/08/06/594430806.db2.gz	SWGNAIHRIWRWET-UHFFFAOYSA-N	-1	3	328.336	1.682	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N[C@@H]3CCOC3)cc(-c3nnn[n-]3)c2c1	ZINC000826499328	594503577	/nfs/dbraw/zinc/50/35/77/594503577.db2.gz	FBCIQYKCGYETNM-MRVPVSSYSA-N	-1	3	327.304	1.524	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N[C@@H]3CCOC3)cc(-c3nn[n-]n3)c2c1	ZINC000826499328	594503578	/nfs/dbraw/zinc/50/35/78/594503578.db2.gz	FBCIQYKCGYETNM-MRVPVSSYSA-N	-1	3	327.304	1.524	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCc3cc(F)ccc3C2)c(-c2nnn[n-]2)c1	ZINC000826500654	594503697	/nfs/dbraw/zinc/50/36/97/594503697.db2.gz	GYUHSVLXIIWVGR-UHFFFAOYSA-N	-1	3	341.306	1.872	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCc3cc(F)ccc3C2)c(-c2nn[n-]n2)c1	ZINC000826500654	594503699	/nfs/dbraw/zinc/50/36/99/594503699.db2.gz	GYUHSVLXIIWVGR-UHFFFAOYSA-N	-1	3	341.306	1.872	20	5		EDBDHM
CC(C)C[C@@H](C)OC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000837698058	595171566	/nfs/dbraw/zinc/17/15/66/595171566.db2.gz	FLLNIHNUIRTQRL-LLVKDONJSA-N	-1	3	344.389	1.851	20	5		EDBDHM
CN1CCC(O[N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000846648302	595292808	/nfs/dbraw/zinc/29/28/08/595292808.db2.gz	WASUMKRQDGLLHK-UHFFFAOYSA-N	-1	3	329.303	1.829	20	5		EDBDHM
COC(=O)C(C)(C)C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848584812	595409744	/nfs/dbraw/zinc/40/97/44/595409744.db2.gz	ITTVEMUPBISLEE-UHFFFAOYSA-N	-1	3	346.286	1.882	20	5		EDBDHM
CC(C)(C)OC(=O)NCc1cn(-c2ccc([O-])cc2[N+](=O)[O-])nn1	ZINC000849149130	595488569	/nfs/dbraw/zinc/48/85/69/595488569.db2.gz	CBVQITDOOKWUHN-UHFFFAOYSA-N	-1	3	335.320	1.906	20	5		EDBDHM
O=c1nc(Cl)cc(N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)[n-]1	ZINC000858455744	595799869	/nfs/dbraw/zinc/79/98/69/595799869.db2.gz	UEJROJXSOIUZGS-MRVPVSSYSA-N	-1	3	336.739	1.830	20	5		EDBDHM
Cc1cc(F)cc(C(=O)[N-]OCCN2CCCC2=O)c1[N+](=O)[O-]	ZINC000856041135	595882804	/nfs/dbraw/zinc/88/28/04/595882804.db2.gz	MDPQKWSTONANRJ-UHFFFAOYSA-N	-1	3	325.296	1.326	20	5		EDBDHM
COC(=O)N(C)CC[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853850930	595900890	/nfs/dbraw/zinc/90/08/90/595900890.db2.gz	QBYULIYOPZOXIN-UHFFFAOYSA-N	-1	3	347.274	1.381	20	5		EDBDHM
Cc1cc(=O)[n-]c(C(C)(C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000852144828	596061037	/nfs/dbraw/zinc/06/10/37/596061037.db2.gz	CXPXHFXORPKDHQ-CYBMUJFWSA-N	-1	3	332.360	1.957	20	5		EDBDHM
CCN1CCC[C@H]1C[N-]S(=O)(=O)c1cc(F)c(C)cc1[N+](=O)[O-]	ZINC000866393530	596874415	/nfs/dbraw/zinc/87/44/15/596874415.db2.gz	GUJVWQRTGJRVAY-NSHDSACASA-N	-1	3	345.396	1.805	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N3CCC[C@H](O)C3)cc(-c3nnn[n-]3)c2c1	ZINC000738366602	599253738	/nfs/dbraw/zinc/25/37/38/599253738.db2.gz	FYBGXZLMGUFWFR-JTQLQIEISA-N	-1	3	341.331	1.284	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(N3CCC[C@H](O)C3)cc(-c3nn[n-]n3)c2c1	ZINC000738366602	599253740	/nfs/dbraw/zinc/25/37/40/599253740.db2.gz	FYBGXZLMGUFWFR-JTQLQIEISA-N	-1	3	341.331	1.284	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCC2(O)CCCCCC2)c(-c2nnn[n-]2)c1	ZINC000738375312	599267571	/nfs/dbraw/zinc/26/75/71/599267571.db2.gz	YJSDEWXIWUOARI-UHFFFAOYSA-N	-1	3	333.352	1.667	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCC2(O)CCCCCC2)c(-c2nn[n-]n2)c1	ZINC000738375312	599267572	/nfs/dbraw/zinc/26/75/72/599267572.db2.gz	YJSDEWXIWUOARI-UHFFFAOYSA-N	-1	3	333.352	1.667	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@@H]2c3ccccc3C[C@@H]2O)c(-c2nnn[n-]2)c1	ZINC000738373482	598499940	/nfs/dbraw/zinc/49/99/40/598499940.db2.gz	DOFDXHCKGPINER-QWHCGFSZSA-N	-1	3	339.315	1.240	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@@H]2c3ccccc3C[C@@H]2O)c(-c2nn[n-]n2)c1	ZINC000738373482	598499942	/nfs/dbraw/zinc/49/99/42/598499942.db2.gz	DOFDXHCKGPINER-QWHCGFSZSA-N	-1	3	339.315	1.240	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCNc2ccccn2)c(-c2nnn[n-]2)c1	ZINC000738374248	598500196	/nfs/dbraw/zinc/50/01/96/598500196.db2.gz	LRETYIDXYOBENK-UHFFFAOYSA-N	-1	3	341.335	1.479	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCNc2ccccn2)c(-c2nn[n-]n2)c1	ZINC000738374248	598500197	/nfs/dbraw/zinc/50/01/97/598500197.db2.gz	LRETYIDXYOBENK-UHFFFAOYSA-N	-1	3	341.335	1.479	20	5		EDBDHM
CS[C@H](CO)[C@@H](C)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000230193117	295663048	/nfs/dbraw/zinc/66/30/48/295663048.db2.gz	YPGJPOAJNREPNL-MWLCHTKSSA-N	-1	3	334.419	1.294	20	5		EDBDHM
O=c1cc(Cn2cnc3cc([N+](=O)[O-])ccc3c2=O)nc(C2CC2)[n-]1	ZINC000412983097	304048540	/nfs/dbraw/zinc/04/85/40/304048540.db2.gz	MAIBLANKBNIURU-UHFFFAOYSA-N	-1	3	339.311	1.726	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]C[C@H]1CCC[C@@H]1O	ZINC000089165743	138273432	/nfs/dbraw/zinc/27/34/32/138273432.db2.gz	BIHKKTWHCAKSRH-KCJUWKMLSA-N	-1	3	334.781	1.688	20	5		EDBDHM
CN1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCC1=O	ZINC000160097226	283245124	/nfs/dbraw/zinc/24/51/24/283245124.db2.gz	DNFSJPMNWWXADB-MRVPVSSYSA-N	-1	3	347.780	1.147	20	5		EDBDHM
NC(=O)c1csc(NC(=O)c2n[n-]c3ccc([N+](=O)[O-])cc32)n1	ZINC000118705272	283393996	/nfs/dbraw/zinc/39/39/96/283393996.db2.gz	GRUATTQCWQDOEF-UHFFFAOYSA-N	-1	3	332.301	1.279	20	5		EDBDHM
Cc1noc(C)c1S(=O)(=O)[N-]CCc1ccc([N+](=O)[O-])cc1	ZINC000036136983	202317483	/nfs/dbraw/zinc/31/74/83/202317483.db2.gz	RCZZIFZVXKTKGW-UHFFFAOYSA-N	-1	3	325.346	1.721	20	5		EDBDHM
CS[C@@H]1CN(c2nc(C)cc(C(=O)[O-])c2[N+](=O)[O-])C[C@@H]1N(C)C	ZINC000565034944	306373537	/nfs/dbraw/zinc/37/35/37/306373537.db2.gz	IYBZXFXHOMTFHK-WDEREUQCSA-N	-1	3	340.405	1.478	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(C)(C)O	ZINC000293737923	201343513	/nfs/dbraw/zinc/34/35/13/201343513.db2.gz	HGMWLPMZNIZPTC-GFCCVEGCSA-N	-1	3	332.378	1.431	20	5		EDBDHM
CCN1CCCC[C@@H]1C[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000111352609	204352958	/nfs/dbraw/zinc/35/29/58/204352958.db2.gz	KFXKPHXPBXHSDY-LLVKDONJSA-N	-1	3	345.396	1.887	20	5		EDBDHM
CCN1CCCC[C@@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000111352912	220143593	/nfs/dbraw/zinc/14/35/93/220143593.db2.gz	CGCVFSCIPHGWJZ-GFCCVEGCSA-N	-1	3	345.396	1.887	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000416633158	251091395	/nfs/dbraw/zinc/09/13/95/251091395.db2.gz	GQFWXKPGZSKMRA-NWDGAFQWSA-N	-1	3	328.390	1.733	20	5		EDBDHM
CCOC(=O)C(CC)(CC)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000490553562	255091682	/nfs/dbraw/zinc/09/16/82/255091682.db2.gz	CCZIQVRKJLPZPY-UHFFFAOYSA-N	-1	3	344.389	1.995	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCCCCCO	ZINC000271741454	140342480	/nfs/dbraw/zinc/34/24/80/140342480.db2.gz	AATABRAYIJJALY-UHFFFAOYSA-N	-1	3	332.378	1.434	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)[C@@H]1CCCCO1	ZINC000272020762	140388587	/nfs/dbraw/zinc/38/85/87/140388587.db2.gz	HUKMURMYHHIJRW-PWSUYJOCSA-N	-1	3	344.389	1.839	20	5		EDBDHM
C[C@H]1CN(Cc2cc([O-])ccc2[N+](=O)[O-])CC[C@H]1N1CCN(C)CC1	ZINC000332403330	141176300	/nfs/dbraw/zinc/17/63/00/141176300.db2.gz	VLWBSEWFFXEBHL-WMLDXEAASA-N	-1	3	348.447	1.758	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC2([S@@](C)=O)CCC2)c([N+](=O)[O-])c1	ZINC000332491104	141190366	/nfs/dbraw/zinc/19/03/66/141190366.db2.gz	SVHBWHARHUIUAL-OAQYLSRUSA-N	-1	3	346.430	1.483	20	5		EDBDHM
O=[N+]([O-])c1cccc(CS(=O)(=O)[N-]Cc2noc(C3CC3)n2)c1	ZINC000343105035	142800439	/nfs/dbraw/zinc/80/04/39/142800439.db2.gz	UIBAYLMREMAAHB-UHFFFAOYSA-N	-1	3	338.345	1.475	20	5		EDBDHM
CCSc1nnc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)s1	ZINC000344781587	143011328	/nfs/dbraw/zinc/01/13/28/143011328.db2.gz	WPDPJTNDBQQODZ-UHFFFAOYSA-N	-1	3	327.347	1.911	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2CCC[C@@H](CO)C2)c(F)c1	ZINC000344954738	143030543	/nfs/dbraw/zinc/03/05/43/143030543.db2.gz	FZSMHIXNGGANIO-WDEREUQCSA-N	-1	3	346.380	1.811	20	5		EDBDHM
Cc1ncc(CNC(=O)CCOc2ccccc2[N+](=O)[O-])c(=O)[n-]1	ZINC000345104478	143050895	/nfs/dbraw/zinc/05/08/95/143050895.db2.gz	IUNUYIGIDAMNEE-UHFFFAOYSA-N	-1	3	332.316	1.484	20	5		EDBDHM
CNC(=O)[C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000345513830	143100653	/nfs/dbraw/zinc/10/06/53/143100653.db2.gz	DPWMJFJJIBPLFQ-GHMZBOCLSA-N	-1	3	341.389	1.096	20	5		EDBDHM
CCC[C@@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)OC	ZINC000358602455	151430176	/nfs/dbraw/zinc/43/01/76/151430176.db2.gz	RGNFXEOTUSTCJP-SNVBAGLBSA-N	-1	3	330.362	1.523	20	5		EDBDHM
O=C([N-]c1nncn1-c1cccnc1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000360608211	152120140	/nfs/dbraw/zinc/12/01/40/152120140.db2.gz	SCSHWDCOFPEUNT-UHFFFAOYSA-N	-1	3	328.263	1.962	20	5		EDBDHM
CCOC(=O)c1cc(C(=O)NCc2ncccc2[O-])cc([N+](=O)[O-])c1	ZINC000352502443	162216247	/nfs/dbraw/zinc/21/62/47/162216247.db2.gz	UYKOIRYDPMKXQH-UHFFFAOYSA-N	-1	3	345.311	1.802	20	5		EDBDHM
O=C(NCc1ncccc1[O-])c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	ZINC000352508921	162220520	/nfs/dbraw/zinc/22/05/20/162220520.db2.gz	OAFBKHFSRVFPDQ-UHFFFAOYSA-N	-1	3	339.311	1.811	20	5		EDBDHM
CC[C@H](C)[C@](C)(O)C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000119230110	287350920	/nfs/dbraw/zinc/35/09/20/287350920.db2.gz	XCZZUNIWWUUHBC-SMDDNHRTSA-N	-1	3	330.406	1.979	20	5		EDBDHM
O=C(c1c([O-])cccc1O)N1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000125572617	287408709	/nfs/dbraw/zinc/40/87/09/287408709.db2.gz	LQXICWXGDODBPP-UHFFFAOYSA-N	-1	3	343.339	1.968	20	5		EDBDHM
CCc1[nH]nc([N-]C(=O)c2n[nH]cc2[N+](=O)[O-])c1Br	ZINC000126836228	287428721	/nfs/dbraw/zinc/42/87/21/287428721.db2.gz	GQTLEUKWQGIYPF-UHFFFAOYSA-N	-1	3	329.114	1.618	20	5		EDBDHM
COCC[C@@H](COC)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000352523705	292630520	/nfs/dbraw/zinc/63/05/20/292630520.db2.gz	UAPRRJRJVHWAPH-NSHDSACASA-N	-1	3	332.378	1.233	20	5		EDBDHM
CCOC(=O)N1CC[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000274699515	268187888	/nfs/dbraw/zinc/18/78/88/268187888.db2.gz	XZRADJVGQRXNPI-JTQLQIEISA-N	-1	3	343.361	1.104	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]C[C@@H]2CCC[C@H]2O)cc1[N+](=O)[O-]	ZINC000274718951	268190783	/nfs/dbraw/zinc/19/07/83/268190783.db2.gz	BSQBNNKIMPGRGA-TVQRCGJNSA-N	-1	3	332.353	1.482	20	5		EDBDHM
O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000274885932	268230296	/nfs/dbraw/zinc/23/02/96/268230296.db2.gz	KFPOQIDCHCXYSJ-AWEZNQCLSA-N	-1	3	342.355	1.700	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@H]2CCO)c([N+](=O)[O-])c1	ZINC000275029330	268268511	/nfs/dbraw/zinc/26/85/11/268268511.db2.gz	ADVMSGSSVWHGIL-CMPLNLGQSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COCCC(C)(C)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000273568666	273045532	/nfs/dbraw/zinc/04/55/32/273045532.db2.gz	GDFMLXWSRYVHQM-UHFFFAOYSA-N	-1	3	346.405	1.944	20	5		EDBDHM
CCN1CCC[C@@H]([N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C1	ZINC000193820260	276167620	/nfs/dbraw/zinc/16/76/20/276167620.db2.gz	FZVYYLJEALKQOV-CYBMUJFWSA-N	-1	3	341.433	1.974	20	5		EDBDHM
C[C@]1(C[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2)NC(=O)[N-]C1=O	ZINC000286102616	287935985	/nfs/dbraw/zinc/93/59/85/287935985.db2.gz	FKPPFPMBCDYNLW-BLLLJJGKSA-N	-1	3	346.343	1.188	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCC1(C)C	ZINC000286783738	288086045	/nfs/dbraw/zinc/08/60/45/288086045.db2.gz	RMJZYNWPCQPOAV-GFCCVEGCSA-N	-1	3	342.373	1.848	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2=CCCOC2)c1C	ZINC000287366025	288220733	/nfs/dbraw/zinc/22/07/33/288220733.db2.gz	ILYDOASNZNEQKE-UHFFFAOYSA-N	-1	3	326.374	1.837	20	5		EDBDHM
COCCSc1ccc([N+](=O)[O-])cc1C(=O)[N-]c1ncn(C)n1	ZINC000294483919	303113881	/nfs/dbraw/zinc/11/38/81/303113881.db2.gz	JJAIHDBALHZPRN-UHFFFAOYSA-N	-1	3	337.361	1.714	20	5		EDBDHM
CC(C)c1nnc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)[nH]1	ZINC000295191044	303186105	/nfs/dbraw/zinc/18/61/05/303186105.db2.gz	DBLWMILDVUZFHS-UHFFFAOYSA-N	-1	3	343.340	1.454	20	5		EDBDHM
COC(=O)CCCO[N-]C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000295923460	303283975	/nfs/dbraw/zinc/28/39/75/303283975.db2.gz	FNDQOONKLOLRDD-UHFFFAOYSA-N	-1	3	338.316	1.559	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)n[nH]1	ZINC000297029957	303355708	/nfs/dbraw/zinc/35/57/08/303355708.db2.gz	KYWYQXISWBVYFM-UHFFFAOYSA-N	-1	3	325.350	1.062	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCO[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000330594701	303771388	/nfs/dbraw/zinc/77/13/88/303771388.db2.gz	BBALCAZTLYMNCE-NXEZZACHSA-N	-1	3	330.362	1.449	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCC[C@H]1CCOC1	ZINC000452018617	305378809	/nfs/dbraw/zinc/37/88/09/305378809.db2.gz	OPAVPNZGSFECQN-NSHDSACASA-N	-1	3	344.389	1.698	20	5		EDBDHM
CN(C)S(=O)(=O)c1ccc(C(=O)[N-]c2cccc([N+](=O)[O-])c2)o1	ZINC000047442632	441189285	/nfs/dbraw/zinc/18/92/85/441189285.db2.gz	SLVHYYJFESRLAF-UHFFFAOYSA-N	-1	3	339.329	1.690	20	5		EDBDHM
COc1cc(CNC[C@H]2CN(C3CC3)CCO2)c([N+](=O)[O-])cc1[O-]	ZINC000106380013	441336542	/nfs/dbraw/zinc/33/65/42/441336542.db2.gz	AXDUYDNTSPZWMW-ZDUSSCGKSA-N	-1	3	337.376	1.262	20	5		EDBDHM
Cc1nc(CC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cs1	ZINC000029395547	441458208	/nfs/dbraw/zinc/45/82/08/441458208.db2.gz	FZZFKTHIARBDQJ-UHFFFAOYSA-N	-1	3	327.387	1.881	20	5		EDBDHM
CCNC(=O)[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000055978521	441679001	/nfs/dbraw/zinc/67/90/01/441679001.db2.gz	XREVFIQIHMVZQJ-ZETCQYMHSA-N	-1	3	335.769	1.051	20	5		EDBDHM
C[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CN1C1CC1	ZINC000126190340	442087236	/nfs/dbraw/zinc/08/72/36/442087236.db2.gz	ZMOGCSPOHRXACE-GHMZBOCLSA-N	-1	3	325.390	1.498	20	5		EDBDHM
CCCCn1c(=O)[n-]nc1S(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000151861701	442131583	/nfs/dbraw/zinc/13/15/83/442131583.db2.gz	FXYRNHCWHKHSNX-UHFFFAOYSA-N	-1	3	340.361	1.666	20	5		EDBDHM
CCN1CCC[C@@H]([N-]S(=O)(=O)c2cc(F)c(C)c([N+](=O)[O-])c2)C1	ZINC000186388511	442524463	/nfs/dbraw/zinc/52/44/63/442524463.db2.gz	JPGGVAMOOHZIKN-LLVKDONJSA-N	-1	3	345.396	1.805	20	5		EDBDHM
CC[C@]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])(C(N)=O)C(C)C	ZINC000181527252	442701977	/nfs/dbraw/zinc/70/19/77/442701977.db2.gz	SSZAAIUXWCQQFU-CYBMUJFWSA-N	-1	3	329.378	1.163	20	5		EDBDHM
CCN1CCC[C@@H]1C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000193208664	442722537	/nfs/dbraw/zinc/72/25/37/442722537.db2.gz	HOVGINAVQXGQMZ-LLVKDONJSA-N	-1	3	343.405	1.366	20	5		EDBDHM
COc1nnc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)[n-]1	ZINC000183008249	442863351	/nfs/dbraw/zinc/86/33/51/442863351.db2.gz	YMSRKNIBWPSDHT-UHFFFAOYSA-N	-1	3	342.109	1.736	20	5		EDBDHM
COc1n[n-]c(NC(=O)c2ccc([N+](=O)[O-])cc2Br)n1	ZINC000183008249	442863352	/nfs/dbraw/zinc/86/33/52/442863352.db2.gz	YMSRKNIBWPSDHT-UHFFFAOYSA-N	-1	3	342.109	1.736	20	5		EDBDHM
COc1nc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)n[n-]1	ZINC000183008249	442863355	/nfs/dbraw/zinc/86/33/55/442863355.db2.gz	YMSRKNIBWPSDHT-UHFFFAOYSA-N	-1	3	342.109	1.736	20	5		EDBDHM
COC(=O)c1ccc(S(=O)(=O)[N-]CCCCF)cc1[N+](=O)[O-]	ZINC000416485041	319432616	/nfs/dbraw/zinc/43/26/16/319432616.db2.gz	YOFDXOUPYFYQDY-UHFFFAOYSA-N	-1	3	334.325	1.409	20	5		EDBDHM
CC[C@](C)([N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)C(=O)OC	ZINC000272440970	443317236	/nfs/dbraw/zinc/31/72/36/443317236.db2.gz	IJTFWIMJEKOVFT-AWEZNQCLSA-N	-1	3	344.389	1.398	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC1([S@@](C)=O)CC1	ZINC000282465611	443347699	/nfs/dbraw/zinc/34/76/99/443347699.db2.gz	ICFWODBZCQIRRO-HXUWFJFHSA-N	-1	3	332.403	1.093	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2CCCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000269766547	443431881	/nfs/dbraw/zinc/43/18/81/443431881.db2.gz	LIFKLGAKYNMQMH-GXFFZTMASA-N	-1	3	344.389	1.433	20	5		EDBDHM
CC1(C)C[C@@H]([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C(=O)O1	ZINC000272324427	443591470	/nfs/dbraw/zinc/59/14/70/443591470.db2.gz	KFZVRYYKEFOCLT-SNVBAGLBSA-N	-1	3	328.271	1.897	20	5		EDBDHM
CCC(CC)([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C(N)=O	ZINC000272177959	443548408	/nfs/dbraw/zinc/54/84/08/443548408.db2.gz	IMOBUXQPCPNLDO-UHFFFAOYSA-N	-1	3	329.303	1.847	20	5		EDBDHM
O=C(c1cccc([O-])c1)N1CCN(c2ncc([N+](=O)[O-])cn2)CC1	ZINC000273161522	443554671	/nfs/dbraw/zinc/55/46/71/443554671.db2.gz	KQPHUYDLPURRBV-UHFFFAOYSA-N	-1	3	329.316	1.053	20	5		EDBDHM
COC(=O)[C@@H]([N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C1CC1	ZINC000276573438	443751025	/nfs/dbraw/zinc/75/10/25/443751025.db2.gz	AYIAUMPARXFUQQ-NSHDSACASA-N	-1	3	342.373	1.442	20	5		EDBDHM
CCN(C)CC[N-]S(=O)(=O)c1cc([N+](=O)[O-])cc(Cl)c1F	ZINC000281067824	443809094	/nfs/dbraw/zinc/80/90/94/443809094.db2.gz	AEABAPJHEFABAV-UHFFFAOYSA-N	-1	3	339.776	1.617	20	5		EDBDHM
COC[C@@H](C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])OC	ZINC000276888860	443865855	/nfs/dbraw/zinc/86/58/55/443865855.db2.gz	UDECHNVWRRXGKB-LLVKDONJSA-N	-1	3	332.378	1.151	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@H](C)N1CCCC1	ZINC000548370393	320877494	/nfs/dbraw/zinc/87/74/94/320877494.db2.gz	RDUSBSLCVVPKLY-LBPRGKRZSA-N	-1	3	327.406	1.666	20	5		EDBDHM
Cc1ccc(C(=O)Nc2[n-]nnc2C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000297623944	444310212	/nfs/dbraw/zinc/31/02/12/444310212.db2.gz	BOPLAENLZYWDNZ-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
Cc1ccc(C(=O)Nc2nn[n-]c2C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000297623944	444310213	/nfs/dbraw/zinc/31/02/13/444310213.db2.gz	BOPLAENLZYWDNZ-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
Cc1ccc(C(=O)Nc2n[n-]nc2C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000297623944	444310215	/nfs/dbraw/zinc/31/02/15/444310215.db2.gz	BOPLAENLZYWDNZ-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)C(C)C	ZINC000317258938	444314904	/nfs/dbraw/zinc/31/49/04/444314904.db2.gz	VADHUZBTVDBPEH-VIFPVBQESA-N	-1	3	330.362	1.704	20	5		EDBDHM
CS[C@H]1CN(c2cc(C(=O)[O-])ccc2[N+](=O)[O-])C[C@@H]1N(C)C	ZINC000578196034	321736574	/nfs/dbraw/zinc/73/65/74/321736574.db2.gz	WFLOSOIYPGCYIL-STQMWFEESA-N	-1	3	325.390	1.775	20	5		EDBDHM
CN1CCN(c2ccc([N+](=O)[O-])c3cnccc32)C[C@H](C(=O)[O-])C1	ZINC000581551368	322191614	/nfs/dbraw/zinc/19/16/14/322191614.db2.gz	LIXDTDZUJKIWNR-LLVKDONJSA-N	-1	3	330.344	1.596	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])c(NCc2nnc(C(F)(F)F)[n-]2)n1	ZINC000343013332	445006378	/nfs/dbraw/zinc/00/63/78/445006378.db2.gz	SPZZDZWPCPSCJP-UHFFFAOYSA-N	-1	3	346.225	1.525	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])c(NCc2n[n-]c(C(F)(F)F)n2)n1	ZINC000343013332	445006381	/nfs/dbraw/zinc/00/63/81/445006381.db2.gz	SPZZDZWPCPSCJP-UHFFFAOYSA-N	-1	3	346.225	1.525	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])c(NCc2nc(C(F)(F)F)n[n-]2)n1	ZINC000343013332	445006383	/nfs/dbraw/zinc/00/63/83/445006383.db2.gz	SPZZDZWPCPSCJP-UHFFFAOYSA-N	-1	3	346.225	1.525	20	5		EDBDHM
O=C(COc1ccccc1[N+](=O)[O-])[N-]c1ncnn1-c1ccccc1	ZINC000339176001	445073055	/nfs/dbraw/zinc/07/30/55/445073055.db2.gz	ZHSKRLRSWVLOFE-UHFFFAOYSA-N	-1	3	339.311	1.615	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1C[N-]S(=O)(=O)c1cncc(F)c1	ZINC000339176789	445074587	/nfs/dbraw/zinc/07/45/87/445074587.db2.gz	VCZQOSQZBPILBL-UHFFFAOYSA-N	-1	3	341.320	1.616	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCNC(=O)C(C)C)c1[N+](=O)[O-]	ZINC000189807258	533706669	/nfs/dbraw/zinc/70/66/69/533706669.db2.gz	ZTPFOMDGPDOXFM-UHFFFAOYSA-N	-1	3	343.405	1.262	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@@H](C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)on1	ZINC000357091519	445423041	/nfs/dbraw/zinc/42/30/41/445423041.db2.gz	AQWVUPJHRXIAPC-SECBINFHSA-N	-1	3	339.329	1.692	20	5		EDBDHM
O=C(CNC(=O)c1cccc([O-])c1)NCc1ccc([N+](=O)[O-])cc1	ZINC000348937626	445448248	/nfs/dbraw/zinc/44/82/48/445448248.db2.gz	BDIFNZGVGVZJCZ-UHFFFAOYSA-N	-1	3	329.312	1.347	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]Cc1ccc(F)cn1	ZINC000357146194	445453729	/nfs/dbraw/zinc/45/37/29/445453729.db2.gz	CMRRJAFCPJVTLB-UHFFFAOYSA-N	-1	3	325.321	1.916	20	5		EDBDHM
CNS(=O)(=O)c1cc([N-]C(=O)c2ccc([N+](=O)[O-])o2)ccc1F	ZINC000355802063	445486358	/nfs/dbraw/zinc/48/63/58/445486358.db2.gz	QYNBQJDXYZOGNO-UHFFFAOYSA-N	-1	3	343.292	1.487	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](C)C[S@](C)=O)c1[N+](=O)[O-]	ZINC000190142130	533707411	/nfs/dbraw/zinc/70/74/11/533707411.db2.gz	GLYFHTSKMCJOCF-SBKAZYGRSA-N	-1	3	334.419	1.257	20	5		EDBDHM
O=C(Nc1ccc(N2CCOCC2)nc1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000361912585	446060370	/nfs/dbraw/zinc/06/03/70/446060370.db2.gz	RNNLCKNZPUVSEY-UHFFFAOYSA-N	-1	3	345.315	1.179	20	5		EDBDHM
COc1c(C(=O)N2CCC[C@@H]2c2nc(=N)n(C)[n-]2)cccc1[N+](=O)[O-]	ZINC000584058020	326192547	/nfs/dbraw/zinc/19/25/47/326192547.db2.gz	FRSGYGXSASYXGO-LLVKDONJSA-N	-1	3	346.347	1.122	20	5		EDBDHM
COc1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc1NC(C)=O	ZINC000361914433	446063048	/nfs/dbraw/zinc/06/30/48/446063048.db2.gz	BYIODADKYSIZIX-UHFFFAOYSA-N	-1	3	346.299	1.915	20	5		EDBDHM
CN1CCC[C@@H](N2CCN(C(=O)c3ccc([N+](=O)[O-])c([O-])c3)CC2)C1	ZINC000369345108	446088360	/nfs/dbraw/zinc/08/83/60/446088360.db2.gz	SROWURNTOKESDX-CQSZACIVSA-N	-1	3	348.403	1.152	20	5		EDBDHM
COCCCN1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC1	ZINC000373491341	446236120	/nfs/dbraw/zinc/23/61/20/446236120.db2.gz	YKCCMYUKCCIORI-UHFFFAOYSA-N	-1	3	337.376	1.485	20	5		EDBDHM
O=C(Nc1cnn(-c2ncccc2F)c1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000370498327	446307015	/nfs/dbraw/zinc/30/70/15/446307015.db2.gz	GTRWYQGDFRUOSR-UHFFFAOYSA-N	-1	3	344.262	1.668	20	5		EDBDHM
Cc1cc(C(=O)N2CCC[C@@H](n3cncn3)C2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375091314	446574116	/nfs/dbraw/zinc/57/41/16/446574116.db2.gz	RHKPIQKXWVFUSY-SNVBAGLBSA-N	-1	3	332.320	1.073	20	5		EDBDHM
N[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C[C@H]1c1ccccc1	ZINC000375936384	447161367	/nfs/dbraw/zinc/16/13/67/447161367.db2.gz	WTXNHXSDYFRUSP-UONOGXRCSA-N	-1	3	327.340	1.867	20	5		EDBDHM
CC1(C)CCCN1CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000452093141	447815396	/nfs/dbraw/zinc/81/53/96/447815396.db2.gz	VVBMCRBZUZGCNQ-UHFFFAOYSA-N	-1	3	333.435	1.809	20	5		EDBDHM
Cc1ncc(S(=O)(=O)[N-]CCOc2ccc([N+](=O)[O-])cc2)s1	ZINC000533174480	448368164	/nfs/dbraw/zinc/36/81/64/448368164.db2.gz	LQSKQFYSJOEIAC-UHFFFAOYSA-N	-1	3	343.386	1.717	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1CS[C@@H](C)C1	ZINC000591331924	448327055	/nfs/dbraw/zinc/32/70/55/448327055.db2.gz	XKMSMGHYTHDISC-DTWKUNHWSA-N	-1	3	332.403	1.776	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)C(C)C	ZINC000517209393	448551644	/nfs/dbraw/zinc/55/16/44/448551644.db2.gz	BTKQEQYOBWFFGL-NSHDSACASA-N	-1	3	332.378	1.553	20	5		EDBDHM
O=C([O-])[C@@]1(c2ccccc2)CCN(CCn2ccc([N+](=O)[O-])n2)C1	ZINC000518200261	448654095	/nfs/dbraw/zinc/65/40/95/448654095.db2.gz	IJYIDWRXSGJAPN-INIZCTEOSA-N	-1	3	330.344	1.520	20	5		EDBDHM
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC[C@@H](C)N2CCC[C@@H](C)C2)n1	ZINC000574159176	448804427	/nfs/dbraw/zinc/80/44/27/448804427.db2.gz	HIVANBBVENVCKV-ZYHUDNBSSA-N	-1	3	336.392	2.529	20	5		EDBDHM
C[C@@H]1C[C@@H]1N1CCN(c2ncc(C(=O)[O-])cc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000568869276	448932353	/nfs/dbraw/zinc/93/23/53/448932353.db2.gz	ULAZQXFZTZUDNB-LOWVWBTDSA-N	-1	3	334.376	1.855	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]CC1CC(F)(F)C1	ZINC000589919387	449078759	/nfs/dbraw/zinc/07/87/59/449078759.db2.gz	POUJOAXTYKUYRW-UHFFFAOYSA-N	-1	3	336.316	1.927	20	5		EDBDHM
CCC1(O)CCC([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CC1	ZINC000593572391	449081219	/nfs/dbraw/zinc/08/12/19/449081219.db2.gz	MSMNNJIHYAPXCW-UHFFFAOYSA-N	-1	3	329.378	1.352	20	5		EDBDHM
Nc1nccc(C(=O)[N-]c2nc3c(s2)C(=O)CCC3)c1[N+](=O)[O-]	ZINC000548712974	449087019	/nfs/dbraw/zinc/08/70/19/449087019.db2.gz	HGMPEQHANGMCQJ-UHFFFAOYSA-N	-1	3	333.329	1.800	20	5		EDBDHM
Cn1c([N-]C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)nnc1C1CC1	ZINC000597897521	449137671	/nfs/dbraw/zinc/13/76/71/449137671.db2.gz	OQMVYORKEUWXMO-UHFFFAOYSA-N	-1	3	331.288	1.582	20	5		EDBDHM
CC1(C)C[C@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCO1	ZINC000593605537	449103138	/nfs/dbraw/zinc/10/31/38/449103138.db2.gz	IQGGWFNSMNQGJZ-SNVBAGLBSA-N	-1	3	329.378	1.473	20	5		EDBDHM
CCOCC(C)(C)[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000590162505	449112517	/nfs/dbraw/zinc/11/25/17/449112517.db2.gz	VKXSWDADQGCYMS-UHFFFAOYSA-N	-1	3	332.378	1.697	20	5		EDBDHM
O=C(c1cc([N+](=O)[O-])ccc1[O-])N1CCC(N2CCCOCC2)CC1	ZINC000600008275	449146732	/nfs/dbraw/zinc/14/67/32/449146732.db2.gz	MITDAAKCXKLEAE-UHFFFAOYSA-N	-1	3	349.387	1.627	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1ccoc1C	ZINC000604306906	449203464	/nfs/dbraw/zinc/20/34/64/449203464.db2.gz	SYCXZLLCZIEITK-UHFFFAOYSA-N	-1	3	326.330	1.983	20	5		EDBDHM
COC(=O)c1cc(C(=O)[N-]c2n[nH]c3ccc([N+](=O)[O-])cc32)on1	ZINC000611487318	449305556	/nfs/dbraw/zinc/30/55/56/449305556.db2.gz	DRJXYAJJMVRHLE-UHFFFAOYSA-N	-1	3	331.244	1.498	20	5		EDBDHM
Cc1noc(C)c1[C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593545442	449338203	/nfs/dbraw/zinc/33/82/03/449338203.db2.gz	SLAOFYFQDYSOHP-MRVPVSSYSA-N	-1	3	326.334	1.634	20	5		EDBDHM
COC(=O)c1ccc(NC(=O)c2n[n-]c3ccc([N+](=O)[O-])cc32)cn1	ZINC000611889525	449459664	/nfs/dbraw/zinc/45/96/64/449459664.db2.gz	UAOPQYDWUBWMLR-UHFFFAOYSA-N	-1	3	341.283	1.905	20	5		EDBDHM
COCC(C)(C)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594752851	449668593	/nfs/dbraw/zinc/66/85/93/449668593.db2.gz	ORSSCDPEPLUYBZ-UHFFFAOYSA-N	-1	3	339.373	1.846	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-]C[C@H](O)C1CC1	ZINC000594761879	449675521	/nfs/dbraw/zinc/67/55/21/449675521.db2.gz	LFLYSMVJBCGCND-LBPRGKRZSA-N	-1	3	337.357	1.192	20	5		EDBDHM
Cc1cncc(CC[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])n1	ZINC000594871746	449787449	/nfs/dbraw/zinc/78/74/49/449787449.db2.gz	RPCNNKDJAMITCZ-UHFFFAOYSA-N	-1	3	336.373	1.523	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN2CC[C@@H](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000601361143	449874550	/nfs/dbraw/zinc/87/45/50/449874550.db2.gz	CNWLFJKCVHKVDV-SNVBAGLBSA-N	-1	3	345.396	1.662	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](O)[C@@H]2CCCO2)c1C	ZINC000599392281	449939440	/nfs/dbraw/zinc/93/94/40/449939440.db2.gz	PWJXWZBNQLCHAH-OLZOCXBDSA-N	-1	3	344.389	1.030	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@H]1CCCN1CC(F)F	ZINC000599398614	449945554	/nfs/dbraw/zinc/94/55/54/449945554.db2.gz	ZYICRSNPLAAIQU-SNVBAGLBSA-N	-1	3	349.359	1.603	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@H]2CCN(C)C2)c(F)cc1[N+](=O)[O-]	ZINC000601434794	449956393	/nfs/dbraw/zinc/95/63/93/449956393.db2.gz	VRFDGZLQINRNQL-JTQLQIEISA-N	-1	3	331.369	1.272	20	5		EDBDHM
C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000599459784	449991839	/nfs/dbraw/zinc/99/18/39/449991839.db2.gz	NBHSXSLAOURZNP-LOKDSWTASA-N	-1	3	332.353	1.824	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)CCc1ccccc1[N+](=O)[O-])C1CCCC1	ZINC000599472687	450000924	/nfs/dbraw/zinc/00/09/24/450000924.db2.gz	LWXMPAIKWMFFKT-UHFFFAOYSA-N	-1	3	340.401	1.816	20	5		EDBDHM
COC(=O)[C@](C)([N-]S(=O)(=O)C1(C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000599483766	450012306	/nfs/dbraw/zinc/01/23/06/450012306.db2.gz	HIGUAPFKWPAEKU-CQSZACIVSA-N	-1	3	342.373	1.455	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1C[C@H]1C(F)(F)F	ZINC000601516431	450038274	/nfs/dbraw/zinc/03/82/74/450038274.db2.gz	AJWKEADFNFONJP-HTQZYQBOSA-N	-1	3	340.279	1.833	20	5		EDBDHM
COc1cc(C[N-]S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)on1	ZINC000595346009	450059446	/nfs/dbraw/zinc/05/94/46/450059446.db2.gz	SAPDYKHFCCFZBB-UHFFFAOYSA-N	-1	3	341.345	1.254	20	5		EDBDHM
O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NCCCc1cc(=O)[nH][n-]1	ZINC000597665538	450180385	/nfs/dbraw/zinc/18/03/85/450180385.db2.gz	QFZHIMOZPCMWCB-UHFFFAOYSA-N	-1	3	340.286	1.188	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1CCOC[C@H]1C	ZINC000619499847	450493102	/nfs/dbraw/zinc/49/31/02/450493102.db2.gz	ZIGFLJSEBFEADM-ZJUUUORDSA-N	-1	3	330.362	1.307	20	5		EDBDHM
Cc1c(Cl)cc(S(=O)(=O)[N-]CC(F)(F)CO)cc1[N+](=O)[O-]	ZINC000184292193	533874047	/nfs/dbraw/zinc/87/40/47/533874047.db2.gz	BNGTYGKXNPLTRQ-UHFFFAOYSA-N	-1	3	344.723	1.463	20	5		EDBDHM
CN[C@H](C)C[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-]	ZINC000261786139	536402787	/nfs/dbraw/zinc/40/27/87/536402787.db2.gz	QKSJEPLQCNTSFM-ZCFIWIBFSA-N	-1	3	342.204	1.788	20	5		EDBDHM
CC[C@H](C)[C@@H](O)C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000269831760	535894861	/nfs/dbraw/zinc/89/48/61/535894861.db2.gz	XMNMSBYTXLQODU-ZANVPECISA-N	-1	3	330.406	1.897	20	5		EDBDHM
CC(C)(C)NC(=O)CCNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000735623383	578906611	/nfs/dbraw/zinc/90/66/11/578906611.db2.gz	NDHSTSAMZMURKV-UHFFFAOYSA-N	-1	3	333.352	1.492	20	5		EDBDHM
CC(C)(C)NC(=O)CCNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000735623383	578906612	/nfs/dbraw/zinc/90/66/12/578906612.db2.gz	NDHSTSAMZMURKV-UHFFFAOYSA-N	-1	3	333.352	1.492	20	5		EDBDHM
CC(C)N1CC[C@@H](Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1=O	ZINC000735882052	578932349	/nfs/dbraw/zinc/93/23/49/578932349.db2.gz	NARQWIODHCFKAI-LLVKDONJSA-N	-1	3	331.336	1.196	20	5		EDBDHM
CC(C)N1CC[C@@H](Nc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1=O	ZINC000735882052	578932351	/nfs/dbraw/zinc/93/23/51/578932351.db2.gz	NARQWIODHCFKAI-LLVKDONJSA-N	-1	3	331.336	1.196	20	5		EDBDHM
C[C@H](CNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])CN1CCOCC1	ZINC000736026760	578947822	/nfs/dbraw/zinc/94/78/22/578947822.db2.gz	QSGCVYZIRQFEFB-LLVKDONJSA-N	-1	3	347.379	1.155	20	5		EDBDHM
C[C@H](CNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])CN1CCOCC1	ZINC000736026760	578947823	/nfs/dbraw/zinc/94/78/23/578947823.db2.gz	QSGCVYZIRQFEFB-LLVKDONJSA-N	-1	3	347.379	1.155	20	5		EDBDHM
C[C@@H]1C[C@@H](N(C)C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CCN1C	ZINC000736758213	579018067	/nfs/dbraw/zinc/01/80/67/579018067.db2.gz	BZBWJYCFGOLORS-MFKMUULPSA-N	-1	3	335.360	1.848	20	5		EDBDHM
O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCc2c(=O)[n-]cnc2C1	ZINC000752782904	579865698	/nfs/dbraw/zinc/86/56/98/579865698.db2.gz	ACOBKXGZIIFYHK-UHFFFAOYSA-N	-1	3	334.719	1.942	20	5		EDBDHM
COCCO[N-]C(=O)Cc1ccc([N+](=O)[O-])cc1Br	ZINC000755447051	579927216	/nfs/dbraw/zinc/92/72/16/579927216.db2.gz	ALILYCCSWXZIDH-UHFFFAOYSA-N	-1	3	333.138	1.594	20	5		EDBDHM
COc1cc(C(=O)OCc2ccc(C(N)=O)cc2[N+](=O)[O-])ccc1[O-]	ZINC000757101346	579964204	/nfs/dbraw/zinc/96/42/04/579964204.db2.gz	NPQHXCKIUZGLPN-UHFFFAOYSA-N	-1	3	346.295	1.765	20	5		EDBDHM
CC(=O)c1cccc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])c1	ZINC000759168717	580000011	/nfs/dbraw/zinc/00/00/11/580000011.db2.gz	GVJPRVZFZFELEJ-UHFFFAOYSA-N	-1	3	336.329	1.498	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]Cc2cccc(F)n2)cc1[N+](=O)[O-]	ZINC000767826140	580201147	/nfs/dbraw/zinc/20/11/47/580201147.db2.gz	UXDACPLHHWPKMN-UHFFFAOYSA-N	-1	3	331.350	1.977	20	5		EDBDHM
C[C@]1([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CCO[C@H]1C1CC1	ZINC000768889617	580223570	/nfs/dbraw/zinc/22/35/70/580223570.db2.gz	DKLOPXQAMPEYMG-RYUDHWBXSA-N	-1	3	332.403	1.892	20	5		EDBDHM
O=C(Cn1cc([N+](=O)[O-])cn1)OCc1noc(-c2ccccc2[O-])n1	ZINC000782674783	580582332	/nfs/dbraw/zinc/58/23/32/580582332.db2.gz	VOBBJLNQIMQAII-UHFFFAOYSA-N	-1	3	345.271	1.290	20	5		EDBDHM
C/C=C\C[C@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C(=O)OCC	ZINC000788668155	580727628	/nfs/dbraw/zinc/72/76/28/580727628.db2.gz	HVDWQTKEGOGGIT-ATPLWMGHSA-N	-1	3	348.402	1.833	20	5		EDBDHM
CCN1CCN(CCNc2cc(C)c([N+](=O)[O-])cc2C(=O)[O-])CC1	ZINC000910346937	592839730	/nfs/dbraw/zinc/83/97/30/592839730.db2.gz	VBBWBYRKNOSWGV-UHFFFAOYSA-N	-1	3	336.392	1.651	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1cc(Cl)c(F)cc1[N+](=O)[O-])c1nnc[nH]1	ZINC000815028482	593610617	/nfs/dbraw/zinc/61/06/17/593610617.db2.gz	COFJCLDBKVOSBL-YFKPBYRVSA-N	-1	3	349.731	1.545	20	5		EDBDHM
CNC(=O)CC1CCN(c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000821632963	593889485	/nfs/dbraw/zinc/88/94/85/593889485.db2.gz	QQJWIAJCVNDCCG-UHFFFAOYSA-N	-1	3	345.363	1.127	20	5		EDBDHM
CNC(=O)CC1CCN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000821632963	593889487	/nfs/dbraw/zinc/88/94/87/593889487.db2.gz	QQJWIAJCVNDCCG-UHFFFAOYSA-N	-1	3	345.363	1.127	20	5		EDBDHM
CC(=O)N1CC[C@@H](Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000823973566	593898119	/nfs/dbraw/zinc/89/81/19/593898119.db2.gz	KTOGJAKVRPDYHD-JOYOIKCWSA-N	-1	3	345.363	1.444	20	5		EDBDHM
CC(=O)N1CC[C@@H](Nc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000823973566	593898121	/nfs/dbraw/zinc/89/81/21/593898121.db2.gz	KTOGJAKVRPDYHD-JOYOIKCWSA-N	-1	3	345.363	1.444	20	5		EDBDHM
Cc1c(COC(=O)c2cc(-c3nnn[n-]3)c[nH]2)cccc1[N+](=O)[O-]	ZINC000822029364	593984480	/nfs/dbraw/zinc/98/44/80/593984480.db2.gz	XMAAWDFFPRAWQL-UHFFFAOYSA-N	-1	3	328.288	1.768	20	5		EDBDHM
Cc1c(COC(=O)c2cc(-c3nn[n-]n3)c[nH]2)cccc1[N+](=O)[O-]	ZINC000822029364	593984481	/nfs/dbraw/zinc/98/44/81/593984481.db2.gz	XMAAWDFFPRAWQL-UHFFFAOYSA-N	-1	3	328.288	1.768	20	5		EDBDHM
CC[C@@H](NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000825134106	594134603	/nfs/dbraw/zinc/13/46/03/594134603.db2.gz	RRQURIRYHJMUSF-LLVKDONJSA-N	-1	3	341.331	1.984	20	5		EDBDHM
CC[C@@H](NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000825134106	594134605	/nfs/dbraw/zinc/13/46/05/594134605.db2.gz	RRQURIRYHJMUSF-LLVKDONJSA-N	-1	3	341.331	1.984	20	5		EDBDHM
O=C(Nc1ccc(F)cc1-c1nnn[n-]1)c1ccc([N+](=O)[O-])cn1	ZINC000823347423	594190101	/nfs/dbraw/zinc/19/01/01/594190101.db2.gz	XOMJMQNTQXFLRI-UHFFFAOYSA-N	-1	3	329.251	1.561	20	5		EDBDHM
O=C(Nc1ccc(F)cc1-c1nn[n-]n1)c1ccc([N+](=O)[O-])cn1	ZINC000823347423	594190102	/nfs/dbraw/zinc/19/01/02/594190102.db2.gz	XOMJMQNTQXFLRI-UHFFFAOYSA-N	-1	3	329.251	1.561	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCO[C@@H]3CCCC[C@H]32)c(-c2nnn[n-]2)c1	ZINC000823639902	594223909	/nfs/dbraw/zinc/22/39/09/594223909.db2.gz	LHKUZZJJGQGRQK-ZIAGYGMSSA-N	-1	3	330.348	1.923	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCO[C@@H]3CCCC[C@H]32)c(-c2nn[n-]n2)c1	ZINC000823639902	594223910	/nfs/dbraw/zinc/22/39/10/594223910.db2.gz	LHKUZZJJGQGRQK-ZIAGYGMSSA-N	-1	3	330.348	1.923	20	5		EDBDHM
O=[N+]([O-])c1cnn(CCNc2c(F)cc(-c3nnn[n-]3)cc2F)c1	ZINC000823651746	594224825	/nfs/dbraw/zinc/22/48/25/594224825.db2.gz	OLFZQOWSGWHYES-UHFFFAOYSA-N	-1	3	336.262	1.362	20	5		EDBDHM
O=[N+]([O-])c1cnn(CCNc2c(F)cc(-c3nn[n-]n3)cc2F)c1	ZINC000823651746	594224826	/nfs/dbraw/zinc/22/48/26/594224826.db2.gz	OLFZQOWSGWHYES-UHFFFAOYSA-N	-1	3	336.262	1.362	20	5		EDBDHM
CN(C(=O)c1cc([N+](=O)[O-])cn1C)c1ccccc1-c1nnn[n-]1	ZINC000825825835	594256444	/nfs/dbraw/zinc/25/64/44/594256444.db2.gz	KVGOMUVSNCLFJY-UHFFFAOYSA-N	-1	3	327.304	1.390	20	5		EDBDHM
CN(C(=O)c1cc([N+](=O)[O-])cn1C)c1ccccc1-c1nn[n-]n1	ZINC000825825835	594256446	/nfs/dbraw/zinc/25/64/46/594256446.db2.gz	KVGOMUVSNCLFJY-UHFFFAOYSA-N	-1	3	327.304	1.390	20	5		EDBDHM
COc1ccc(NC(=O)c2cc(-c3nnn[n-]3)cn2C)cc1[N+](=O)[O-]	ZINC000826209856	594380233	/nfs/dbraw/zinc/38/02/33/594380233.db2.gz	UIXPPGVMPRYVOV-UHFFFAOYSA-N	-1	3	343.303	1.374	20	5		EDBDHM
COc1ccc(NC(=O)c2cc(-c3nn[n-]n3)cn2C)cc1[N+](=O)[O-]	ZINC000826209856	594380234	/nfs/dbraw/zinc/38/02/34/594380234.db2.gz	UIXPPGVMPRYVOV-UHFFFAOYSA-N	-1	3	343.303	1.374	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1OC(=O)c1ccc(-c2nnn[n-]2)cn1	ZINC000826304269	594416397	/nfs/dbraw/zinc/41/63/97/594416397.db2.gz	FIATXHOZQXZJKV-UHFFFAOYSA-N	-1	3	326.272	1.698	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1OC(=O)c1ccc(-c2nn[n-]n2)cn1	ZINC000826304269	594416399	/nfs/dbraw/zinc/41/63/99/594416399.db2.gz	FIATXHOZQXZJKV-UHFFFAOYSA-N	-1	3	326.272	1.698	20	5		EDBDHM
O=C(OCCc1ccccc1[N+](=O)[O-])c1ccc(-c2nnn[n-]2)[nH]1	ZINC000826464292	594485998	/nfs/dbraw/zinc/48/59/98/594485998.db2.gz	QLGLPLVYGQXNKP-UHFFFAOYSA-N	-1	3	328.288	1.503	20	5		EDBDHM
COc1ccc(OCCN2CC[C@H](CNC(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000829500856	594627255	/nfs/dbraw/zinc/62/72/55/594627255.db2.gz	QEXVWERWVGNBNZ-LLVKDONJSA-N	-1	3	339.348	1.572	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2CO)c1	ZINC000832606012	594763501	/nfs/dbraw/zinc/76/35/01/594763501.db2.gz	YSOXFLMDMXGZLB-NXEZZACHSA-N	-1	3	348.808	1.996	20	5		EDBDHM
Cc1c(C[N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)cnn1C	ZINC000848586270	595410338	/nfs/dbraw/zinc/41/03/38/595410338.db2.gz	TZLLWFHDJMPEFI-UHFFFAOYSA-N	-1	3	340.286	1.925	20	5		EDBDHM
Cn1nccc1CC[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848588084	595410776	/nfs/dbraw/zinc/41/07/76/595410776.db2.gz	OMHFJFKUPCKQLL-UHFFFAOYSA-N	-1	3	340.286	1.659	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1COC2(CCC2)C1	ZINC000849447231	595528921	/nfs/dbraw/zinc/52/89/21/595528921.db2.gz	HHNGESSFVGJFPZ-SNVBAGLBSA-N	-1	3	342.373	1.593	20	5		EDBDHM
CCOCCC1(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000825590082	607729589	/nfs/dbraw/zinc/72/95/89/607729589.db2.gz	OYNREAVPXMGTDM-UHFFFAOYSA-N	-1	3	333.352	1.789	20	5		EDBDHM
CCOCCC1(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000825590082	607729591	/nfs/dbraw/zinc/72/95/91/607729591.db2.gz	OYNREAVPXMGTDM-UHFFFAOYSA-N	-1	3	333.352	1.789	20	5		EDBDHM
Nc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1[N+](=O)[O-]	ZINC000102823541	138298808	/nfs/dbraw/zinc/29/88/08/138298808.db2.gz	YDZUSEKPMOURJO-UHFFFAOYSA-N	-1	3	325.288	1.609	20	5		EDBDHM
Nc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1[N+](=O)[O-]	ZINC000102823541	138298809	/nfs/dbraw/zinc/29/88/09/138298809.db2.gz	YDZUSEKPMOURJO-UHFFFAOYSA-N	-1	3	325.288	1.609	20	5		EDBDHM
CN(C)[C@H](CNC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)c1cccs1	ZINC000186766076	236011605	/nfs/dbraw/zinc/01/16/05/236011605.db2.gz	KBSIVRQSGAKAQB-LLVKDONJSA-N	-1	3	336.373	1.790	20	5		EDBDHM
CC[C@H](CCO)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000094960474	218272143	/nfs/dbraw/zinc/27/21/43/218272143.db2.gz	UWYUWKMERFIEIR-SECBINFHSA-N	-1	3	336.797	1.935	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CC[C@H](C)O1	ZINC000416536503	251075148	/nfs/dbraw/zinc/07/51/48/251075148.db2.gz	PTWDUMDEVLGYAH-ONGXEEELSA-N	-1	3	330.362	1.449	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CC12CC2	ZINC000416657938	251099637	/nfs/dbraw/zinc/09/96/37/251099637.db2.gz	ZPGXPLBHDVDRLT-SECBINFHSA-N	-1	3	340.357	1.460	20	5		EDBDHM
CCC(CC)[C@@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000119132474	221251145	/nfs/dbraw/zinc/25/11/45/221251145.db2.gz	VBBVWHGMYVHXJH-LBPRGKRZSA-N	-1	3	334.369	1.809	20	5		EDBDHM
Cc1n[nH]c(C(=O)[N-]OC[C@@H](C)NC(=O)OC(C)(C)C)c1[N+](=O)[O-]	ZINC000271089588	140234893	/nfs/dbraw/zinc/23/48/93/140234893.db2.gz	HSYGRGDHNNVTQG-SSDOTTSWSA-N	-1	3	343.340	1.201	20	5		EDBDHM
COC(=O)Cc1nnc(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)[n-]1	ZINC000271347326	140282806	/nfs/dbraw/zinc/28/28/06/140282806.db2.gz	XEQWSRHVQVNBFA-UHFFFAOYSA-N	-1	3	347.331	1.606	20	5		EDBDHM
COC(=O)Cc1n[n-]c(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)n1	ZINC000271347326	140282808	/nfs/dbraw/zinc/28/28/08/140282808.db2.gz	XEQWSRHVQVNBFA-UHFFFAOYSA-N	-1	3	347.331	1.606	20	5		EDBDHM
COC(=O)Cc1nc(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)n[n-]1	ZINC000271347326	140282810	/nfs/dbraw/zinc/28/28/10/140282810.db2.gz	XEQWSRHVQVNBFA-UHFFFAOYSA-N	-1	3	347.331	1.606	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC(C)(C)CCCO	ZINC000271710260	140337706	/nfs/dbraw/zinc/33/77/06/140337706.db2.gz	RNVMJMQIUDTBKJ-UHFFFAOYSA-N	-1	3	346.405	1.680	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC2([S@](C)=O)CCC2)c([N+](=O)[O-])c1	ZINC000332491103	141190271	/nfs/dbraw/zinc/19/02/71/141190271.db2.gz	SVHBWHARHUIUAL-NRFANRHFSA-N	-1	3	346.430	1.483	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCCN2CCCC2)c(F)c1	ZINC000340163484	142288548	/nfs/dbraw/zinc/28/85/48/142288548.db2.gz	BDZCTYFMOQQPKA-UHFFFAOYSA-N	-1	3	331.369	1.498	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCCn2ccnn2)c1[N+](=O)[O-]	ZINC000190141659	292087410	/nfs/dbraw/zinc/08/74/10/292087410.db2.gz	JCBZOFBWGSYTGL-UHFFFAOYSA-N	-1	3	339.377	1.172	20	5		EDBDHM
CC[C@@H](C)[C@@H](C)NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000343487328	142851234	/nfs/dbraw/zinc/85/12/34/142851234.db2.gz	CEXXANCHATWELC-GHMZBOCLSA-N	-1	3	343.405	1.424	20	5		EDBDHM
Cc1ccc([N-]S(C)(=O)=O)c(NC(=O)c2n[nH]cc2[N+](=O)[O-])c1	ZINC000345319775	143077313	/nfs/dbraw/zinc/07/73/13/143077313.db2.gz	BOFGHNWZJWJGKP-UHFFFAOYSA-N	-1	3	339.333	1.250	20	5		EDBDHM
O=[N+]([O-])c1cc(CNCC[N-]S(=O)(=O)c2cccs2)cs1	ZINC000122267171	222048479	/nfs/dbraw/zinc/04/84/79/222048479.db2.gz	QJQGXQMWXJUWGH-UHFFFAOYSA-N	-1	3	347.443	1.786	20	5		EDBDHM
COc1ncccc1C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000123028168	222203946	/nfs/dbraw/zinc/20/39/46/222203946.db2.gz	YIENZCMVXYHCME-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC2(O)CCCCC2)c(F)c1	ZINC000123426800	222275457	/nfs/dbraw/zinc/27/54/57/222275457.db2.gz	XFIGRJWYKHQXHP-UHFFFAOYSA-N	-1	3	332.353	1.707	20	5		EDBDHM
COCCCC[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	ZINC000275024153	268266816	/nfs/dbraw/zinc/26/68/16/268266816.db2.gz	BGPLTGOCCBNENG-UHFFFAOYSA-N	-1	3	336.341	1.447	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC(=O)C(C)(C)C)c([N+](=O)[O-])c1	ZINC000274294992	273082772	/nfs/dbraw/zinc/08/27/72/273082772.db2.gz	GBWQZAHFCQCKCU-UHFFFAOYSA-N	-1	3	330.362	1.497	20	5		EDBDHM
CC[C@@H](C)c1nc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)n[nH]1	ZINC000278047840	273243698	/nfs/dbraw/zinc/24/36/98/273243698.db2.gz	ZVQFQUNZWHQCLU-HTQZYQBOSA-N	-1	3	334.336	1.818	20	5		EDBDHM
CC[C@H](C)c1nc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)n[nH]1	ZINC000278047843	273243702	/nfs/dbraw/zinc/24/37/02/273243702.db2.gz	ZVQFQUNZWHQCLU-JGVFFNPUSA-N	-1	3	334.336	1.818	20	5		EDBDHM
COC(=O)c1cc(NC([O-])=NOCC(C)(C)O)c(C)c([N+](=O)[O-])c1	ZINC000284609114	274262842	/nfs/dbraw/zinc/26/28/42/274262842.db2.gz	AXIWLLRJCGXNFC-UHFFFAOYSA-N	-1	3	341.320	1.514	20	5		EDBDHM
COC(=O)c1cc(NC(=O)[N-]OCC(C)(C)O)c(C)c([N+](=O)[O-])c1	ZINC000284609114	274262845	/nfs/dbraw/zinc/26/28/45/274262845.db2.gz	AXIWLLRJCGXNFC-UHFFFAOYSA-N	-1	3	341.320	1.514	20	5		EDBDHM
CC(C)(C)N1C[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1=O	ZINC000080805326	277158253	/nfs/dbraw/zinc/15/82/53/277158253.db2.gz	WMQVBMPKYLXROE-JTQLQIEISA-N	-1	3	341.389	1.273	20	5		EDBDHM
O=C1C[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@H]2CCCCN12	ZINC000367184704	304644797	/nfs/dbraw/zinc/64/47/97/304644797.db2.gz	HECLUVAPCWFOOG-GHMZBOCLSA-N	-1	3	339.373	1.027	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C1CCC(C(N)=O)CC1	ZINC000346293578	302047095	/nfs/dbraw/zinc/04/70/95/302047095.db2.gz	PEDANBBLIKAACV-UHFFFAOYSA-N	-1	3	341.389	1.226	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H](OC)C1CC1	ZINC000293915454	303037967	/nfs/dbraw/zinc/03/79/67/303037967.db2.gz	XJKUGCMPBLEJKC-GFCCVEGCSA-N	-1	3	330.362	1.307	20	5		EDBDHM
COC(=O)c1cc([N-]S(=O)(=O)N(C)CC2CC2)cc([N+](=O)[O-])c1	ZINC000438718776	305188424	/nfs/dbraw/zinc/18/84/24/305188424.db2.gz	RCLIKAUWENSUEU-UHFFFAOYSA-N	-1	3	343.361	1.380	20	5		EDBDHM
CO[C@@H]([C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000451990935	305376740	/nfs/dbraw/zinc/37/67/40/305376740.db2.gz	MPKOLHZFFPKUTK-OQPBUACISA-N	-1	3	332.353	1.826	20	5		EDBDHM
O=C(NCc1ncccc1[O-])c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000526941397	305836102	/nfs/dbraw/zinc/83/61/02/305836102.db2.gz	WIBBNBRGPIRJBN-UHFFFAOYSA-N	-1	3	331.284	1.397	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)Cn1cccn1	ZINC000045742111	441027408	/nfs/dbraw/zinc/02/74/08/441027408.db2.gz	KSNCDDUBAHNMSZ-SNVBAGLBSA-N	-1	3	340.361	1.167	20	5		EDBDHM
Cc1nc(C)c(CC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(=O)[n-]1	ZINC000057283056	441105310	/nfs/dbraw/zinc/10/53/10/441105310.db2.gz	XHGNDFYKFCJXJM-SECBINFHSA-N	-1	3	330.344	1.715	20	5		EDBDHM
CCNC(=O)[C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000055978518	441679035	/nfs/dbraw/zinc/67/90/35/441679035.db2.gz	XREVFIQIHMVZQJ-SSDOTTSWSA-N	-1	3	335.769	1.051	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nncn1C	ZINC000056069133	441685628	/nfs/dbraw/zinc/68/56/28/441685628.db2.gz	UTUHFOQCSYYBDA-SSDOTTSWSA-N	-1	3	345.768	1.416	20	5		EDBDHM
COc1cc([N-]C(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])ncn1	ZINC000077198718	441732474	/nfs/dbraw/zinc/73/24/74/441732474.db2.gz	MZKJBTIUKNWVGU-UHFFFAOYSA-N	-1	3	334.288	1.663	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1ncc(C)s1	ZINC000173638897	441811023	/nfs/dbraw/zinc/81/10/23/441811023.db2.gz	ZCAZDOPWLIZNOA-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
CC[C@H](C)C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000116651391	441835702	/nfs/dbraw/zinc/83/57/02/441835702.db2.gz	VEFIIMAZPZDBPT-JTQLQIEISA-N	-1	3	329.378	1.035	20	5		EDBDHM
O=[N+]([O-])c1ccc([O-])cc1CN1CCC[C@@H](CN2CCOCC2)C1	ZINC000093016987	441849862	/nfs/dbraw/zinc/84/98/62/441849862.db2.gz	CQKNHBMFHXSEGT-AWEZNQCLSA-N	-1	3	335.404	1.845	20	5		EDBDHM
CN1CCN(CCCCNC(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC1	ZINC000160018325	441854565	/nfs/dbraw/zinc/85/45/65/441854565.db2.gz	RHRSGAHBLHBTBY-UHFFFAOYSA-N	-1	3	336.392	1.058	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC[C@@H](C)[S@@](C)=O)c([N+](=O)[O-])c1	ZINC000124135958	441910189	/nfs/dbraw/zinc/91/01/89/441910189.db2.gz	RULMZFPGVRILEC-SBKAZYGRSA-N	-1	3	334.419	1.339	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)Cn2cncn2)c1C	ZINC000120379452	442060459	/nfs/dbraw/zinc/06/04/59/442060459.db2.gz	NHTISZBXBBBMHT-SNVBAGLBSA-N	-1	3	339.377	1.170	20	5		EDBDHM
O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(Cc2nnn[n-]2)cc1	ZINC000135561336	442611309	/nfs/dbraw/zinc/61/13/09/442611309.db2.gz	WILGNRSLIYZVBF-UHFFFAOYSA-N	-1	3	338.327	1.880	20	5		EDBDHM
O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(Cc2nn[n-]n2)cc1	ZINC000135561336	442611314	/nfs/dbraw/zinc/61/13/14/442611314.db2.gz	WILGNRSLIYZVBF-UHFFFAOYSA-N	-1	3	338.327	1.880	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCN2CCCC2)cc1C	ZINC000193703689	442769465	/nfs/dbraw/zinc/76/94/65/442769465.db2.gz	CIQDKIATOOMOSR-UHFFFAOYSA-N	-1	3	327.406	1.586	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-][C@H]1CC=CCC1)OCCO2	ZINC000265465618	442784330	/nfs/dbraw/zinc/78/43/30/442784330.db2.gz	IDYGASZZRJGHSF-JTQLQIEISA-N	-1	3	340.357	1.753	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2CCO)c(F)c1	ZINC000188933259	442844670	/nfs/dbraw/zinc/84/46/70/442844670.db2.gz	HAQBUXDCHPHRAF-BXKDBHETSA-N	-1	3	332.353	1.563	20	5		EDBDHM
C[C@H](C[S@@](C)=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000183194295	442899801	/nfs/dbraw/zinc/89/98/01/442899801.db2.gz	XUXGHRLNHRQHLS-QOLSBQFWSA-N	-1	3	340.810	1.294	20	5		EDBDHM
CCN1CCN([C@@H](C)CNC(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC1	ZINC000183612876	442946240	/nfs/dbraw/zinc/94/62/40/442946240.db2.gz	SOUZRHCVZLPLHS-LBPRGKRZSA-N	-1	3	336.392	1.056	20	5		EDBDHM
COc1ccc(C(=O)Nc2nnc(SCCO)[n-]2)cc1[N+](=O)[O-]	ZINC000268537959	443025909	/nfs/dbraw/zinc/02/59/09/443025909.db2.gz	CMSTWBQOWCZDOT-UHFFFAOYSA-N	-1	3	339.333	1.058	20	5		EDBDHM
COc1ccc(C(=O)Nc2nc(SCCO)n[n-]2)cc1[N+](=O)[O-]	ZINC000268537959	443025913	/nfs/dbraw/zinc/02/59/13/443025913.db2.gz	CMSTWBQOWCZDOT-UHFFFAOYSA-N	-1	3	339.333	1.058	20	5		EDBDHM
COc1ccc(C(=O)Nc2n[n-]c(SCCO)n2)cc1[N+](=O)[O-]	ZINC000268537959	443025916	/nfs/dbraw/zinc/02/59/16/443025916.db2.gz	CMSTWBQOWCZDOT-UHFFFAOYSA-N	-1	3	339.333	1.058	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCCC[C@@H]2OC)c([N+](=O)[O-])c1	ZINC000266155902	443038287	/nfs/dbraw/zinc/03/82/87/443038287.db2.gz	GLIBUNGVUSIGQN-AAEUAGOBSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CCOC(=O)[C@H](C)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000268773049	443104671	/nfs/dbraw/zinc/10/46/71/443104671.db2.gz	ITQUQNWYFPHEMK-SECBINFHSA-N	-1	3	346.361	1.081	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCCC[C@H]1CO	ZINC000269301787	443274207	/nfs/dbraw/zinc/27/42/07/443274207.db2.gz	QVUCBVKQGDNCOR-CMPLNLGQSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CS[C@H](C)C1	ZINC000416593917	319448135	/nfs/dbraw/zinc/44/81/35/319448135.db2.gz	PNDYLZAQWVQVEO-BDAKNGLRSA-N	-1	3	332.403	1.776	20	5		EDBDHM
CC[C@@H](C)[C@@H](O)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000269756781	443426705	/nfs/dbraw/zinc/42/67/05/443426705.db2.gz	ISHONGFDQAIJBD-SKDRFNHKSA-N	-1	3	332.378	1.289	20	5		EDBDHM
COc1nc(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])n[n-]1	ZINC000271309021	443500812	/nfs/dbraw/zinc/50/08/12/443500812.db2.gz	VBBNUURDNIPKHA-UHFFFAOYSA-N	-1	3	339.333	1.704	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]CCN(C)C2CC2)cc1[N+](=O)[O-]	ZINC000267733626	443558697	/nfs/dbraw/zinc/55/86/97/443558697.db2.gz	ZOFSMHMRPNWREQ-UHFFFAOYSA-N	-1	3	347.824	1.929	20	5		EDBDHM
C[C@@H](CS(C)(=O)=O)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000272233062	443563540	/nfs/dbraw/zinc/56/35/40/443563540.db2.gz	PPHFQHKIPVWVRO-QMMMGPOBSA-N	-1	3	336.316	1.236	20	5		EDBDHM
O=C([N-][C@H]1CCCn2ncnc21)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000272155663	443542984	/nfs/dbraw/zinc/54/29/84/443542984.db2.gz	MWKPPJCCAMKHIN-NSHDSACASA-N	-1	3	337.286	1.929	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C[C@@H]2CCC[C@H]2O)c1	ZINC000272398144	443613115	/nfs/dbraw/zinc/61/31/15/443613115.db2.gz	ANRJVJFDODENIK-GXSJLCMTSA-N	-1	3	348.808	1.996	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](CO)[C@H]2CCCO2)c1[N+](=O)[O-]	ZINC000447934618	320148089	/nfs/dbraw/zinc/14/80/89/320148089.db2.gz	ZQMMZNHKYMEXNX-NWDGAFQWSA-N	-1	3	344.389	1.030	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CC(=O)N(C(C)C)C2)c([N+](=O)[O-])c1	ZINC000523411724	320485795	/nfs/dbraw/zinc/48/57/95/320485795.db2.gz	HXQQGTNJOLBFLQ-LLVKDONJSA-N	-1	3	341.389	1.191	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)c2ncnn2C)c1C	ZINC000276694371	443794669	/nfs/dbraw/zinc/79/46/69/443794669.db2.gz	NDPVLOIOZSQTGZ-JTQLQIEISA-N	-1	3	339.377	1.380	20	5		EDBDHM
CCOC(=O)CCC[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000299000509	443924477	/nfs/dbraw/zinc/92/44/77/443924477.db2.gz	AVKHSYHRWDDCHM-UHFFFAOYSA-N	-1	3	344.389	1.833	20	5		EDBDHM
Cc1nc([C@@H](C)[N-]S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)n[nH]1	ZINC000285521015	444014388	/nfs/dbraw/zinc/01/43/88/444014388.db2.gz	ZEFVRWPVHFJDMM-SECBINFHSA-N	-1	3	339.377	1.678	20	5		EDBDHM
C[C@H]1CN(CCCNc2ncc(C(=O)[O-])cc2[N+](=O)[O-])CCCO1	ZINC000563208721	321100483	/nfs/dbraw/zinc/10/04/83/321100483.db2.gz	WWEONQOCACQXGH-NSHDSACASA-N	-1	3	338.364	1.601	20	5		EDBDHM
Cc1ccnc(NCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c1	ZINC000301647661	444183344	/nfs/dbraw/zinc/18/33/44/444183344.db2.gz	OLSCKAZYSKDQMZ-UHFFFAOYSA-N	-1	3	336.373	1.689	20	5		EDBDHM
O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000298082559	444409401	/nfs/dbraw/zinc/40/94/01/444409401.db2.gz	LSUYLAZZYOPHEF-ZDUSSCGKSA-N	-1	3	342.355	1.700	20	5		EDBDHM
CC(C)c1[nH]nc(C(=O)[N-]c2cc(C(=O)N(C)C)ccn2)c1[N+](=O)[O-]	ZINC000337604004	445162229	/nfs/dbraw/zinc/16/22/29/445162229.db2.gz	CFHFWLBKFNGFJR-UHFFFAOYSA-N	-1	3	346.347	1.790	20	5		EDBDHM
O=C(COc1ccccc1[N+](=O)[O-])N1CCc2nc[n-]c(=O)c2C1	ZINC000356995053	445366932	/nfs/dbraw/zinc/36/69/32/445366932.db2.gz	IUHIGEBCFKHXEB-UHFFFAOYSA-N	-1	3	330.300	1.054	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ncccc1[O-]	ZINC000360022881	445533376	/nfs/dbraw/zinc/53/33/76/445533376.db2.gz	JNJFMTRKDDDKPP-UHFFFAOYSA-N	-1	3	339.329	1.183	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](C)c2cnn(C)c2)c1[N+](=O)[O-]	ZINC000360253633	445658540	/nfs/dbraw/zinc/65/85/40/445658540.db2.gz	ZTGSURIETWMPDJ-LLVKDONJSA-N	-1	3	338.389	1.985	20	5		EDBDHM
COc1cc(CN[C@@H]2CC(=O)N([C@@H]3C[C@@H]3C)C2)c([N+](=O)[O-])cc1[O-]	ZINC000363414618	445793864	/nfs/dbraw/zinc/79/38/64/445793864.db2.gz	PMNUEGNZQREDMO-MVWJERBFSA-N	-1	3	335.360	1.408	20	5		EDBDHM
COc1c(C(=O)N2CCc3c(nc[n-]c3=O)C2)cccc1[N+](=O)[O-]	ZINC000356743399	445982599	/nfs/dbraw/zinc/98/25/99/445982599.db2.gz	LQIQLYGABPRXRT-UHFFFAOYSA-N	-1	3	330.300	1.298	20	5		EDBDHM
C/C=C\C[C@H](CO)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000351607962	446203240	/nfs/dbraw/zinc/20/32/40/446203240.db2.gz	LAQNFUPFLNEGCM-QMAVJUDZSA-N	-1	3	328.390	1.817	20	5		EDBDHM
C/C=C\C[C@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000351618133	446213885	/nfs/dbraw/zinc/21/38/85/446213885.db2.gz	GUPHMOSNDTXZCS-PKRMOACSSA-N	-1	3	334.781	1.854	20	5		EDBDHM
COc1ccc([N+](=O)[O-])c(C(=O)[N-]c2nncn2-c2cccnc2)c1	ZINC000377138064	446943739	/nfs/dbraw/zinc/94/37/39/446943739.db2.gz	HSKUCQKSOONQAS-UHFFFAOYSA-N	-1	3	340.299	1.831	20	5		EDBDHM
Cn1c(=O)[nH]c2ccc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)cc21	ZINC000443183760	447007987	/nfs/dbraw/zinc/00/79/87/447007987.db2.gz	JOEMCVHMOIAZQO-UHFFFAOYSA-N	-1	3	329.272	1.540	20	5		EDBDHM
CCSc1nnc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)s1	ZINC000444844276	447141704	/nfs/dbraw/zinc/14/17/04/447141704.db2.gz	CHIMSGNOZJJBBS-UHFFFAOYSA-N	-1	3	327.347	1.911	20	5		EDBDHM
Cn1nc(-c2ccncc2)cc1NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000445016485	447157245	/nfs/dbraw/zinc/15/72/45/447157245.db2.gz	DQQFQNVPXDQQPE-UHFFFAOYSA-N	-1	3	340.299	1.743	20	5		EDBDHM
O=C(Nc1nc2c(s1)C(=O)CCC2)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000445174490	447177489	/nfs/dbraw/zinc/17/74/89/447177489.db2.gz	BXBCSOCFTHBGLU-UHFFFAOYSA-N	-1	3	334.313	1.923	20	5		EDBDHM
COC(=O)c1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2F)cc1[N+](=O)[O-]	ZINC000416491266	447623461	/nfs/dbraw/zinc/62/34/61/447623461.db2.gz	XLRMDVCHXONYDM-WDEREUQCSA-N	-1	3	346.336	1.550	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000451885955	447773774	/nfs/dbraw/zinc/77/37/74/447773774.db2.gz	CFNXOQDVJUIYEV-CYBMUJFWSA-N	-1	3	342.373	1.451	20	5		EDBDHM
CCOC(=O)[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000451944378	447794614	/nfs/dbraw/zinc/79/46/14/447794614.db2.gz	GXAQRCVWIYOULJ-MNOVXSKESA-N	-1	3	342.373	1.605	20	5		EDBDHM
Cc1ccc([C@H](C)NC(=O)c2[nH]c(=O)[n-]c(=O)c2N)cc1[N+](=O)[O-]	ZINC000488036877	447840415	/nfs/dbraw/zinc/84/04/15/447840415.db2.gz	BVDXNARJVPCFRZ-ZETCQYMHSA-N	-1	3	333.304	1.178	20	5		EDBDHM
CCN1CCN([C@@H](C)CNc2ccc([N+](=O)[O-])c(C(=O)[O-])c2)CC1	ZINC000582789197	448340213	/nfs/dbraw/zinc/34/02/13/448340213.db2.gz	VIOLOIHZBGTBKS-LBPRGKRZSA-N	-1	3	336.392	1.731	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCCCn2ccnc2)s1	ZINC000517194655	448550139	/nfs/dbraw/zinc/55/01/39/448550139.db2.gz	ZULXZNQDYGRSLJ-UHFFFAOYSA-N	-1	3	330.391	1.612	20	5		EDBDHM
O=C([O-])CCN(CCOc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCO1	ZINC000567358955	448675812	/nfs/dbraw/zinc/67/58/12/448675812.db2.gz	CDNJDQITYCWGDF-HNNXBMFYSA-N	-1	3	338.360	1.929	20	5		EDBDHM
O=C([O-])[C@@]1(c2ccccc2)CCN(CCn2cc([N+](=O)[O-])cn2)C1	ZINC000579247944	448752911	/nfs/dbraw/zinc/75/29/11/448752911.db2.gz	UULOZQDUBRNHTE-INIZCTEOSA-N	-1	3	330.344	1.520	20	5		EDBDHM
C[C@H]1CN(c2ccc([N+](=O)[O-])c(C(=O)[O-])c2)CCN1CC(C)(C)O	ZINC000574521759	448893748	/nfs/dbraw/zinc/89/37/48/448893748.db2.gz	IJCVJJWZPQSTPD-NSHDSACASA-N	-1	3	337.376	1.574	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2CCCCN2C2CC2)nc1	ZINC000593589071	449093371	/nfs/dbraw/zinc/09/33/71/449093371.db2.gz	RDQMWSBNEXFNDN-LBPRGKRZSA-N	-1	3	340.405	1.285	20	5		EDBDHM
CC(C)(C)OC(=O)c1n[nH]cc1NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000600048135	449159005	/nfs/dbraw/zinc/15/90/05/449159005.db2.gz	BVFIMAQHXBYBAB-UHFFFAOYSA-N	-1	3	349.303	1.626	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](CO)CC1CC1	ZINC000611109705	449171682	/nfs/dbraw/zinc/17/16/82/449171682.db2.gz	CCULALBFMNVELZ-SNVBAGLBSA-N	-1	3	330.362	1.043	20	5		EDBDHM
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)[N-]c1nnc2[nH]cnn12	ZINC000590378873	449140042	/nfs/dbraw/zinc/14/00/42/449140042.db2.gz	GERVJXBHHQBQJS-SSDOTTSWSA-N	-1	3	333.333	1.480	20	5		EDBDHM
O=C(c1cccc([O-])c1[N+](=O)[O-])N1CCC(N2CCCOCC2)CC1	ZINC000600007585	449145997	/nfs/dbraw/zinc/14/59/97/449145997.db2.gz	FCVGHZFUJYVMIQ-UHFFFAOYSA-N	-1	3	349.387	1.627	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN2CCCCC2)c(F)cc1[N+](=O)[O-]	ZINC000590592033	449208107	/nfs/dbraw/zinc/20/81/07/449208107.db2.gz	ZZLMAWOCNNYJJY-UHFFFAOYSA-N	-1	3	345.396	1.807	20	5		EDBDHM
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)c2ccc([O-])c([N+](=O)[O-])c2)C1	ZINC000600629354	449465660	/nfs/dbraw/zinc/46/56/60/449465660.db2.gz	RRBBHDNSNLYQMO-MELADBBJSA-N	-1	3	349.387	1.672	20	5		EDBDHM
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)c2cc([O-])cc([N+](=O)[O-])c2)C1	ZINC000600629032	449466332	/nfs/dbraw/zinc/46/63/32/449466332.db2.gz	OEFHOMFHMZBHAQ-HRCADAONSA-N	-1	3	349.387	1.672	20	5		EDBDHM
CCN1CCC[C@H](C[N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])C1	ZINC000594751688	449667121	/nfs/dbraw/zinc/66/71/21/449667121.db2.gz	BDOQVAPUYOQJOJ-LLVKDONJSA-N	-1	3	328.394	1.000	20	5		EDBDHM
CC[C@@H](CN1CCCC1)[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594762212	449676197	/nfs/dbraw/zinc/67/61/97/449676197.db2.gz	FRCSMDVDKZWVIU-NSHDSACASA-N	-1	3	328.394	1.143	20	5		EDBDHM
CC[NH+]1CCC(C[N-]S(=O)(=O)c2cc(C)sc2[N+](=O)[O-])CC1	ZINC000601314337	449823725	/nfs/dbraw/zinc/82/37/25/449823725.db2.gz	COOAYQJIAINOCO-UHFFFAOYSA-N	-1	3	347.462	1.975	20	5		EDBDHM
CCN1CCC(C[N-]S(=O)(=O)c2cc(C)sc2[N+](=O)[O-])CC1	ZINC000601314337	449823727	/nfs/dbraw/zinc/82/37/27/449823727.db2.gz	COOAYQJIAINOCO-UHFFFAOYSA-N	-1	3	347.462	1.975	20	5		EDBDHM
CCN1C[C@H](C)[C@H]([N-]S(=O)(=O)c2cc(C)sc2[N+](=O)[O-])C1	ZINC000601359041	449873348	/nfs/dbraw/zinc/87/33/48/449873348.db2.gz	PXPPYIXTRXIVIH-WCBMZHEXSA-N	-1	3	333.435	1.583	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@H]2C[C@@H](OC)C2)cc1[N+](=O)[O-]	ZINC000599519095	450038633	/nfs/dbraw/zinc/03/86/33/450038633.db2.gz	ZBWYIQAVTYRJOF-DTORHVGOSA-N	-1	3	348.352	1.446	20	5		EDBDHM
CCOC(=O)c1nnc(CNC(=O)c2cccc([N+](=O)[O-])c2C)[n-]1	ZINC000615920383	450271466	/nfs/dbraw/zinc/27/14/66/450271466.db2.gz	ZTJSMGAPFWSMHJ-UHFFFAOYSA-N	-1	3	333.304	1.128	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)[n-]1	ZINC000619447875	450476241	/nfs/dbraw/zinc/47/62/41/450476241.db2.gz	SBXXUYWBPGBBDB-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)c[n-]1	ZINC000619447875	450476246	/nfs/dbraw/zinc/47/62/46/450476246.db2.gz	SBXXUYWBPGBBDB-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
CCn1ccnc1[C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000451932597	486115416	/nfs/dbraw/zinc/11/54/16/486115416.db2.gz	NFLYYKYOIBBNNW-SECBINFHSA-N	-1	3	342.352	1.990	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCOC2CCC2)c([N+](=O)[O-])c1	ZINC000742336192	579448860	/nfs/dbraw/zinc/44/88/60/579448860.db2.gz	HIFUMXMXDRAJML-UHFFFAOYSA-N	-1	3	330.362	1.451	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2CC)n[nH]1	ZINC000738382763	578501978	/nfs/dbraw/zinc/50/19/78/578501978.db2.gz	HJWKEWVEQVKYLY-UHFFFAOYSA-N	-1	3	338.389	1.921	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H](CO)C2CC2)cc1[N+](=O)[O-]	ZINC000751416447	578550616	/nfs/dbraw/zinc/55/06/16/578550616.db2.gz	BTTOMTOTYKLOSV-JTQLQIEISA-N	-1	3	334.781	1.606	20	5		EDBDHM
C[C@@H]1CN2CCCC[C@@H]2CN1c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000736292061	578974461	/nfs/dbraw/zinc/97/44/61/578974461.db2.gz	HXOGKFZTCMWVJL-DGCLKSJQSA-N	-1	3	343.391	1.838	20	5		EDBDHM
CN(C(=O)Cc1ccc(-c2nnn[n-]2)cc1)c1ccc([N+](=O)[O-])cc1	ZINC000736739083	579016319	/nfs/dbraw/zinc/01/63/19/579016319.db2.gz	JACUVOZONSKRQV-UHFFFAOYSA-N	-1	3	338.327	1.980	20	5		EDBDHM
CN(C(=O)Cc1ccc(-c2nn[n-]n2)cc1)c1ccc([N+](=O)[O-])cc1	ZINC000736739083	579016320	/nfs/dbraw/zinc/01/63/20/579016320.db2.gz	JACUVOZONSKRQV-UHFFFAOYSA-N	-1	3	338.327	1.980	20	5		EDBDHM
CN(C(=O)c1ccc([N+](=O)[O-])n1C)c1ccc(-c2nnn[n-]2)cc1F	ZINC000736741157	579016662	/nfs/dbraw/zinc/01/66/62/579016662.db2.gz	BJSSREALQFCPQE-UHFFFAOYSA-N	-1	3	345.294	1.529	20	5		EDBDHM
CN(C(=O)c1ccc([N+](=O)[O-])n1C)c1ccc(-c2nn[n-]n2)cc1F	ZINC000736741157	579016663	/nfs/dbraw/zinc/01/66/63/579016663.db2.gz	BJSSREALQFCPQE-UHFFFAOYSA-N	-1	3	345.294	1.529	20	5		EDBDHM
CNC(=O)C1([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CCCC1	ZINC000777977802	580454062	/nfs/dbraw/zinc/45/40/62/580454062.db2.gz	PNWUOCVZDCHVKZ-UHFFFAOYSA-N	-1	3	341.314	1.862	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H](O)c1ccco1	ZINC000751204044	579796985	/nfs/dbraw/zinc/79/69/85/579796985.db2.gz	ASZHJOJUQQDURP-JTQLQIEISA-N	-1	3	342.329	1.208	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H](CO)CC(F)F)cc([N+](=O)[O-])c1F	ZINC000758253854	579978573	/nfs/dbraw/zinc/97/85/73/579978573.db2.gz	MEPRQGKOHBVUNK-ZETCQYMHSA-N	-1	3	342.295	1.337	20	5		EDBDHM
CC(=O)Nc1cc([N-]C(=O)c2n[nH]cc2[N+](=O)[O-])c(F)cc1F	ZINC000764008674	580110813	/nfs/dbraw/zinc/11/08/13/580110813.db2.gz	ZKMGTTJQBWEYJD-UHFFFAOYSA-N	-1	3	325.231	1.807	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]Cc2cccc3c2OCO3)cs1	ZINC000768812303	580220998	/nfs/dbraw/zinc/22/09/98/580220998.db2.gz	KDZYOCANJURZLS-UHFFFAOYSA-N	-1	3	342.354	1.864	20	5		EDBDHM
Cc1cc([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)cn(C)c1=O	ZINC000768862692	580222849	/nfs/dbraw/zinc/22/28/49/580222849.db2.gz	XLLUZDHTKYPOGJ-UHFFFAOYSA-N	-1	3	329.359	1.464	20	5		EDBDHM
CO[C@@H]1[C@@H](C)[C@@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1(C)C	ZINC000768888959	580223616	/nfs/dbraw/zinc/22/36/16/580223616.db2.gz	OBSZOEDLOLVOMH-WHGOUJPWSA-N	-1	3	334.419	1.994	20	5		EDBDHM
CN1C(=O)CN([N-]C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1=O	ZINC000770455536	580260940	/nfs/dbraw/zinc/26/09/40/580260940.db2.gz	POOJNIREXVOYLD-UHFFFAOYSA-N	-1	3	334.332	1.431	20	5		EDBDHM
COc1c([O-])ccc(CN2CC[C@H](C)[S@@](=O)CC2)c1[N+](=O)[O-]	ZINC000894036759	591178523	/nfs/dbraw/zinc/17/85/23/591178523.db2.gz	OPTLSZBGZYIXTO-MGUXCZDKSA-N	-1	3	328.390	1.652	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2C[C@@H](C)OC2=O)c1C	ZINC000809383428	593335586	/nfs/dbraw/zinc/33/55/86/593335586.db2.gz	XTWQJZPVYZSEQI-SCZZXKLOSA-N	-1	3	328.346	1.194	20	5		EDBDHM
CC(C)c1nncn1CCNc1ccc(-c2nnn[n-]2)c([N+](=O)[O-])c1	ZINC000820211483	593799252	/nfs/dbraw/zinc/79/92/52/593799252.db2.gz	OPXIQHIAIWLUSQ-UHFFFAOYSA-N	-1	3	343.351	1.602	20	5		EDBDHM
CN(CCC(=O)OC(C)(C)C)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000821599021	593875782	/nfs/dbraw/zinc/87/57/82/593875782.db2.gz	CEXNIKDZVPCBQW-UHFFFAOYSA-N	-1	3	348.363	1.943	20	5		EDBDHM
CN(CCC(=O)OC(C)(C)C)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000821599021	593875783	/nfs/dbraw/zinc/87/57/83/593875783.db2.gz	CEXNIKDZVPCBQW-UHFFFAOYSA-N	-1	3	348.363	1.943	20	5		EDBDHM
CCC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C1	ZINC000820838533	593902445	/nfs/dbraw/zinc/90/24/45/593902445.db2.gz	VHQMSVITLABUJW-VIFPVBQESA-N	-1	3	331.336	1.198	20	5		EDBDHM
CCC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C1	ZINC000820838533	593902448	/nfs/dbraw/zinc/90/24/48/593902448.db2.gz	VHQMSVITLABUJW-VIFPVBQESA-N	-1	3	331.336	1.198	20	5		EDBDHM
COCCCn1ccc(Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])n1	ZINC000821688383	593914833	/nfs/dbraw/zinc/91/48/33/593914833.db2.gz	IYZDJCQZBSKJCK-UHFFFAOYSA-N	-1	3	344.335	1.752	20	5		EDBDHM
COCCCn1ccc(Nc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])n1	ZINC000821688383	593914835	/nfs/dbraw/zinc/91/48/35/593914835.db2.gz	IYZDJCQZBSKJCK-UHFFFAOYSA-N	-1	3	344.335	1.752	20	5		EDBDHM
Cc1nn(C)c(NCc2cc(-c3nnn[n-]3)ccc2F)c1[N+](=O)[O-]	ZINC000822496285	594057478	/nfs/dbraw/zinc/05/74/78/594057478.db2.gz	IAYJVWREYQHUPU-UHFFFAOYSA-N	-1	3	332.299	1.568	20	5		EDBDHM
Cc1nn(C)c(NCc2cc(-c3nn[n-]n3)ccc2F)c1[N+](=O)[O-]	ZINC000822496285	594057480	/nfs/dbraw/zinc/05/74/80/594057480.db2.gz	IAYJVWREYQHUPU-UHFFFAOYSA-N	-1	3	332.299	1.568	20	5		EDBDHM
O=C(NCc1cc(-c2nnn[n-]2)ccc1F)c1ccc([N+](=O)[O-])cn1	ZINC000823241936	594174215	/nfs/dbraw/zinc/17/42/15/594174215.db2.gz	KVQUHHOFTYUBIY-UHFFFAOYSA-N	-1	3	343.278	1.239	20	5		EDBDHM
O=C(NCc1cc(-c2nn[n-]n2)ccc1F)c1ccc([N+](=O)[O-])cn1	ZINC000823241936	594174216	/nfs/dbraw/zinc/17/42/16/594174216.db2.gz	KVQUHHOFTYUBIY-UHFFFAOYSA-N	-1	3	343.278	1.239	20	5		EDBDHM
O=[N+]([O-])c1ccc(OCCNc2ccc(-c3nnn[n-]3)nc2)cc1	ZINC000823646075	594224391	/nfs/dbraw/zinc/22/43/91/594224391.db2.gz	ZPQHDEGVMIMLAD-UHFFFAOYSA-N	-1	3	327.304	1.661	20	5		EDBDHM
O=[N+]([O-])c1ccc(OCCNc2ccc(-c3nn[n-]n3)nc2)cc1	ZINC000823646075	594224392	/nfs/dbraw/zinc/22/43/92/594224392.db2.gz	ZPQHDEGVMIMLAD-UHFFFAOYSA-N	-1	3	327.304	1.661	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC(C(F)(F)F)CC2)c(-c2nnn[n-]2)c1	ZINC000823647233	594224465	/nfs/dbraw/zinc/22/44/65/594224465.db2.gz	IJOHCYQJQKFIEH-UHFFFAOYSA-N	-1	3	343.269	1.949	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC(C(F)(F)F)CC2)c(-c2nn[n-]n2)c1	ZINC000823647233	594224466	/nfs/dbraw/zinc/22/44/66/594224466.db2.gz	IJOHCYQJQKFIEH-UHFFFAOYSA-N	-1	3	343.269	1.949	20	5		EDBDHM
Cc1nn([C@@H](C)C(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1[N+](=O)[O-]	ZINC000826333011	594430321	/nfs/dbraw/zinc/43/03/21/594430321.db2.gz	QIFUVASWKOFPQZ-VIFPVBQESA-N	-1	3	342.319	1.480	20	5		EDBDHM
Cc1nn([C@@H](C)C(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1[N+](=O)[O-]	ZINC000826333011	594430322	/nfs/dbraw/zinc/43/03/22/594430322.db2.gz	QIFUVASWKOFPQZ-VIFPVBQESA-N	-1	3	342.319	1.480	20	5		EDBDHM
Cc1nn(CC(=O)c2cccc(-c3nnn[n-]3)c2)c(C)c1[N+](=O)[O-]	ZINC000826334028	594431031	/nfs/dbraw/zinc/43/10/31/594431031.db2.gz	FIDYLELCBQUPLT-UHFFFAOYSA-N	-1	3	327.304	1.471	20	5		EDBDHM
Cc1nn(CC(=O)c2cccc(-c3nn[n-]n3)c2)c(C)c1[N+](=O)[O-]	ZINC000826334028	594431033	/nfs/dbraw/zinc/43/10/33/594431033.db2.gz	FIDYLELCBQUPLT-UHFFFAOYSA-N	-1	3	327.304	1.471	20	5		EDBDHM
O=C(NCCc1ccccc1[N+](=O)[O-])c1ccc(-c2nnn[n-]2)[nH]1	ZINC000826439743	594477851	/nfs/dbraw/zinc/47/78/51/594477851.db2.gz	IDPDRWVTYJVATF-UHFFFAOYSA-N	-1	3	327.304	1.076	20	5		EDBDHM
O=C(NCCc1ccccc1[N+](=O)[O-])c1ccc(-c2nn[n-]n2)[nH]1	ZINC000826439743	594477852	/nfs/dbraw/zinc/47/78/52/594477852.db2.gz	IDPDRWVTYJVATF-UHFFFAOYSA-N	-1	3	327.304	1.076	20	5		EDBDHM
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000829160250	594575766	/nfs/dbraw/zinc/57/57/66/594575766.db2.gz	GGZLWYKKMRFLHZ-KGLIPLIRSA-N	-1	3	347.371	1.992	20	5		EDBDHM
CC1=C([O-])N(C)S(=O)(=O)N1Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000829562028	594640767	/nfs/dbraw/zinc/64/07/67/594640767.db2.gz	YBTQPNYHRMTEFY-ZETCQYMHSA-N	-1	3	333.753	1.156	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)co1	ZINC000832473739	594752831	/nfs/dbraw/zinc/75/28/31/594752831.db2.gz	QNGCXQKNFRGAIW-UHFFFAOYSA-N	-1	3	325.346	1.932	20	5		EDBDHM
O=C([O-])N[C@@H]1CCC[C@@H]2CN(C[C@H](O)c3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC000834186810	595046747	/nfs/dbraw/zinc/04/67/47/595046747.db2.gz	KSLVOIHYVYGNDQ-MIGQKNRLSA-N	-1	3	349.387	1.996	20	5		EDBDHM
CCOC(=O)c1cc(C(=O)OCCn2ccc([N+](=O)[O-])n2)[n-]c1C	ZINC000837875664	595217372	/nfs/dbraw/zinc/21/73/72/595217372.db2.gz	SYFPAUWGNXHGLE-UHFFFAOYSA-N	-1	3	336.304	1.462	20	5		EDBDHM
O=C([N-]C[C@H]1COCCO1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848580639	595408145	/nfs/dbraw/zinc/40/81/45/595408145.db2.gz	CLUMROMEKSRAKI-NSHDSACASA-N	-1	3	332.259	1.098	20	5		EDBDHM
O=C([N-]C[C@H]1CCCNC1=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848592509	595412375	/nfs/dbraw/zinc/41/23/75/595412375.db2.gz	VOJSIRFLQMZGDR-SECBINFHSA-N	-1	3	343.286	1.209	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)C(OC)OC	ZINC000849405248	595521347	/nfs/dbraw/zinc/52/13/47/595521347.db2.gz	GOIAABDGZJOEIF-ZDUSSCGKSA-N	-1	3	346.405	1.454	20	5		EDBDHM
O=C(NCCc1ccc([N+](=O)[O-])cc1)c1nnc2ccccc2c1[O-]	ZINC000111577978	595876296	/nfs/dbraw/zinc/87/62/96/595876296.db2.gz	ZYRILHISQZQXTK-UHFFFAOYSA-N	-1	3	338.323	1.804	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2COC3(CCC3)C2)c([N+](=O)[O-])s1	ZINC000867511880	596405663	/nfs/dbraw/zinc/40/56/63/596405663.db2.gz	AJOOIPAIHBFPDE-SECBINFHSA-N	-1	3	332.403	1.955	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2C[C@H](SC)C2)c([N+](=O)[O-])c1	ZINC000867676791	596491158	/nfs/dbraw/zinc/49/11/58/596491158.db2.gz	GPMAUQJLZHTJRY-CZMCAQCFSA-N	-1	3	332.403	1.776	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)N1CCC[C@@H](C)C1	ZINC000078234515	138256564	/nfs/dbraw/zinc/25/65/64/138256564.db2.gz	PVLDIGOCVBGVJR-SNVBAGLBSA-N	-1	3	329.378	1.992	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2cscn2)c([N+](=O)[O-])c1	ZINC000125784295	138336340	/nfs/dbraw/zinc/33/63/40/138336340.db2.gz	VNLSOUGFGBCLJZ-UHFFFAOYSA-N	-1	3	329.359	1.538	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CC[C@H](O)C1	ZINC000276745483	201297382	/nfs/dbraw/zinc/29/73/82/201297382.db2.gz	SGWZGBFLZSQDRY-ONGXEEELSA-N	-1	3	330.362	1.043	20	5		EDBDHM
CCOC(=O)[C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000049499085	204392135	/nfs/dbraw/zinc/39/21/35/204392135.db2.gz	JPTBOKUHWGFIBZ-SSDOTTSWSA-N	-1	3	336.753	1.478	20	5		EDBDHM
CS[C@H](CO)[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000223589324	139021224	/nfs/dbraw/zinc/02/12/24/139021224.db2.gz	WBYZPMBYHQCQDJ-OIBJUYFYSA-N	-1	3	338.382	1.125	20	5		EDBDHM
COc1cc(CNCC(=O)NCc2ccco2)c([N+](=O)[O-])cc1[O-]	ZINC000237119319	139041151	/nfs/dbraw/zinc/04/11/51/139041151.db2.gz	LKJSFCLBKBLOEE-UHFFFAOYSA-N	-1	3	335.316	1.308	20	5		EDBDHM
CCC(=O)N1CC[C@@H]([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000133192887	205360207	/nfs/dbraw/zinc/36/02/07/205360207.db2.gz	KDDFWJVGVNBMJM-LLVKDONJSA-N	-1	3	341.389	1.192	20	5		EDBDHM
CN1CC[C@H](NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)[C@H]1c1ccccc1	ZINC000248834923	139177002	/nfs/dbraw/zinc/17/70/02/139177002.db2.gz	NQHTZBVGUVIPNH-DZGCQCFKSA-N	-1	3	342.355	1.871	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCC(=O)NC(C)(C)C)cc1[N+](=O)[O-]	ZINC000343508062	183829487	/nfs/dbraw/zinc/82/94/87/183829487.db2.gz	PIEPVEVDNMYZMG-UHFFFAOYSA-N	-1	3	349.434	1.548	20	5		EDBDHM
CCOC(=O)c1sc([N-]C(=O)c2nn(C)cc2[N+](=O)[O-])nc1C	ZINC000270971336	140210808	/nfs/dbraw/zinc/21/08/08/140210808.db2.gz	HZZZPMOPFMYYTE-UHFFFAOYSA-N	-1	3	339.333	1.522	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ccn(C)n1	ZINC000416560595	304331836	/nfs/dbraw/zinc/33/18/36/304331836.db2.gz	NHXCNLCOXXQKKI-MRVPVSSYSA-N	-1	3	328.325	1.507	20	5		EDBDHM
COCCOC[C@@H](C)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000360566676	152099819	/nfs/dbraw/zinc/09/98/19/152099819.db2.gz	AKZBJWRXPBFROA-LLVKDONJSA-N	-1	3	332.378	1.233	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCCC(=O)OC(C)C)c([N+](=O)[O-])c1	ZINC000360865491	152235179	/nfs/dbraw/zinc/23/51/79/152235179.db2.gz	PTFVAKAHULJSHZ-UHFFFAOYSA-N	-1	3	344.389	1.913	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCc3c[nH]nc3C2)c(F)c1	ZINC000364427999	153234093	/nfs/dbraw/zinc/23/40/93/153234093.db2.gz	MPZGZGWDTVDPOA-SECBINFHSA-N	-1	3	340.336	1.293	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@@H]2CCCO2)cc1[N+](=O)[O-]	ZINC000274996822	268259361	/nfs/dbraw/zinc/25/93/61/268259361.db2.gz	FPDIMKVJIPRCPV-QMMMGPOBSA-N	-1	3	334.325	1.200	20	5		EDBDHM
CCN(CC[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-])C1CC1	ZINC000171381513	276348782	/nfs/dbraw/zinc/34/87/82/276348782.db2.gz	FBTLXJUWSJZOOO-UHFFFAOYSA-N	-1	3	331.369	1.497	20	5		EDBDHM
Cc1ccc(N2CCC[C@H]2C[C@]2(C)NC(=O)[N-]C2=O)c([N+](=O)[O-])c1	ZINC000286465674	288012676	/nfs/dbraw/zinc/01/26/76/288012676.db2.gz	SZZYFZIXFFEGFW-ZBEGNZNMSA-N	-1	3	332.360	1.860	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCC1(C)C	ZINC000286765193	288081679	/nfs/dbraw/zinc/08/16/79/288081679.db2.gz	QBSRBBBUGKKOOL-GFCCVEGCSA-N	-1	3	342.373	1.848	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCC1(OC)CCC1	ZINC000292829495	289447993	/nfs/dbraw/zinc/44/79/93/289447993.db2.gz	OQVDJDJUSMZPNS-UHFFFAOYSA-N	-1	3	344.389	1.841	20	5		EDBDHM
CCOC(=O)C(C)(C)O[N-]C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000295760150	303262821	/nfs/dbraw/zinc/26/28/21/303262821.db2.gz	VTALJKWLQVRHBJ-UHFFFAOYSA-N	-1	3	328.325	1.444	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)n[nH]1	ZINC000297263497	303379557	/nfs/dbraw/zinc/37/95/57/303379557.db2.gz	YVYAOWXYUYRRGO-UHFFFAOYSA-N	-1	3	339.377	1.371	20	5		EDBDHM
O=C(c1c([O-])cccc1O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000436646213	305163549	/nfs/dbraw/zinc/16/35/49/305163549.db2.gz	GQWHZSBQBBVAOF-SNVBAGLBSA-N	-1	3	344.327	1.728	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]Cc2nnc(C3CC3)[nH]2)cc1[N+](=O)[O-]	ZINC000451676398	305361528	/nfs/dbraw/zinc/36/15/28/305361528.db2.gz	FAGYCEGQEKDEFI-UHFFFAOYSA-N	-1	3	343.390	1.439	20	5		EDBDHM
CCc1ncc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)o1	ZINC000451963054	305374560	/nfs/dbraw/zinc/37/45/60/305374560.db2.gz	YHPAZKCLTXNTMX-UHFFFAOYSA-N	-1	3	325.346	1.932	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1	ZINC000523693870	305812154	/nfs/dbraw/zinc/81/21/54/305812154.db2.gz	CPOBHCPRBKJUIK-NSHDSACASA-N	-1	3	330.300	1.583	20	5		EDBDHM
Cc1cc(C(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)ccc1[O-]	ZINC000540923505	306041627	/nfs/dbraw/zinc/04/16/27/306041627.db2.gz	BHYHLXOXZGZTAT-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
O=C([N-]c1n[nH]c(C2CCC2)n1)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000544821085	306079160	/nfs/dbraw/zinc/07/91/60/306079160.db2.gz	KIBCFMIUIZJHFS-UHFFFAOYSA-N	-1	3	331.288	1.961	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])N1CCC[C@@H](C)C1	ZINC000045744969	441027290	/nfs/dbraw/zinc/02/72/90/441027290.db2.gz	LVQBNMYFUOXTOC-OLZOCXBDSA-N	-1	3	341.433	1.994	20	5		EDBDHM
CN(C)C1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)CCCC1	ZINC000066000412	441499342	/nfs/dbraw/zinc/49/93/42/441499342.db2.gz	XAAKOAAMUDOFTF-UHFFFAOYSA-N	-1	3	333.435	1.809	20	5		EDBDHM
Cc1c([C@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)cnn1C	ZINC000055236742	441632770	/nfs/dbraw/zinc/63/27/70/441632770.db2.gz	FUFZXHZDOJSATR-QMMMGPOBSA-N	-1	3	342.352	1.815	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1ccnc(C)n1	ZINC000056126612	441691079	/nfs/dbraw/zinc/69/10/79/441691079.db2.gz	CTVSPBNXVGNXRY-UHFFFAOYSA-N	-1	3	338.345	1.180	20	5		EDBDHM
COc1cc(C(=O)[N-]c2nnc3ccccn32)c([N+](=O)[O-])cc1OC	ZINC000041836651	441677392	/nfs/dbraw/zinc/67/73/92/441677392.db2.gz	DDHPXOOLZORKGT-UHFFFAOYSA-N	-1	3	343.299	1.907	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]Cc1ccn2ccnc2c1	ZINC000178405166	442431000	/nfs/dbraw/zinc/43/10/00/442431000.db2.gz	RSIDKGLQSMVRGJ-UHFFFAOYSA-N	-1	3	332.341	1.721	20	5		EDBDHM
CN1CCc2nc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)sc2C1	ZINC000186779470	442610413	/nfs/dbraw/zinc/61/04/13/442610413.db2.gz	GXZVCXPBFAPVLA-UHFFFAOYSA-N	-1	3	335.345	1.392	20	5		EDBDHM
COc1nnc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[n-]1	ZINC000179371616	442634452	/nfs/dbraw/zinc/63/44/52/442634452.db2.gz	KZMBYAQVALOPQJ-UHFFFAOYSA-N	-1	3	332.320	1.574	20	5		EDBDHM
COc1nc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n[n-]1	ZINC000179371616	442634457	/nfs/dbraw/zinc/63/44/57/442634457.db2.gz	KZMBYAQVALOPQJ-UHFFFAOYSA-N	-1	3	332.320	1.574	20	5		EDBDHM
COc1n[n-]c(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1	ZINC000179371616	442634459	/nfs/dbraw/zinc/63/44/59/442634459.db2.gz	KZMBYAQVALOPQJ-UHFFFAOYSA-N	-1	3	332.320	1.574	20	5		EDBDHM
C[C@H](CCN1CCN(C)CC1)NC(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000187578816	442681759	/nfs/dbraw/zinc/68/17/59/442681759.db2.gz	YIKMPHBPSMPEAU-GFCCVEGCSA-N	-1	3	336.392	1.056	20	5		EDBDHM
CC(C)c1ccc(CN2CCC[C@@]3(C2)NC(=O)[N-]C3=O)cc1[N+](=O)[O-]	ZINC000193464694	442745625	/nfs/dbraw/zinc/74/56/25/442745625.db2.gz	YOHBSCXMBMZORV-KRWDZBQOSA-N	-1	3	346.387	1.892	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CCC[C@H]1CCO	ZINC000188915973	442842251	/nfs/dbraw/zinc/84/22/51/442842251.db2.gz	SZCIXYDHKVLZGL-RYUDHWBXSA-N	-1	3	328.390	1.733	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]C[C@H](O)C1CCCCC1	ZINC000184534518	443034678	/nfs/dbraw/zinc/03/46/78/443034678.db2.gz	ICNLNGTXWVANKM-HNNXBMFYSA-N	-1	3	342.417	1.955	20	5		EDBDHM
CC(C)N1C[C@H]([N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000266299085	443090515	/nfs/dbraw/zinc/09/05/15/443090515.db2.gz	NKOSHUAWFQHRHH-JQWIXIFHSA-N	-1	3	345.396	1.741	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C	ZINC000269348061	443288842	/nfs/dbraw/zinc/28/88/42/443288842.db2.gz	JBZOTWWLFAKIDH-JTQLQIEISA-N	-1	3	344.389	1.744	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)c2ccn(C)n2)c1C	ZINC000416553568	319443166	/nfs/dbraw/zinc/44/31/66/319443166.db2.gz	CPFFQXNNYPOFQS-LLVKDONJSA-N	-1	3	338.389	1.985	20	5		EDBDHM
CC[C@@H]1OCC[C@H]1[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000416563912	319444656	/nfs/dbraw/zinc/44/46/56/319444656.db2.gz	ZNFZYUKXJPGZSM-MNOVXSKESA-N	-1	3	330.362	1.449	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)C1(OC)CCC1	ZINC000416616590	319450167	/nfs/dbraw/zinc/45/01/67/319450167.db2.gz	MNSRNDXKMQFLGO-SNVBAGLBSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C)c1csnn1	ZINC000416634518	319451866	/nfs/dbraw/zinc/45/18/66/319451866.db2.gz	OBIUKANAYVWDAJ-QMMMGPOBSA-N	-1	3	328.375	1.794	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)C1CC1	ZINC000269655542	443381422	/nfs/dbraw/zinc/38/14/22/443381422.db2.gz	OJLSPRDHBHAICV-NSHDSACASA-N	-1	3	330.362	1.307	20	5		EDBDHM
CN(C)[C@]1(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCSC1	ZINC000267182291	443369847	/nfs/dbraw/zinc/36/98/47/443369847.db2.gz	XPDTWOQMRKBCAT-ZDUSSCGKSA-N	-1	3	345.446	1.310	20	5		EDBDHM
CCC[C@H](C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OCC	ZINC000278805572	443446250	/nfs/dbraw/zinc/44/62/50/443446250.db2.gz	RURWFUOFPVGIRW-LLVKDONJSA-N	-1	3	344.389	1.853	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CCC[C@H](C)O)c1	ZINC000278853164	443462288	/nfs/dbraw/zinc/46/22/88/443462288.db2.gz	XBMXWJQGWMSHBC-VIFPVBQESA-N	-1	3	336.797	1.996	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCC[N-]S(=O)(=O)c2cccs2)cn1	ZINC000446978957	320138612	/nfs/dbraw/zinc/13/86/12/320138612.db2.gz	GLHGAHPSQLASRI-UHFFFAOYSA-N	-1	3	328.375	1.442	20	5		EDBDHM
CCC[C@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(N)=O	ZINC000285278449	443924239	/nfs/dbraw/zinc/92/42/39/443924239.db2.gz	FJLMTQVMLCXNAG-JTQLQIEISA-N	-1	3	329.378	1.144	20	5		EDBDHM
CSC1(CNc2nccc(C(=O)[O-])c2[N+](=O)[O-])CCN(C)CC1	ZINC000567052425	321240141	/nfs/dbraw/zinc/24/01/41/321240141.db2.gz	ZXKDVKWHQUHJJC-UHFFFAOYSA-N	-1	3	340.405	1.927	20	5		EDBDHM
CCc1ccccc1[C@@H](N)CNC(=O)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000570800677	321357783	/nfs/dbraw/zinc/35/77/83/321357783.db2.gz	XGLZDXNXOAYICI-AWEZNQCLSA-N	-1	3	330.344	1.688	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C(C)(C)C(=O)N(C)C)c1[N+](=O)[O-]	ZINC000570875097	321361163	/nfs/dbraw/zinc/36/11/63/321361163.db2.gz	QJCFMODOVNNCDJ-UHFFFAOYSA-N	-1	3	343.405	1.357	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C2CCC(CO)CC2)c([N+](=O)[O-])c1	ZINC000324045721	444349038	/nfs/dbraw/zinc/34/90/38/444349038.db2.gz	STNDGYCYWMYDEL-UHFFFAOYSA-N	-1	3	344.389	1.433	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@](C)(O)C(F)(F)F)c([N+](=O)[O-])c1	ZINC000340597930	444455599	/nfs/dbraw/zinc/45/55/99/444455599.db2.gz	VTINRCIHVIKGKX-JTQLQIEISA-N	-1	3	342.295	1.495	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@]2(C)CO)c([N+](=O)[O-])c1	ZINC000331170586	444429940	/nfs/dbraw/zinc/42/99/40/444429940.db2.gz	JKGHXSHQWXIYPF-ZIAGYGMSSA-N	-1	3	344.389	1.433	20	5		EDBDHM
O=C(NCCCNC(=O)c1cccc([O-])c1)c1cc([N+](=O)[O-])c[nH]1	ZINC000337988468	444480722	/nfs/dbraw/zinc/48/07/22/444480722.db2.gz	XUNYXZJEBQWTBG-UHFFFAOYSA-N	-1	3	332.316	1.178	20	5		EDBDHM
C[C@@H](NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000580576800	322070583	/nfs/dbraw/zinc/07/05/83/322070583.db2.gz	PWAUDOUSSJCNLF-SNVBAGLBSA-N	-1	3	343.405	1.424	20	5		EDBDHM
Cc1sc(S(=O)(=O)NCc2cnc(C)[n-]c2=O)cc1[N+](=O)[O-]	ZINC000342492511	444714867	/nfs/dbraw/zinc/71/48/67/444714867.db2.gz	IYUMBBMIEJPBRV-UHFFFAOYSA-N	-1	3	344.374	1.247	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CCC[C@@H]1OC	ZINC000341185307	444716356	/nfs/dbraw/zinc/71/63/56/444716356.db2.gz	APHVNVQVNYKAAN-JQWIXIFHSA-N	-1	3	344.389	1.697	20	5		EDBDHM
CCOC(=O)[C@H](C)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000342504592	444720738	/nfs/dbraw/zinc/72/07/38/444720738.db2.gz	RKWIRVSWZIODQU-SSDOTTSWSA-N	-1	3	336.391	1.442	20	5		EDBDHM
CNC(=O)[C@H]1CCC[C@H]1[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000342574288	444750924	/nfs/dbraw/zinc/75/09/24/444750924.db2.gz	URUSGNMUDFDWJO-DTWKUNHWSA-N	-1	3	347.418	1.158	20	5		EDBDHM
CCc1nc([C@@H](C)[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)n[nH]1	ZINC000342577709	444752973	/nfs/dbraw/zinc/75/29/73/444752973.db2.gz	XRNQXIXMLWJPRK-ZCFIWIBFSA-N	-1	3	345.406	1.685	20	5		EDBDHM
C[C@H](NC(=O)c1cc(=O)[n-]c(N(C)C)n1)c1cccc([N+](=O)[O-])c1	ZINC000338770274	444846381	/nfs/dbraw/zinc/84/63/81/444846381.db2.gz	MCXNVWBZORRORE-VIFPVBQESA-N	-1	3	331.332	1.647	20	5		EDBDHM
Cc1nn(C)c(C(=O)[N-]c2n[nH]c(-c3ccccn3)n2)c1[N+](=O)[O-]	ZINC000344467734	444994312	/nfs/dbraw/zinc/99/43/12/444994312.db2.gz	WEGJVXKTIXFXMV-UHFFFAOYSA-N	-1	3	328.292	1.069	20	5		EDBDHM
Cc1nc([N-]C(=O)c2cc([N+](=O)[O-])ccc2SCCO)nn1C	ZINC000344542944	445046187	/nfs/dbraw/zinc/04/61/87/445046187.db2.gz	FWWHMGBLCQSCDR-UHFFFAOYSA-N	-1	3	337.361	1.368	20	5		EDBDHM
Cn1c(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)nc2ccc(F)cc21	ZINC000345371591	445184043	/nfs/dbraw/zinc/18/40/43/445184043.db2.gz	UKBROSCOXSMMIH-UHFFFAOYSA-N	-1	3	331.263	1.974	20	5		EDBDHM
CCO[C@@H]1C[C@H]([N-]c2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]1OC	ZINC000362675491	445493806	/nfs/dbraw/zinc/49/38/06/445493806.db2.gz	SHNMJXXRZBGTEY-XQQFMLRXSA-N	-1	3	334.332	2.249	20	5		EDBDHM
CS(=O)(=O)[N-]c1cc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)ccc1F	ZINC000349446497	445588824	/nfs/dbraw/zinc/58/88/24/445588824.db2.gz	HAWNWVMYTSRBJY-UHFFFAOYSA-N	-1	3	343.296	1.081	20	5		EDBDHM
CS[C@@H]1CN(c2nc(C(=O)[O-])ccc2[N+](=O)[O-])C[C@H]1N(C)C	ZINC000583696186	326122089	/nfs/dbraw/zinc/12/20/89/326122089.db2.gz	INCHCAGJIFSFTG-GHMZBOCLSA-N	-1	3	326.378	1.170	20	5		EDBDHM
Cn1ccnc1-c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[n-]1	ZINC000435713135	446709266	/nfs/dbraw/zinc/70/92/66/446709266.db2.gz	IYVNMAAHHVKFJJ-UHFFFAOYSA-N	-1	3	330.279	2.110	20	5		EDBDHM
Cn1ccnc1-c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)[n-]n1	ZINC000435713135	446709276	/nfs/dbraw/zinc/70/92/76/446709276.db2.gz	IYVNMAAHHVKFJJ-UHFFFAOYSA-N	-1	3	330.279	2.110	20	5		EDBDHM
CN1Cc2ccccc2[C@H](NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)C1	ZINC000371371488	446813092	/nfs/dbraw/zinc/81/30/92/446813092.db2.gz	BZLFZCGFPNNPDN-CQSZACIVSA-N	-1	3	328.328	1.612	20	5		EDBDHM
COc1ccc(C(=O)[N-]c2ncn(-c3ccccn3)n2)cc1[N+](=O)[O-]	ZINC000371390895	446826855	/nfs/dbraw/zinc/82/68/55/446826855.db2.gz	YIQGCZVQNKHHAC-UHFFFAOYSA-N	-1	3	340.299	1.831	20	5		EDBDHM
Cc1ncc(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c(=O)[n-]1	ZINC000450545478	447521061	/nfs/dbraw/zinc/52/10/61/447521061.db2.gz	XYGROFPOCMDKQY-UHFFFAOYSA-N	-1	3	344.327	1.678	20	5		EDBDHM
O=[N+]([O-])c1ccccc1C[N-]S(=O)(=O)c1cnn2c1OCCC2	ZINC000416368298	447583732	/nfs/dbraw/zinc/58/37/32/447583732.db2.gz	GURYODQPNHRFHE-UHFFFAOYSA-N	-1	3	338.345	1.052	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F	ZINC000427143340	447552610	/nfs/dbraw/zinc/55/26/10/447552610.db2.gz	IORJPBNZQMBJOL-ZCFIWIBFSA-N	-1	3	336.279	1.986	20	5		EDBDHM
CSC1(CNC(=O)c2cccc([O-])c2[N+](=O)[O-])CCN(C)CC1	ZINC000427214440	447563603	/nfs/dbraw/zinc/56/36/03/447563603.db2.gz	ZUMXZPNAROLNTP-UHFFFAOYSA-N	-1	3	339.417	1.858	20	5		EDBDHM
COC1([C@@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCC1	ZINC000416623675	447660192	/nfs/dbraw/zinc/66/01/92/447660192.db2.gz	YNOXFTMPSURCEJ-SECBINFHSA-N	-1	3	332.353	1.970	20	5		EDBDHM
O=C(c1csc(=O)[n-]1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000471750798	447812476	/nfs/dbraw/zinc/81/24/76/447812476.db2.gz	WKDMKHIOQOJPBM-UHFFFAOYSA-N	-1	3	334.357	1.719	20	5		EDBDHM
COC(=O)[C@@H](CC(C)(C)C)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000592075472	448662055	/nfs/dbraw/zinc/66/20/55/448662055.db2.gz	LDFVOGJKLHEHMP-SNVBAGLBSA-N	-1	3	344.389	1.851	20	5		EDBDHM
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCC[C@H]3CN(C)CC[C@@H]32)n1	ZINC000521252706	448967778	/nfs/dbraw/zinc/96/77/78/448967778.db2.gz	MSIAYWBNCPKZFU-AAEUAGOBSA-N	-1	3	334.376	1.917	20	5		EDBDHM
O=C(Nc1ncc(CCO)s1)c1n[n-]c2ccc([N+](=O)[O-])cc21	ZINC000588875696	448944600	/nfs/dbraw/zinc/94/46/00/448944600.db2.gz	XDODODHHXSTAFE-UHFFFAOYSA-N	-1	3	333.329	1.715	20	5		EDBDHM
CO[C@@H]1[C@@H](C)[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1(C)C	ZINC000593572273	449080913	/nfs/dbraw/zinc/08/09/13/449080913.db2.gz	HGHVKTZHORDMFA-KPXOXKRLSA-N	-1	3	329.378	1.328	20	5		EDBDHM
COC(=O)[C@H](CCF)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000593634476	449120456	/nfs/dbraw/zinc/12/04/56/449120456.db2.gz	NFUPUVHZGYGFOZ-JTQLQIEISA-N	-1	3	348.352	1.391	20	5		EDBDHM
C[C@@H](CCc1cccn1C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593554768	449345759	/nfs/dbraw/zinc/34/57/59/449345759.db2.gz	FWJGKARJGNZLCJ-NSHDSACASA-N	-1	3	338.389	1.628	20	5		EDBDHM
O=c1[n-]ccc(N2CCC(CCN3CCOCC3)CC2)c1[N+](=O)[O-]	ZINC000596098813	449361147	/nfs/dbraw/zinc/36/11/47/449361147.db2.gz	UHNFZLNGPRYSQA-UHFFFAOYSA-N	-1	3	336.392	1.634	20	5		EDBDHM
COC(=O)[C@H](CNc1cc[n-]c(=O)c1[N+](=O)[O-])Cc1ccc(O)cc1	ZINC000596124062	449374055	/nfs/dbraw/zinc/37/40/55/449374055.db2.gz	TYNVPOLVGDSTOK-NSHDSACASA-N	-1	3	347.327	1.845	20	5		EDBDHM
CN(C[C@@H](O)COCc1ccccc1)c1cc[n-]c(=O)c1[N+](=O)[O-]	ZINC000596124895	449375374	/nfs/dbraw/zinc/37/53/74/449375374.db2.gz	IHCBHAOHUPYUCF-CYBMUJFWSA-N	-1	3	333.344	1.709	20	5		EDBDHM
COc1ccccc1CCNC(=O)CNc1cc[n-]c(=O)c1[N+](=O)[O-]	ZINC000596225619	449424911	/nfs/dbraw/zinc/42/49/11/449424911.db2.gz	MINFINGDCDWIFS-UHFFFAOYSA-N	-1	3	346.343	1.475	20	5		EDBDHM
CC1(NC(=O)C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CC=CC1	ZINC000594382816	449481874	/nfs/dbraw/zinc/48/18/74/449481874.db2.gz	OUNDBZKSZGSCMU-UHFFFAOYSA-N	-1	3	339.373	1.098	20	5		EDBDHM
CC(C)(C)OC(=O)c1cncc([N-]C(=O)c2n[nH]cc2[N+](=O)[O-])c1	ZINC000594385602	449484515	/nfs/dbraw/zinc/48/45/15/449484515.db2.gz	NSFIDRYWGMOACL-UHFFFAOYSA-N	-1	3	333.304	1.921	20	5		EDBDHM
CO[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CCOC1	ZINC000594791468	449700933	/nfs/dbraw/zinc/70/09/33/449700933.db2.gz	NLCTYBCUSFFMEY-SKDRFNHKSA-N	-1	3	348.352	1.064	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](CO)C1CCC1	ZINC000594800079	449712081	/nfs/dbraw/zinc/71/20/81/449712081.db2.gz	CDYAXFQHWSYKKU-NSHDSACASA-N	-1	3	330.362	1.043	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@]12C[C@@H]1COC2(C)C	ZINC000599397940	449944841	/nfs/dbraw/zinc/94/48/41/449944841.db2.gz	VOVPITOIASBFAT-OTYXRUKQSA-N	-1	3	342.373	1.449	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC[C@H]1CCCOC1	ZINC000599364136	449919472	/nfs/dbraw/zinc/91/94/72/449919472.db2.gz	HHLKTIKQIDNKHB-GFCCVEGCSA-N	-1	3	328.390	1.998	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC[C@H]2CCCOC2)c(F)c1	ZINC000599364262	449919841	/nfs/dbraw/zinc/91/98/41/449919841.db2.gz	JUIFKJOJQCFDMT-SNVBAGLBSA-N	-1	3	332.353	1.829	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@]23C[C@H]2COC3(C)C)c([N+](=O)[O-])s1	ZINC000601473595	449996901	/nfs/dbraw/zinc/99/69/01/449996901.db2.gz	HVXBOWLFCRROML-QPUJVOFHSA-N	-1	3	332.403	1.811	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1[C@H](C)O[C@H](C)[C@H]1C	ZINC000599460519	449994982	/nfs/dbraw/zinc/99/49/82/449994982.db2.gz	YGYMCKUXGGDVLW-RBQUTUCGSA-N	-1	3	344.389	1.694	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2[C@@H]3Cc4cc(F)ccc4[C@@H]32)nc1	ZINC000595380428	450094748	/nfs/dbraw/zinc/09/47/48/450094748.db2.gz	OVXOHXNHJFBJML-VHDGCEQUSA-N	-1	3	349.343	1.746	20	5		EDBDHM
O=C(c1cc(=O)[n-]cn1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000599607859	450101012	/nfs/dbraw/zinc/10/10/12/450101012.db2.gz	WFZKBGLLFPCKNV-UHFFFAOYSA-N	-1	3	344.327	1.774	20	5		EDBDHM
CCc1[nH]nc(C(=O)[N-]c2nnc3[n-][nH+]c(C)c(C)c2-3)c1[N+](=O)[O-]	ZINC000597638370	450162410	/nfs/dbraw/zinc/16/24/10/450162410.db2.gz	PZIMTCWEEPUWKW-UHFFFAOYSA-N	-1	3	330.308	1.416	20	5		EDBDHM
CC[C@](C)([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC)C(=O)OC	ZINC000619480540	450485704	/nfs/dbraw/zinc/48/57/04/450485704.db2.gz	XQSMNUFKVKFEHJ-ZDUSSCGKSA-N	-1	3	346.361	1.223	20	5		EDBDHM
Cc1c([N+](=O)[O-])cc(S(=O)(=O)[N-]CC(F)F)c(C)c1[N+](=O)[O-]	ZINC000190036493	533960053	/nfs/dbraw/zinc/96/00/53/533960053.db2.gz	JUZPNYSEPJUFFG-UHFFFAOYSA-N	-1	3	339.276	1.663	20	5		EDBDHM
Cn1ncc2c1nc(COC(=O)c1cc(F)cc([N+](=O)[O-])c1)[n-]c2=O	ZINC000731527347	578675743	/nfs/dbraw/zinc/67/57/43/578675743.db2.gz	FYHLZIXQXOECDA-UHFFFAOYSA-N	-1	3	347.262	1.473	20	5		EDBDHM
Cc1ccc(C(=O)Nc2ccc(-c3nnn[n-]3)cn2)cc1[N+](=O)[O-]	ZINC000737315790	579070893	/nfs/dbraw/zinc/07/08/93/579070893.db2.gz	QOFLYESQHLJALY-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cc1ccc(C(=O)Nc2ccc(-c3nn[n-]n3)cn2)cc1[N+](=O)[O-]	ZINC000737315790	579070894	/nfs/dbraw/zinc/07/08/94/579070894.db2.gz	QOFLYESQHLJALY-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
O=C([N-]OCc1cccnc1)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000746938098	579617538	/nfs/dbraw/zinc/61/75/38/579617538.db2.gz	ZJVTVOURRHMZLN-UHFFFAOYSA-N	-1	3	331.284	1.623	20	5		EDBDHM
O=C1[N-]C(=O)N2CCN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)C[C@H]12	ZINC000772158568	580304375	/nfs/dbraw/zinc/30/43/75/580304375.db2.gz	LEAYINZBPFFAFD-SECBINFHSA-N	-1	3	345.142	1.642	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000778963282	580477035	/nfs/dbraw/zinc/47/70/35/580477035.db2.gz	BHLNSHKZQIARKQ-UHFFFAOYSA-N	-1	3	344.287	1.093	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)c1cc2nsnc2c([N+](=O)[O-])c1	ZINC000778964472	580477081	/nfs/dbraw/zinc/47/70/81/580477081.db2.gz	QEAJQBAMSOJWGE-UHFFFAOYSA-N	-1	3	348.300	1.361	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H]2CCC=CO2)c([N+](=O)[O-])c1	ZINC000780903322	580537194	/nfs/dbraw/zinc/53/71/94/580537194.db2.gz	WHXZCFQHHIRUNA-LLVKDONJSA-N	-1	3	328.346	1.574	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](CCO)C2CC2)c1[N+](=O)[O-]	ZINC000790851015	580779985	/nfs/dbraw/zinc/77/99/85/580779985.db2.gz	AMNUSQRYQBNPQZ-LBPRGKRZSA-N	-1	3	328.390	1.651	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](C)c1ccc[nH]1	ZINC000795147534	580914397	/nfs/dbraw/zinc/91/43/97/580914397.db2.gz	CEXDXEXYDQBQET-VIFPVBQESA-N	-1	3	325.346	1.971	20	5		EDBDHM
C[C@@H]1CCNC(=O)[C@@H]1[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000799428424	581027851	/nfs/dbraw/zinc/02/78/51/581027851.db2.gz	LVOBXXBJPPIUQY-LDYMZIIASA-N	-1	3	327.287	1.327	20	5		EDBDHM
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)[N-]N1Cc2ccccc2C1=O	ZINC000801949979	581088874	/nfs/dbraw/zinc/08/88/74/581088874.db2.gz	FIVUMMXNDWNRNU-UHFFFAOYSA-N	-1	3	330.275	1.617	20	5		EDBDHM
CCN1CCN(CCNc2ccc(/C=C/C(=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000910345007	592838820	/nfs/dbraw/zinc/83/88/20/592838820.db2.gz	IYLBZRHHGHGZGB-GQCTYLIASA-N	-1	3	348.403	1.742	20	5		EDBDHM
COc1ccc(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)cc1[N+](=O)[O-]	ZINC000821798976	593942353	/nfs/dbraw/zinc/94/23/53/593942353.db2.gz	WGRUCPRRDKUDBN-UHFFFAOYSA-N	-1	3	343.303	1.042	20	5		EDBDHM
COc1ccc(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)cc1[N+](=O)[O-]	ZINC000821798976	593942355	/nfs/dbraw/zinc/94/23/55/593942355.db2.gz	WGRUCPRRDKUDBN-UHFFFAOYSA-N	-1	3	343.303	1.042	20	5		EDBDHM
CC(C)[C@H](O)C1(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000824198228	593953968	/nfs/dbraw/zinc/95/39/68/593953968.db2.gz	AANBZXYFCSCWRV-NSHDSACASA-N	-1	3	333.352	1.379	20	5		EDBDHM
CC(C)[C@H](O)C1(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000824198228	593953969	/nfs/dbraw/zinc/95/39/69/593953969.db2.gz	AANBZXYFCSCWRV-NSHDSACASA-N	-1	3	333.352	1.379	20	5		EDBDHM
Cc1nn(Cc2ccc(Cl)c([N+](=O)[O-])c2)c(N)c1-c1nnn[n-]1	ZINC000822500692	594058394	/nfs/dbraw/zinc/05/83/94/594058394.db2.gz	BXOMTIXSVLPCNQ-UHFFFAOYSA-N	-1	3	334.727	1.564	20	5		EDBDHM
Cc1nn(Cc2ccc(Cl)c([N+](=O)[O-])c2)c(N)c1-c1nn[n-]n1	ZINC000822500692	594058396	/nfs/dbraw/zinc/05/83/96/594058396.db2.gz	BXOMTIXSVLPCNQ-UHFFFAOYSA-N	-1	3	334.727	1.564	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCO[C@@H]([C@@H]2CCCO2)C1	ZINC000823629717	594223053	/nfs/dbraw/zinc/22/30/53/594223053.db2.gz	FQBIDTIRLLXZSB-UONOGXRCSA-N	-1	3	346.347	1.159	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCO[C@@H]([C@@H]2CCCO2)C1	ZINC000823629717	594223054	/nfs/dbraw/zinc/22/30/54/594223054.db2.gz	FQBIDTIRLLXZSB-UONOGXRCSA-N	-1	3	346.347	1.159	20	5		EDBDHM
O=[N+]([O-])c1cnn(-c2nc(C(F)(F)F)ccc2-c2nnn[n-]2)c1	ZINC000823651765	594224793	/nfs/dbraw/zinc/22/47/93/594224793.db2.gz	PGBQEUHLHKULRB-UHFFFAOYSA-N	-1	3	326.198	1.374	20	5		EDBDHM
O=[N+]([O-])c1cnn(-c2nc(C(F)(F)F)ccc2-c2nn[n-]n2)c1	ZINC000823651765	594224794	/nfs/dbraw/zinc/22/47/94/594224794.db2.gz	PGBQEUHLHKULRB-UHFFFAOYSA-N	-1	3	326.198	1.374	20	5		EDBDHM
COc1ccc(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cc1[N+](=O)[O-]	ZINC000826200850	594376549	/nfs/dbraw/zinc/37/65/49/594376549.db2.gz	MIGSTVZXCOQDJH-UHFFFAOYSA-N	-1	3	343.303	1.042	20	5		EDBDHM
COc1ccc(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cc1[N+](=O)[O-]	ZINC000826200850	594376552	/nfs/dbraw/zinc/37/65/52/594376552.db2.gz	MIGSTVZXCOQDJH-UHFFFAOYSA-N	-1	3	343.303	1.042	20	5		EDBDHM
Cc1cc(COC(=O)c2c[nH]c(-c3nnn[n-]3)c2)ccc1[N+](=O)[O-]	ZINC000826267444	594404164	/nfs/dbraw/zinc/40/41/64/594404164.db2.gz	GJTYJMKUBZDWLI-UHFFFAOYSA-N	-1	3	328.288	1.768	20	5		EDBDHM
Cc1cc(COC(=O)c2c[nH]c(-c3nn[n-]n3)c2)ccc1[N+](=O)[O-]	ZINC000826267444	594404165	/nfs/dbraw/zinc/40/41/65/594404165.db2.gz	GJTYJMKUBZDWLI-UHFFFAOYSA-N	-1	3	328.288	1.768	20	5		EDBDHM
CC[C@](C)(CC(=O)[O-])NCC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000828658500	594474355	/nfs/dbraw/zinc/47/43/55/594474355.db2.gz	VYHKTUZNKZBKEU-OAHLLOKOSA-N	-1	3	339.348	1.775	20	5		EDBDHM
O=C(NCCc1cccc([N+](=O)[O-])c1)c1ccc(-c2nnn[n-]2)[nH]1	ZINC000826440056	594478223	/nfs/dbraw/zinc/47/82/23/594478223.db2.gz	WMYLBJBJZSTEJP-UHFFFAOYSA-N	-1	3	327.304	1.076	20	5		EDBDHM
O=C(NCCc1cccc([N+](=O)[O-])c1)c1ccc(-c2nn[n-]n2)[nH]1	ZINC000826440056	594478226	/nfs/dbraw/zinc/47/82/26/594478226.db2.gz	WMYLBJBJZSTEJP-UHFFFAOYSA-N	-1	3	327.304	1.076	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@H]2CCO[C@@]3(CCOC3)C2)c(-c2nnn[n-]2)c1	ZINC000826498732	594502722	/nfs/dbraw/zinc/50/27/22/594502722.db2.gz	HJJSUKLTGKZFDG-BONVTDFDSA-N	-1	3	346.347	1.525	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@H]2CCO[C@@]3(CCOC3)C2)c(-c2nn[n-]n2)c1	ZINC000826498732	594502724	/nfs/dbraw/zinc/50/27/24/594502724.db2.gz	HJJSUKLTGKZFDG-BONVTDFDSA-N	-1	3	346.347	1.525	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@@H]2COC3(CCCC3)O2)c(-c2nnn[n-]2)c1	ZINC000826499193	594502983	/nfs/dbraw/zinc/50/29/83/594502983.db2.gz	ZKCYPZFNVXOLBN-LLVKDONJSA-N	-1	3	346.347	1.873	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@@H]2COC3(CCCC3)O2)c(-c2nn[n-]n2)c1	ZINC000826499193	594502984	/nfs/dbraw/zinc/50/29/84/594502984.db2.gz	ZKCYPZFNVXOLBN-LLVKDONJSA-N	-1	3	346.347	1.873	20	5		EDBDHM
O=[N+]([O-])c1ccsc1NCCNc1ncccc1-c1nnn[n-]1	ZINC000826500701	594503231	/nfs/dbraw/zinc/50/32/31/594503231.db2.gz	ISWOWIGTWSCCMY-UHFFFAOYSA-N	-1	3	332.349	1.755	20	5		EDBDHM
O=[N+]([O-])c1ccsc1NCCNc1ncccc1-c1nn[n-]n1	ZINC000826500701	594503233	/nfs/dbraw/zinc/50/32/33/594503233.db2.gz	ISWOWIGTWSCCMY-UHFFFAOYSA-N	-1	3	332.349	1.755	20	5		EDBDHM
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000829160251	594575568	/nfs/dbraw/zinc/57/55/68/594575568.db2.gz	GGZLWYKKMRFLHZ-UONOGXRCSA-N	-1	3	347.371	1.992	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@H]1CCn2ccnc21	ZINC000831744745	594698484	/nfs/dbraw/zinc/69/84/84/594698484.db2.gz	PBJJFMGNTOHSQG-VIFPVBQESA-N	-1	3	342.764	1.868	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCn3ccnc32)c([N+](=O)[O-])c1	ZINC000831744429	594698523	/nfs/dbraw/zinc/69/85/23/594698523.db2.gz	NTSPLFHTPMHMEI-JTQLQIEISA-N	-1	3	338.345	1.223	20	5		EDBDHM
C[C@H](C(=O)[O-])[C@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1ccccc1	ZINC000833407149	594842708	/nfs/dbraw/zinc/84/27/08/594842708.db2.gz	LFPWBAJKEKSKLP-LRDDRELGSA-N	-1	3	345.355	1.808	20	5		EDBDHM
CCn1nnc(C)c1COC(=O)c1[n-]nc2ccc([N+](=O)[O-])cc21	ZINC000835695662	594863216	/nfs/dbraw/zinc/86/32/16/594863216.db2.gz	ZMKAIQRGRPLCFJ-UHFFFAOYSA-N	-1	3	330.304	1.748	20	5		EDBDHM
CCn1nnc(C)c1COC(=O)c1n[n-]c2ccc([N+](=O)[O-])cc21	ZINC000835695662	594863218	/nfs/dbraw/zinc/86/32/18/594863218.db2.gz	ZMKAIQRGRPLCFJ-UHFFFAOYSA-N	-1	3	330.304	1.748	20	5		EDBDHM
O=C([O-])N1CC[C@@H](N(C[C@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)C1	ZINC000834084364	595009954	/nfs/dbraw/zinc/00/99/54/595009954.db2.gz	SICATSJFPMUQCN-CABCVRRESA-N	-1	3	335.360	1.845	20	5		EDBDHM
O=C([N-]CCc1ncno1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848585545	595409809	/nfs/dbraw/zinc/40/98/09/595409809.db2.gz	QUUUPHAACNOUNU-UHFFFAOYSA-N	-1	3	328.231	1.308	20	5		EDBDHM
O=C([N-]C[C@@]1(O)CCSC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848586689	595410382	/nfs/dbraw/zinc/41/03/82/595410382.db2.gz	BRTNRCJPQGXZSM-LBPRGKRZSA-N	-1	3	348.327	1.551	20	5		EDBDHM
CO[C@](C)(CO)C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848596139	595413952	/nfs/dbraw/zinc/41/39/52/595413952.db2.gz	OSONIVKEYQOQAU-LBPRGKRZSA-N	-1	3	334.275	1.080	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)OC(=O)[C@H]1CCS(=O)(=O)[N-]1	ZINC000845374335	595486755	/nfs/dbraw/zinc/48/67/55/595486755.db2.gz	BMYJAOAEMCBFOP-BXKDBHETSA-N	-1	3	328.346	1.199	20	5		EDBDHM
O=[N+]([O-])c1ccnn1Cc1nnc(-c2cccc(-c3nnn[n-]3)c2)o1	ZINC000738370145	599165873	/nfs/dbraw/zinc/16/58/73/599165873.db2.gz	QIUARTVSFGLGFV-UHFFFAOYSA-N	-1	3	339.275	1.070	20	5		EDBDHM
O=[N+]([O-])c1ccnn1Cc1nnc(-c2cccc(-c3nn[n-]n3)c2)o1	ZINC000738370145	599165875	/nfs/dbraw/zinc/16/58/75/599165875.db2.gz	QIUARTVSFGLGFV-UHFFFAOYSA-N	-1	3	339.275	1.070	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1Nc1cnn(CC(F)F)c1	ZINC000738360444	599207765	/nfs/dbraw/zinc/20/77/65/599207765.db2.gz	WWRHCZWUOGSZLZ-UHFFFAOYSA-N	-1	3	336.262	1.980	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1Nc1cnn(CC(F)F)c1	ZINC000738360444	599207767	/nfs/dbraw/zinc/20/77/67/599207767.db2.gz	WWRHCZWUOGSZLZ-UHFFFAOYSA-N	-1	3	336.262	1.980	20	5		EDBDHM
CNC(=O)[C@H](CC(C)C)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000119542266	596630627	/nfs/dbraw/zinc/63/06/27/596630627.db2.gz	OZDWUMOMHZWWMU-VIFPVBQESA-N	-1	3	335.407	1.095	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCN2CCCCC2)cc1F	ZINC000866497222	596893666	/nfs/dbraw/zinc/89/36/66/596893666.db2.gz	HYQSSARYUMNTAF-UHFFFAOYSA-N	-1	3	345.396	1.807	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2cccc(CO)c2)c(-c2nnn[n-]2)c1	ZINC000738375335	598503095	/nfs/dbraw/zinc/50/30/95/598503095.db2.gz	YTSQNWZHUCYBTM-UHFFFAOYSA-N	-1	3	327.304	1.274	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2cccc(CO)c2)c(-c2nn[n-]n2)c1	ZINC000738375335	598503097	/nfs/dbraw/zinc/50/30/97/598503097.db2.gz	YTSQNWZHUCYBTM-UHFFFAOYSA-N	-1	3	327.304	1.274	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H](O)C2CCCCC2)c(-c2nnn[n-]2)c1	ZINC000738369773	598521671	/nfs/dbraw/zinc/52/16/71/598521671.db2.gz	OAXJBFMXBFMAIG-LBPRGKRZSA-N	-1	3	333.352	1.523	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H](O)C2CCCCC2)c(-c2nn[n-]n2)c1	ZINC000738369773	598521672	/nfs/dbraw/zinc/52/16/72/598521672.db2.gz	OAXJBFMXBFMAIG-LBPRGKRZSA-N	-1	3	333.352	1.523	20	5		EDBDHM
CN(C)c1ncccc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000066000479	215002781	/nfs/dbraw/zinc/00/27/81/215002781.db2.gz	BOTZGKOTCIHMIQ-UHFFFAOYSA-N	-1	3	342.402	1.596	20	5		EDBDHM
CN(C)Cc1ccccc1CNC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000186960624	236079398	/nfs/dbraw/zinc/07/93/98/236079398.db2.gz	SPKKVVKPSZHUFI-UHFFFAOYSA-N	-1	3	330.344	1.687	20	5		EDBDHM
COc1cc(C(=O)N2CCC[C@@H]2c2nc(=N)n(C)[n-]2)ccc1[N+](=O)[O-]	ZINC000563965815	306353563	/nfs/dbraw/zinc/35/35/63/306353563.db2.gz	DXZILYHTQBUTRM-LLVKDONJSA-N	-1	3	346.347	1.122	20	5		EDBDHM
O=C(c1ccc([O-])cc1)N1CCN(c2ncc([N+](=O)[O-])s2)CC1	ZINC000190314758	238382469	/nfs/dbraw/zinc/38/24/69/238382469.db2.gz	ROENXCXIDVHWGG-UHFFFAOYSA-N	-1	3	334.357	1.719	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CC[C@H](O)C1	ZINC000276629817	201297081	/nfs/dbraw/zinc/29/70/81/201297081.db2.gz	GDCIQAXLTNGSDM-ONGXEEELSA-N	-1	3	330.362	1.043	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]CC1CCOCC1	ZINC000195012665	139004498	/nfs/dbraw/zinc/00/44/98/139004498.db2.gz	MDPXPATVYRHKDS-UHFFFAOYSA-N	-1	3	334.781	1.953	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H]1COC2(CCCC2)O1	ZINC000110477573	204312097	/nfs/dbraw/zinc/31/20/97/204312097.db2.gz	UDZKBNLTROAZAX-LLVKDONJSA-N	-1	3	342.373	1.559	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])[C@@H](O)C(C)C	ZINC000416614083	251084286	/nfs/dbraw/zinc/08/42/86/251084286.db2.gz	FNFBKNSEONNTGN-RISCZKNCSA-N	-1	3	330.406	1.977	20	5		EDBDHM
COCC[C@@](C)(O)C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000269817383	140000177	/nfs/dbraw/zinc/00/01/77/140000177.db2.gz	VMAICJWWRUQTHM-CQSZACIVSA-N	-1	3	346.405	1.277	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000270789021	140169384	/nfs/dbraw/zinc/16/93/84/140169384.db2.gz	GFCDGZUBORQEHJ-UHFFFAOYSA-N	-1	3	334.737	1.232	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)CCc1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000271111496	140238502	/nfs/dbraw/zinc/23/85/02/140238502.db2.gz	NOFOQTVSMCBVDG-NSHDSACASA-N	-1	3	330.362	1.008	20	5		EDBDHM
CS(=O)(=O)c1cc([N+](=O)[O-])c([N-][C@H]2CCCCNC2=O)s1	ZINC000271139821	140244617	/nfs/dbraw/zinc/24/46/17/140244617.db2.gz	CEFSLKMQHYFMRE-ZETCQYMHSA-N	-1	3	333.391	1.140	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@]2(O)CCSC2)cc1C	ZINC000331289993	141004142	/nfs/dbraw/zinc/00/41/42/141004142.db2.gz	OOEDHKPBFXRCSN-ZDUSSCGKSA-N	-1	3	346.430	1.358	20	5		EDBDHM
CO[C@@H]1[C@H](C)[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1(C)C	ZINC000332447378	141183495	/nfs/dbraw/zinc/18/34/95/141183495.db2.gz	LLVZLCKZMBZRGV-OASPWFOLSA-N	-1	3	328.390	1.933	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2CC[C@H](F)C2)cc1[N+](=O)[O-]	ZINC000344876937	143022589	/nfs/dbraw/zinc/02/25/89/143022589.db2.gz	AIUYGLRACNIRFA-YUMQZZPRSA-N	-1	3	336.316	1.911	20	5		EDBDHM
CCOc1ccc(C(=O)NCc2cnc(C)[n-]c2=O)cc1[N+](=O)[O-]	ZINC000345096921	143049844	/nfs/dbraw/zinc/04/98/44/143049844.db2.gz	MZWXBEYYHMURNE-UHFFFAOYSA-N	-1	3	332.316	1.728	20	5		EDBDHM
CN(C)c1nc(-c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cc(=O)[n-]1	ZINC000346868352	143253725	/nfs/dbraw/zinc/25/37/25/143253725.db2.gz	LPTQQSKAPJIRID-UHFFFAOYSA-N	-1	3	343.303	1.192	20	5		EDBDHM
Cc1ncc(C[N-]S(=O)(=O)CCc2ccccc2[N+](=O)[O-])o1	ZINC000416548373	304330765	/nfs/dbraw/zinc/33/07/65/304330765.db2.gz	OCXSGOKHAQMEIZ-UHFFFAOYSA-N	-1	3	325.346	1.553	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](CO)C2CCCC2)c([N+](=O)[O-])c1	ZINC000352586808	149075442	/nfs/dbraw/zinc/07/54/42/149075442.db2.gz	WBBZSVFCOANIDZ-GFCCVEGCSA-N	-1	3	328.390	1.733	20	5		EDBDHM
CCC[C@H]([N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)C(=O)OC	ZINC000355766486	150392454	/nfs/dbraw/zinc/39/24/54/150392454.db2.gz	VLJHCPJSBKYDDQ-ZDUSSCGKSA-N	-1	3	344.389	1.398	20	5		EDBDHM
COC(=O)c1cc([N-]c2ncc(C(=O)OC)cc2[N+](=O)[O-])cn1C	ZINC000357699071	151118805	/nfs/dbraw/zinc/11/88/05/151118805.db2.gz	QBRCETNVAAVHPD-UHFFFAOYSA-N	-1	3	334.288	1.645	20	5		EDBDHM
COCCC1([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)CCC1	ZINC000360354119	152004459	/nfs/dbraw/zinc/00/44/59/152004459.db2.gz	TUKKBEQLEQAGRJ-UHFFFAOYSA-N	-1	3	344.389	1.841	20	5		EDBDHM
O=C(Cc1ccccc1[N+](=O)[O-])NCc1nnc(C(F)(F)F)[n-]1	ZINC000360815945	152217362	/nfs/dbraw/zinc/21/73/62/152217362.db2.gz	YHDFYEZSWJPPKZ-UHFFFAOYSA-N	-1	3	329.238	1.591	20	5		EDBDHM
O=C(Cc1ccccc1[N+](=O)[O-])NCc1n[n-]c(C(F)(F)F)n1	ZINC000360815945	152217363	/nfs/dbraw/zinc/21/73/63/152217363.db2.gz	YHDFYEZSWJPPKZ-UHFFFAOYSA-N	-1	3	329.238	1.591	20	5		EDBDHM
O=C(Cc1ccccc1[N+](=O)[O-])NCc1nc(C(F)(F)F)n[n-]1	ZINC000360815945	152217365	/nfs/dbraw/zinc/21/73/65/152217365.db2.gz	YHDFYEZSWJPPKZ-UHFFFAOYSA-N	-1	3	329.238	1.591	20	5		EDBDHM
O=C(CCc1cccc([N+](=O)[O-])c1)NCc1nnc(C(F)(F)F)[n-]1	ZINC000361013971	152279392	/nfs/dbraw/zinc/27/93/92/152279392.db2.gz	QEQIPBMKMSAAOZ-UHFFFAOYSA-N	-1	3	343.265	1.981	20	5		EDBDHM
O=C(CCc1cccc([N+](=O)[O-])c1)NCc1n[n-]c(C(F)(F)F)n1	ZINC000361013971	152279395	/nfs/dbraw/zinc/27/93/95/152279395.db2.gz	QEQIPBMKMSAAOZ-UHFFFAOYSA-N	-1	3	343.265	1.981	20	5		EDBDHM
O=C(CCc1cccc([N+](=O)[O-])c1)NCc1nc(C(F)(F)F)n[n-]1	ZINC000361013971	152279396	/nfs/dbraw/zinc/27/93/96/152279396.db2.gz	QEQIPBMKMSAAOZ-UHFFFAOYSA-N	-1	3	343.265	1.981	20	5		EDBDHM
O=C(NC1CCN([C@H]2CCOC2)CC1)c1cc([O-])ccc1[N+](=O)[O-]	ZINC000367532744	154164045	/nfs/dbraw/zinc/16/40/45/154164045.db2.gz	DHNLBVWBIUPDFT-LBPRGKRZSA-N	-1	3	335.360	1.284	20	5		EDBDHM
O=C(c1ccc([N+](=O)[O-])c([O-])c1)N1CCCN(C2CCOCC2)CC1	ZINC000369525840	155072905	/nfs/dbraw/zinc/07/29/05/155072905.db2.gz	PHLFTKZGDXJPHP-UHFFFAOYSA-N	-1	3	349.387	1.627	20	5		EDBDHM
CCCN1CCC[C@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000352501730	162215668	/nfs/dbraw/zinc/21/56/68/162215668.db2.gz	WVWNOLWELFEKAQ-LBPRGKRZSA-N	-1	3	345.396	1.887	20	5		EDBDHM
CCCCCS(=O)(=O)[N-][C@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000273590130	268060880	/nfs/dbraw/zinc/06/08/80/268060880.db2.gz	ISPKBWWGUIMTCX-KGLIPLIRSA-N	-1	3	346.405	1.099	20	5		EDBDHM
C[C@@H]1Oc2ccc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)cc2NC1=O	ZINC000361905472	279063972	/nfs/dbraw/zinc/06/39/72/279063972.db2.gz	AAFJOHFBOWOCNJ-ZETCQYMHSA-N	-1	3	344.283	1.667	20	5		EDBDHM
Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H]2C[C@@]2(C)NC(=O)[N-]C2=O)n1	ZINC000343356390	301203853	/nfs/dbraw/zinc/20/38/53/301203853.db2.gz	QIWNIGJVMXXHEF-MEDUHNTESA-N	-1	3	347.375	1.564	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2C(=O)NCC[C@H]2C)c1[N+](=O)[O-]	ZINC000195476500	301555668	/nfs/dbraw/zinc/55/56/68/301555668.db2.gz	UAWBQFWWMIYQGY-KCJUWKMLSA-N	-1	3	341.389	1.015	20	5		EDBDHM
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)[N-]CCCN1CCCCC1	ZINC000299353443	304806638	/nfs/dbraw/zinc/80/66/38/304806638.db2.gz	BVPPSHXIBJGTPA-UHFFFAOYSA-N	-1	3	345.396	1.888	20	5		EDBDHM
COC(=O)c1ccc(C)c(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1O	ZINC000436507647	305159274	/nfs/dbraw/zinc/15/92/74/305159274.db2.gz	AQMPJUOCFRTCCW-UHFFFAOYSA-N	-1	3	347.283	1.748	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])[C@@H](O)C(F)F	ZINC000451706967	305363636	/nfs/dbraw/zinc/36/36/36/305363636.db2.gz	HJMCBTZWAFAONR-MWLCHTKSSA-N	-1	3	338.332	1.419	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1(CF)CCOCC1	ZINC000451731919	305365489	/nfs/dbraw/zinc/36/54/89/305365489.db2.gz	CHNFPSMTIHJXDK-UHFFFAOYSA-N	-1	3	348.352	1.400	20	5		EDBDHM
CO[C@@H]1COCC[C@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000451780993	305368723	/nfs/dbraw/zinc/36/87/23/305368723.db2.gz	WTDPKSGUKFWLET-JOYOIKCWSA-N	-1	3	348.352	1.064	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCC[C@H]1CCOC1	ZINC000452022930	305379314	/nfs/dbraw/zinc/37/93/14/305379314.db2.gz	VXXZAEXVHKUTPL-NSHDSACASA-N	-1	3	344.389	1.698	20	5		EDBDHM
COC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCOCC1	ZINC000610958070	450392043	/nfs/dbraw/zinc/39/20/43/450392043.db2.gz	VHWNOVDVFXVZDR-UHFFFAOYSA-N	-1	3	348.352	1.208	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCCF)c(Br)c1	ZINC000532614564	305987000	/nfs/dbraw/zinc/98/70/00/305987000.db2.gz	WRZAUEZKZQYTPD-UHFFFAOYSA-N	-1	3	341.158	1.995	20	5		EDBDHM
CC(C)N1CCN([C@H]2CCN(Cc3cc([O-])ccc3[N+](=O)[O-])C2)CC1	ZINC000549860214	306149361	/nfs/dbraw/zinc/14/93/61/306149361.db2.gz	JWAQQZBMTWZEOZ-INIZCTEOSA-N	-1	3	348.447	1.901	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1c[nH]c(=O)c(C)c1	ZINC000550429081	306152818	/nfs/dbraw/zinc/15/28/18/306152818.db2.gz	PGLDDVMILVWKNH-UHFFFAOYSA-N	-1	3	339.329	1.813	20	5		EDBDHM
CNC(=O)C1CCC([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000063310920	441325785	/nfs/dbraw/zinc/32/57/85/441325785.db2.gz	CJNGCMGUVYYFOW-UHFFFAOYSA-N	-1	3	341.389	1.178	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CCCOC1	ZINC000056130053	441691413	/nfs/dbraw/zinc/69/14/13/441691413.db2.gz	OPGYMEXOVBWTAW-SNVBAGLBSA-N	-1	3	330.362	1.308	20	5		EDBDHM
CN(C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[n-]c1=O)Cc1ccccc1	ZINC000121675037	441756774	/nfs/dbraw/zinc/75/67/74/441756774.db2.gz	JLCMRILKMCBKTR-CYBMUJFWSA-N	-1	3	344.371	1.598	20	5		EDBDHM
C[C@@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1	ZINC000122781215	441862621	/nfs/dbraw/zinc/86/26/21/441862621.db2.gz	CIWWIDBWBMZHFY-LURJTMIESA-N	-1	3	339.167	1.016	20	5		EDBDHM
O=[N+]([O-])c1ccc(OC(F)F)c([N-]S(=O)(=O)N2CCCC2)c1	ZINC000078237046	441908597	/nfs/dbraw/zinc/90/85/97/441908597.db2.gz	CRDCWFLBIXRHTF-UHFFFAOYSA-N	-1	3	337.304	1.949	20	5		EDBDHM
CCN1CCC[C@@H]1C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000162139559	442068139	/nfs/dbraw/zinc/06/81/39/442068139.db2.gz	COISOJPCWUBJNF-SNVBAGLBSA-N	-1	3	333.435	1.727	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C1CC1	ZINC000152369140	442203454	/nfs/dbraw/zinc/20/34/54/442203454.db2.gz	KTBPSBARCIQYET-LBPRGKRZSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)[C@@H]2CCOC2)c1C	ZINC000120961475	442157735	/nfs/dbraw/zinc/15/77/35/442157735.db2.gz	MNUDQAYJRCEPJD-VXGBXAGGSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Nc1ncc([N+](=O)[O-])cc1C(=O)[N-]c1nnc(-c2ccccn2)s1	ZINC000180543345	442619532	/nfs/dbraw/zinc/61/95/32/442619532.db2.gz	DUDCJWWWOZXLQI-UHFFFAOYSA-N	-1	3	343.328	1.738	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]C[C@H]1CC[C@@H](O)C1	ZINC000188345035	442741680	/nfs/dbraw/zinc/74/16/80/442741680.db2.gz	XWULOGNQAHFDNQ-WCBMZHEXSA-N	-1	3	334.781	1.688	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCCC[C@H]1OC	ZINC000266166987	443043083	/nfs/dbraw/zinc/04/30/83/443043083.db2.gz	INBZATGVMGWYKJ-VXGBXAGGSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]CC2(O)CCCC2)cc1[N+](=O)[O-]	ZINC000184849875	443086097	/nfs/dbraw/zinc/08/60/97/443086097.db2.gz	BNDRRYAUAQPVCA-UHFFFAOYSA-N	-1	3	332.353	1.626	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)[C@H]2CCOC2)cc1C	ZINC000266217145	443061919	/nfs/dbraw/zinc/06/19/19/443061919.db2.gz	RKAYWFANJYBXOY-RYUDHWBXSA-N	-1	3	328.390	1.915	20	5		EDBDHM
COc1cc(-c2noc(Cn3ccc(=O)c([N+](=O)[O-])c3)n2)ccc1[O-]	ZINC000350576486	319055557	/nfs/dbraw/zinc/05/55/57/319055557.db2.gz	HEMGWBRVJJXKBX-UHFFFAOYSA-N	-1	3	344.283	1.569	20	5		EDBDHM
CCS(=O)(=O)CCCNCc1cc(OC)c([O-])cc1[N+](=O)[O-]	ZINC000414542935	319329659	/nfs/dbraw/zinc/32/96/59/319329659.db2.gz	MEMYJVJOFMAWSX-UHFFFAOYSA-N	-1	3	332.378	1.223	20	5		EDBDHM
O=C1[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C[C@H]2CCCCN12	ZINC000416514770	319437823	/nfs/dbraw/zinc/43/78/23/319437823.db2.gz	IUASZROBYICAKF-GHMZBOCLSA-N	-1	3	339.373	1.027	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C[C@H](C)CCO)c1	ZINC000272490898	443337569	/nfs/dbraw/zinc/33/75/69/443337569.db2.gz	PZILMMYNVPBZNW-MRVPVSSYSA-N	-1	3	336.797	1.853	20	5		EDBDHM
CC(C)[C@@H]1OCC[C@H]1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000267305872	443412477	/nfs/dbraw/zinc/41/24/77/443412477.db2.gz	VUJWOAXONBAWRO-FZMZJTMJSA-N	-1	3	328.390	1.934	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000269733347	443416327	/nfs/dbraw/zinc/41/63/27/443416327.db2.gz	RTXOWQGVUNTNPU-PWSUYJOCSA-N	-1	3	330.362	1.185	20	5		EDBDHM
C[C@@H]1CC[C@H]([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000444213795	320120517	/nfs/dbraw/zinc/12/05/17/320120517.db2.gz	CWEGZYBZPJOXLP-ZJUUUORDSA-N	-1	3	342.373	1.833	20	5		EDBDHM
COCc1nnc(Sc2ncc(C(=O)OC)cc2[N+](=O)[O-])[n-]1	ZINC000276577953	443753245	/nfs/dbraw/zinc/75/32/45/443753245.db2.gz	AQRCANQEUDPJII-UHFFFAOYSA-N	-1	3	325.306	1.192	20	5		EDBDHM
COCc1n[n-]c(Sc2ncc(C(=O)OC)cc2[N+](=O)[O-])n1	ZINC000276577953	443753249	/nfs/dbraw/zinc/75/32/49/443753249.db2.gz	AQRCANQEUDPJII-UHFFFAOYSA-N	-1	3	325.306	1.192	20	5		EDBDHM
COCc1nc(Sc2ncc(C(=O)OC)cc2[N+](=O)[O-])n[n-]1	ZINC000276577953	443753254	/nfs/dbraw/zinc/75/32/54/443753254.db2.gz	AQRCANQEUDPJII-UHFFFAOYSA-N	-1	3	325.306	1.192	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1C[C@@H](C)O[C@@H](C)C1	ZINC000536607441	320727790	/nfs/dbraw/zinc/72/77/90/320727790.db2.gz	URYCZZIYJZRYBH-JGPRNRPPSA-N	-1	3	344.389	1.838	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)c2nncn2C)cc1C	ZINC000299063693	443943707	/nfs/dbraw/zinc/94/37/07/443943707.db2.gz	UFHIUVSVNSJMPK-JTQLQIEISA-N	-1	3	339.377	1.380	20	5		EDBDHM
CCOC(=O)c1nnc(C2CCN(c3c([N+](=O)[O-])ncn3C)CC2)[n-]1	ZINC000277980833	444075847	/nfs/dbraw/zinc/07/58/47/444075847.db2.gz	MDAKPVZDFRYZRR-UHFFFAOYSA-N	-1	3	349.351	1.007	20	5		EDBDHM
CCOC(=O)c1nc(C2CCN(c3c([N+](=O)[O-])ncn3C)CC2)n[n-]1	ZINC000277980833	444075850	/nfs/dbraw/zinc/07/58/50/444075850.db2.gz	MDAKPVZDFRYZRR-UHFFFAOYSA-N	-1	3	349.351	1.007	20	5		EDBDHM
CCOC(=O)c1n[n-]c(C2CCN(c3c([N+](=O)[O-])ncn3C)CC2)n1	ZINC000277980833	444075854	/nfs/dbraw/zinc/07/58/54/444075854.db2.gz	MDAKPVZDFRYZRR-UHFFFAOYSA-N	-1	3	349.351	1.007	20	5		EDBDHM
COc1cc(CN[C@H](CO)C[C@@H](O)C(C)(C)C)c([N+](=O)[O-])cc1[O-]	ZINC000570806590	321358686	/nfs/dbraw/zinc/35/86/86/321358686.db2.gz	GNBVHVWVWPNWRT-XHDPSFHLSA-N	-1	3	342.392	1.557	20	5		EDBDHM
CC[C@H](C[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1)OC	ZINC000289503189	444160119	/nfs/dbraw/zinc/16/01/19/444160119.db2.gz	LBGTTXUGTYSXSR-MRVPVSSYSA-N	-1	3	336.341	1.446	20	5		EDBDHM
CS(=O)(=O)c1cc(C(=O)[N-]O[C@H]2CCCCO2)cc([N+](=O)[O-])c1	ZINC000299722548	444124946	/nfs/dbraw/zinc/12/49/46/444124946.db2.gz	XJJUHVVTZAZSAU-LBPRGKRZSA-N	-1	3	344.345	1.186	20	5		EDBDHM
COC(=O)CCCO[N-]C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000290548625	444294252	/nfs/dbraw/zinc/29/42/52/444294252.db2.gz	HOXHGZPTLIAKHS-UHFFFAOYSA-N	-1	3	327.249	1.118	20	5		EDBDHM
C[C@](O)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C1CC1	ZINC000314647873	444301977	/nfs/dbraw/zinc/30/19/77/444301977.db2.gz	VQEDXAAEQYBFLB-LBPRGKRZSA-N	-1	3	334.781	1.688	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C)C(=O)OC(C)(C)C	ZINC000321934494	444337916	/nfs/dbraw/zinc/33/79/16/444337916.db2.gz	LMQBEBPYAHIXKZ-SNVBAGLBSA-N	-1	3	344.389	1.912	20	5		EDBDHM
CCC(CC)(CO)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000323238651	444342378	/nfs/dbraw/zinc/34/23/78/444342378.db2.gz	VYYVZQIZGZXCHZ-UHFFFAOYSA-N	-1	3	346.405	1.680	20	5		EDBDHM
Cc1c([C@@H](C)[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])cnn1C	ZINC000337824874	444425342	/nfs/dbraw/zinc/42/53/42/444425342.db2.gz	WRTWDPUWDXRVIX-SNVBAGLBSA-N	-1	3	338.389	1.985	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCCOC(F)F	ZINC000337960926	444472524	/nfs/dbraw/zinc/47/25/24/444472524.db2.gz	STMNKFNMKOSEOT-UHFFFAOYSA-N	-1	3	340.304	1.511	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CCC[C@@H](O)C1	ZINC000336872384	444817007	/nfs/dbraw/zinc/81/70/07/444817007.db2.gz	MRDAAXWKFRCLPU-CMPLNLGQSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CCC[C@H]1F	ZINC000339117637	445039973	/nfs/dbraw/zinc/03/99/73/445039973.db2.gz	BHNXZMBHQUQKPS-MNOVXSKESA-N	-1	3	346.336	1.550	20	5		EDBDHM
O=[N+]([O-])c1cccc(S(=O)(=O)[N-][C@H](CO)CC(F)(F)F)c1	ZINC000354630950	445321140	/nfs/dbraw/zinc/32/11/40/445321140.db2.gz	WUBIXMMXPHFPRQ-ZETCQYMHSA-N	-1	3	328.268	1.186	20	5		EDBDHM
CCC[C@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(=O)OC	ZINC000358615387	445678262	/nfs/dbraw/zinc/67/82/62/445678262.db2.gz	WWGBELPNBIZBST-NSHDSACASA-N	-1	3	344.389	1.832	20	5		EDBDHM
COc1cncc(C(=O)[N-]c2n[nH]c(-c3cccc([N+](=O)[O-])c3)n2)n1	ZINC000361792660	445949509	/nfs/dbraw/zinc/94/95/09/445949509.db2.gz	PBLFZKMGBCMRJQ-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCN(C2CC2)C1	ZINC000354282845	446079010	/nfs/dbraw/zinc/07/90/10/446079010.db2.gz	PQVGNAGFTJNCKH-LLVKDONJSA-N	-1	3	325.390	1.418	20	5		EDBDHM
O=C(Nc1ccc2c(c1)NC(=O)CS2)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000361984854	446129026	/nfs/dbraw/zinc/12/90/26/446129026.db2.gz	WEJMEXNZVYMCOT-UHFFFAOYSA-N	-1	3	346.324	1.992	20	5		EDBDHM
C/C=C\C[C@@H](CO)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000351568856	446165481	/nfs/dbraw/zinc/16/54/81/446165481.db2.gz	RNUREWPCGIITLS-RXNFCKPNSA-N	-1	3	328.390	1.817	20	5		EDBDHM
O=C(Nc1ccc(NC(=O)C2CC2)nc1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000362098587	446211653	/nfs/dbraw/zinc/21/16/53/446211653.db2.gz	RADMZCSNGLIOMJ-UHFFFAOYSA-N	-1	3	343.299	1.691	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C[C@@H]2[C@H]3COC[C@H]32)cc1[N+](=O)[O-]	ZINC000368506920	446906939	/nfs/dbraw/zinc/90/69/39/446906939.db2.gz	GSFCGZYAGKIMAJ-OWUUHHOZSA-N	-1	3	346.792	1.727	20	5		EDBDHM
CC[C@@H](C)[C@](C)(O)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000443305198	447028549	/nfs/dbraw/zinc/02/85/49/447028549.db2.gz	KOZDEJMIICFDKW-QMTHXVAHSA-N	-1	3	346.405	1.679	20	5		EDBDHM
C[C@@H](CCO)CC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000397757954	447552295	/nfs/dbraw/zinc/55/22/95/447552295.db2.gz	SYTTXWDAFZLTNQ-SECBINFHSA-N	-1	3	336.797	1.935	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CC23CCOCC3)c(F)c1	ZINC000451886455	447773561	/nfs/dbraw/zinc/77/35/61/447773561.db2.gz	DEKLALIGGDESJC-GFCCVEGCSA-N	-1	3	330.337	1.581	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CC12CCOCC2	ZINC000451892386	447774844	/nfs/dbraw/zinc/77/48/44/447774844.db2.gz	QQRGKONTHJSAPE-ZDUSSCGKSA-N	-1	3	342.373	1.451	20	5		EDBDHM
O=C(Nc1ccc(Cc2nnn[n-]2)cc1)c1ccc([N+](=O)[O-])cn1	ZINC000569663631	447859497	/nfs/dbraw/zinc/85/94/97/447859497.db2.gz	HJQUZADSKOFIRE-UHFFFAOYSA-N	-1	3	325.288	1.346	20	5		EDBDHM
O=C(Nc1ccc(Cc2nn[n-]n2)cc1)c1ccc([N+](=O)[O-])cn1	ZINC000569663631	447859499	/nfs/dbraw/zinc/85/94/99/447859499.db2.gz	HJQUZADSKOFIRE-UHFFFAOYSA-N	-1	3	325.288	1.346	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCN1CC[C@@H](C)C1	ZINC000525819455	448033170	/nfs/dbraw/zinc/03/31/70/448033170.db2.gz	OILDAUIJZHAYKX-LLVKDONJSA-N	-1	3	327.406	1.523	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1	ZINC000527124193	448165436	/nfs/dbraw/zinc/16/54/36/448165436.db2.gz	KKFHEWGPUSDDNT-ZDUSSCGKSA-N	-1	3	332.360	1.960	20	5		EDBDHM
CCNC(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)c1	ZINC000591602105	448403489	/nfs/dbraw/zinc/40/34/89/448403489.db2.gz	OXKULNWWOUIAQP-UHFFFAOYSA-N	-1	3	330.300	1.697	20	5		EDBDHM
CC[C@@H](C)C[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000592066123	448656834	/nfs/dbraw/zinc/65/68/34/448656834.db2.gz	DGVWKERZAPVSSX-GHMZBOCLSA-N	-1	3	344.389	1.851	20	5		EDBDHM
CC(C)(C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])[C@]1(O)CCOC1	ZINC000592088044	448673629	/nfs/dbraw/zinc/67/36/29/448673629.db2.gz	STRQJLMIZPGSKO-AWEZNQCLSA-N	-1	3	344.389	1.051	20	5		EDBDHM
COCCN(C)CCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000567944288	448788480	/nfs/dbraw/zinc/78/84/80/448788480.db2.gz	IOBSVYXMJAJQRI-UHFFFAOYSA-N	-1	3	331.756	1.262	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCN2CC[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000547347548	448871597	/nfs/dbraw/zinc/87/15/97/448871597.db2.gz	VKHUAKSGYHXOPX-SECBINFHSA-N	-1	3	333.435	1.585	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H](C)N2CCCC2)c([N+](=O)[O-])c1	ZINC000548042490	448974525	/nfs/dbraw/zinc/97/45/25/448974525.db2.gz	JAXALVPOKMMHTJ-LLVKDONJSA-N	-1	3	343.405	1.366	20	5		EDBDHM
CN1CCC[C@@H](N2CCN(c3ccc([N+](=O)[O-])c(C(=O)[O-])c3)CC2)C1	ZINC000592975164	449091285	/nfs/dbraw/zinc/09/12/85/449091285.db2.gz	DKVDQLIWTIJOBN-CQSZACIVSA-N	-1	3	348.403	1.509	20	5		EDBDHM
Cc1cccc2c1OC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C2	ZINC000593599183	449099788	/nfs/dbraw/zinc/09/97/88/449099788.db2.gz	UAECTGYYVXLOPG-GFCCVEGCSA-N	-1	3	349.368	1.580	20	5		EDBDHM
O=C(c1ccccc1[O-])N1CCN(c2cc[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC000596078248	449352800	/nfs/dbraw/zinc/35/28/00/449352800.db2.gz	UIWLTZXJWFFTAH-UHFFFAOYSA-N	-1	3	344.327	1.363	20	5		EDBDHM
O=c1[n-]ccc(N2CCC3(CCC3)S(=O)(=O)CC2)c1[N+](=O)[O-]	ZINC000596271103	449448079	/nfs/dbraw/zinc/44/80/79/449448079.db2.gz	KFBPVXCZNWDYAE-UHFFFAOYSA-N	-1	3	327.362	1.243	20	5		EDBDHM
CO[C@@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)c2cccc([O-])c2[N+](=O)[O-])C1	ZINC000600624469	449463962	/nfs/dbraw/zinc/46/39/62/449463962.db2.gz	ZYJIPCZQRPVBLY-KWCYVHTRSA-N	-1	3	349.387	1.672	20	5		EDBDHM
C[C@@H]1CCCCN1CC[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594748532	449664082	/nfs/dbraw/zinc/66/40/82/449664082.db2.gz	MCAKRADFDUSQLJ-LLVKDONJSA-N	-1	3	328.394	1.143	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])N1CCC[C@H](C)C1	ZINC000594749365	449665432	/nfs/dbraw/zinc/66/54/32/449665432.db2.gz	SNVCILCEGVZFLW-NWDGAFQWSA-N	-1	3	342.421	1.389	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-][C@@H]1C=C[C@H](CO)C1	ZINC000594759776	449674909	/nfs/dbraw/zinc/67/49/09/449674909.db2.gz	JOAIDMCHSGIQBK-WDEREUQCSA-N	-1	3	349.368	1.358	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H](CO)C2CCC2)c(Cl)c1	ZINC000594800061	449711949	/nfs/dbraw/zinc/71/19/49/449711949.db2.gz	BQQKYZZMOQPXDS-NSHDSACASA-N	-1	3	334.781	1.688	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](CO)C1CCC1	ZINC000594800078	449712363	/nfs/dbraw/zinc/71/23/63/449712363.db2.gz	CDYAXFQHWSYKKU-LLVKDONJSA-N	-1	3	330.362	1.043	20	5		EDBDHM
CCCN1CCC[C@H]1C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594778433	449691081	/nfs/dbraw/zinc/69/10/81/449691081.db2.gz	POYFJNCMCLEBNB-NSHDSACASA-N	-1	3	328.394	1.143	20	5		EDBDHM
C[C@@H]1CCC[C@H](C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])O1	ZINC000594851261	449759374	/nfs/dbraw/zinc/75/93/74/449759374.db2.gz	INLRITIVMANTJN-DGCLKSJQSA-N	-1	3	328.390	1.972	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CC[C@H]2CCCO2)c(F)cc1[N+](=O)[O-]	ZINC000601297550	449807434	/nfs/dbraw/zinc/80/74/34/449807434.db2.gz	CKZPZDODFMGGKM-SNVBAGLBSA-N	-1	3	332.353	1.890	20	5		EDBDHM
Cc1cccc2c1C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)CO2	ZINC000599374633	449928471	/nfs/dbraw/zinc/92/84/71/449928471.db2.gz	JROYEXPOEXSIAV-NSHDSACASA-N	-1	3	349.368	1.580	20	5		EDBDHM
CN(CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)CC(F)F	ZINC000599520972	450039908	/nfs/dbraw/zinc/03/99/08/450039908.db2.gz	BYWGGFNECHDNIB-UHFFFAOYSA-N	-1	3	341.311	1.209	20	5		EDBDHM
CCn1nccc1C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000595415251	450127534	/nfs/dbraw/zinc/12/75/34/450127534.db2.gz	KRXNGQQFTZHMEC-UHFFFAOYSA-N	-1	3	340.361	1.298	20	5		EDBDHM
O=C(CC[C@@H]1NC(=O)[N-]C1=O)NCCCCc1ccc([N+](=O)[O-])cc1	ZINC000610070457	450134814	/nfs/dbraw/zinc/13/48/14/450134814.db2.gz	AKOVODKAVJZEPQ-ZDUSSCGKSA-N	-1	3	348.359	1.022	20	5		EDBDHM
C[C@H](C[C@H]1CCOC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000610739613	450316791	/nfs/dbraw/zinc/31/67/91/450316791.db2.gz	GGKFMHXDQPQVEM-NXEZZACHSA-N	-1	3	332.353	1.827	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@]1(C)CCO[C@@H]1C	ZINC000619496369	450491661	/nfs/dbraw/zinc/49/16/61/450491661.db2.gz	WSYCENPCNPAZEL-NOZJJQNGSA-N	-1	3	330.362	1.449	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CCOC(C)(C)C1	ZINC000269945469	536956711	/nfs/dbraw/zinc/95/67/11/536956711.db2.gz	QBCHQCGKDYGYMP-JTQLQIEISA-N	-1	3	344.389	1.839	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)c1nc(C)no1	ZINC000352714128	536956874	/nfs/dbraw/zinc/95/68/74/536956874.db2.gz	RSYUNEQZEVFDOH-SSDOTTSWSA-N	-1	3	342.333	1.334	20	5		EDBDHM
COC(=O)CC(C)(C)[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000741257965	578655657	/nfs/dbraw/zinc/65/56/57/578655657.db2.gz	MIOFAYNNXWSIBG-UHFFFAOYSA-N	-1	3	346.361	1.223	20	5		EDBDHM
CO[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1)C(F)(F)F	ZINC000734496005	578819187	/nfs/dbraw/zinc/81/91/87/578819187.db2.gz	NSIZVWQNDDDJPP-JTQLQIEISA-N	-1	3	342.295	1.759	20	5		EDBDHM
CC(C)c1nnc(Sc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)n1C	ZINC000735952380	578942326	/nfs/dbraw/zinc/94/23/26/578942326.db2.gz	FEDIWWQDPDFHEN-UHFFFAOYSA-N	-1	3	347.364	1.573	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1OC(=O)c1ccc(-c2nnn[n-]2)cn1	ZINC000737373042	579080451	/nfs/dbraw/zinc/08/04/51/579080451.db2.gz	PUDRPSFTJGTQMH-UHFFFAOYSA-N	-1	3	326.272	1.698	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1OC(=O)c1ccc(-c2nn[n-]n2)cn1	ZINC000737373042	579080452	/nfs/dbraw/zinc/08/04/52/579080452.db2.gz	PUDRPSFTJGTQMH-UHFFFAOYSA-N	-1	3	326.272	1.698	20	5		EDBDHM
NC(=O)CC[C@@H]1CCCN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000737748995	579127968	/nfs/dbraw/zinc/12/79/68/579127968.db2.gz	UQMSFFSETPIXBA-JTQLQIEISA-N	-1	3	345.363	1.257	20	5		EDBDHM
NC(=O)CC[C@@H]1CCCN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1	ZINC000737748995	579127970	/nfs/dbraw/zinc/12/79/70/579127970.db2.gz	UQMSFFSETPIXBA-JTQLQIEISA-N	-1	3	345.363	1.257	20	5		EDBDHM
O=C(NCc1ccc(-c2nnn[n-]2)cc1F)c1cccc([N+](=O)[O-])c1	ZINC000738102631	579160484	/nfs/dbraw/zinc/16/04/84/579160484.db2.gz	SENSNKQUUAAIII-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=C(NCc1ccc(-c2nn[n-]n2)cc1F)c1cccc([N+](=O)[O-])c1	ZINC000738102631	579160485	/nfs/dbraw/zinc/16/04/85/579160485.db2.gz	SENSNKQUUAAIII-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=C(NCc1cccc(-c2nnn[n-]2)c1)c1cc([N+](=O)[O-])ccc1F	ZINC000738115471	579161301	/nfs/dbraw/zinc/16/13/01/579161301.db2.gz	CACSNIZBZZZBGW-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=C(NCc1cccc(-c2nn[n-]n2)c1)c1cc([N+](=O)[O-])ccc1F	ZINC000738115471	579161302	/nfs/dbraw/zinc/16/13/02/579161302.db2.gz	CACSNIZBZZZBGW-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=C([O-])[C@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000739505145	579212986	/nfs/dbraw/zinc/21/29/86/579212986.db2.gz	BONSZKFBCVIFCZ-GDBMZVCRSA-N	-1	3	346.339	1.750	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCc2nnc(C(F)(F)F)[n-]2)c2nonc21	ZINC000775541973	580393245	/nfs/dbraw/zinc/39/32/45/580393245.db2.gz	IRUBZZSQFUYYDE-UHFFFAOYSA-N	-1	3	329.198	1.880	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCc2n[n-]c(C(F)(F)F)n2)c2nonc21	ZINC000775541973	580393246	/nfs/dbraw/zinc/39/32/46/580393246.db2.gz	IRUBZZSQFUYYDE-UHFFFAOYSA-N	-1	3	329.198	1.880	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCc2nc(C(F)(F)F)n[n-]2)c2nonc21	ZINC000775541973	580393247	/nfs/dbraw/zinc/39/32/47/580393247.db2.gz	IRUBZZSQFUYYDE-UHFFFAOYSA-N	-1	3	329.198	1.880	20	5		EDBDHM
O=C(CNC(=O)c1cccc([O-])c1)OCc1ccccc1[N+](=O)[O-]	ZINC000779465334	580486258	/nfs/dbraw/zinc/48/62/58/580486258.db2.gz	UDWMIXUBNIRNNR-UHFFFAOYSA-N	-1	3	330.296	1.774	20	5		EDBDHM
COC(=O)C=Cc1ccc(Sc2n[n-]c(CO)n2)c([N+](=O)[O-])c1	ZINC000788319270	580717243	/nfs/dbraw/zinc/71/72/43/580717243.db2.gz	TWVIDIBFLQFIDE-HWKANZROSA-N	-1	3	336.329	1.543	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)[C@@H]1CCCO1	ZINC000788711092	580728449	/nfs/dbraw/zinc/72/84/49/580728449.db2.gz	UCJSCQPTNMSXAC-ZJUUUORDSA-N	-1	3	336.391	1.129	20	5		EDBDHM
COC(=O)CC(C)(C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000741256920	592916647	/nfs/dbraw/zinc/91/66/47/592916647.db2.gz	FFWUMLHMOFHGOL-UHFFFAOYSA-N	-1	3	346.361	1.223	20	5		EDBDHM
Cn1nccc1[C@@H](CO)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000838065408	593118132	/nfs/dbraw/zinc/11/81/32/593118132.db2.gz	XNTWNJFBTTZSDU-LLVKDONJSA-N	-1	3	340.286	1.270	20	5		EDBDHM
C[C@@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)c1ccc(-c2nnn[n-]2)cc1	ZINC000820499935	593824359	/nfs/dbraw/zinc/82/43/59/593824359.db2.gz	ARHICTPLQLPZHN-SECBINFHSA-N	-1	3	343.303	1.276	20	5		EDBDHM
C[C@@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)c1ccc(-c2nn[n-]n2)cc1	ZINC000820499935	593824360	/nfs/dbraw/zinc/82/43/60/593824360.db2.gz	ARHICTPLQLPZHN-SECBINFHSA-N	-1	3	343.303	1.276	20	5		EDBDHM
CC1(C)C[C@@](C)([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C(=O)O1	ZINC000820734765	593875997	/nfs/dbraw/zinc/87/59/97/593875997.db2.gz	JXVQQJOETKLUEE-CYBMUJFWSA-N	-1	3	328.346	1.357	20	5		EDBDHM
COC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C[C@H]1C	ZINC000821656823	593899817	/nfs/dbraw/zinc/89/98/17/593899817.db2.gz	ACGNGZCBNUBEEB-KCJUWKMLSA-N	-1	3	332.320	1.020	20	5		EDBDHM
COC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C[C@H]1C	ZINC000821656823	593899818	/nfs/dbraw/zinc/89/98/18/593899818.db2.gz	ACGNGZCBNUBEEB-KCJUWKMLSA-N	-1	3	332.320	1.020	20	5		EDBDHM
COc1ccc(-c2nnn[n-]2)cc1COC(=O)c1ccc([N+](=O)[O-])o1	ZINC000821745287	593928440	/nfs/dbraw/zinc/92/84/40/593928440.db2.gz	NQJRQQXRBLRJLZ-UHFFFAOYSA-N	-1	3	345.271	1.734	20	5		EDBDHM
COc1ccc(-c2nn[n-]n2)cc1COC(=O)c1ccc([N+](=O)[O-])o1	ZINC000821745287	593928442	/nfs/dbraw/zinc/92/84/42/593928442.db2.gz	NQJRQQXRBLRJLZ-UHFFFAOYSA-N	-1	3	345.271	1.734	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(CC(=O)c2ccc(-c3nnn[n-]3)cc2)c1=O	ZINC000822212662	594010656	/nfs/dbraw/zinc/01/06/56/594010656.db2.gz	AZOZPJRVNSHFQE-UHFFFAOYSA-N	-1	3	340.299	1.128	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(CC(=O)c2ccc(-c3nn[n-]n3)cc2)c1=O	ZINC000822212662	594010657	/nfs/dbraw/zinc/01/06/57/594010657.db2.gz	AZOZPJRVNSHFQE-UHFFFAOYSA-N	-1	3	340.299	1.128	20	5		EDBDHM
O=C(NCc1cccc(-c2nnn[n-]2)c1)c1ccc([N+](=O)[O-])cn1	ZINC000823257158	594176689	/nfs/dbraw/zinc/17/66/89/594176689.db2.gz	CFVJKMRYQVEFAK-UHFFFAOYSA-N	-1	3	325.288	1.100	20	5		EDBDHM
O=C(NCc1cccc(-c2nn[n-]n2)c1)c1ccc([N+](=O)[O-])cn1	ZINC000823257158	594176690	/nfs/dbraw/zinc/17/66/90/594176690.db2.gz	CFVJKMRYQVEFAK-UHFFFAOYSA-N	-1	3	325.288	1.100	20	5		EDBDHM
CCN1C[C@@H](C)N(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000825453682	594187498	/nfs/dbraw/zinc/18/74/98/594187498.db2.gz	WMBVVIXRBMXRLJ-WDEREUQCSA-N	-1	3	331.380	1.694	20	5		EDBDHM
CCN1C[C@@H](C)N(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C[C@H]1C	ZINC000825453672	594187536	/nfs/dbraw/zinc/18/75/36/594187536.db2.gz	WMBVVIXRBMXRLJ-GHMZBOCLSA-N	-1	3	331.380	1.694	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCO[C@@H]2CCCC[C@H]21	ZINC000823630465	594223074	/nfs/dbraw/zinc/22/30/74/594223074.db2.gz	XBRYKCSBPTUVCQ-TZMCWYRMSA-N	-1	3	330.348	1.923	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCO[C@@H]2CCCC[C@H]21	ZINC000823630465	594223075	/nfs/dbraw/zinc/22/30/75/594223075.db2.gz	XBRYKCSBPTUVCQ-TZMCWYRMSA-N	-1	3	330.348	1.923	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCOC[C@H]2c2ccco2)c(-c2nnn[n-]2)c1	ZINC000823639868	594223823	/nfs/dbraw/zinc/22/38/23/594223823.db2.gz	JSBHQIKRDXABFV-ZDUSSCGKSA-N	-1	3	342.315	1.946	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCOC[C@H]2c2ccco2)c(-c2nn[n-]n2)c1	ZINC000823639868	594223824	/nfs/dbraw/zinc/22/38/24/594223824.db2.gz	JSBHQIKRDXABFV-ZDUSSCGKSA-N	-1	3	342.315	1.946	20	5		EDBDHM
COc1cc(-c2nnn[n-]2)ccc1Cn1nc(C)c([N+](=O)[O-])c1C	ZINC000826174212	594362579	/nfs/dbraw/zinc/36/25/79/594362579.db2.gz	NKSAAJCNYVUGMP-UHFFFAOYSA-N	-1	3	329.320	1.645	20	5		EDBDHM
COc1cc(-c2nn[n-]n2)ccc1Cn1nc(C)c([N+](=O)[O-])c1C	ZINC000826174212	594362580	/nfs/dbraw/zinc/36/25/80/594362580.db2.gz	NKSAAJCNYVUGMP-UHFFFAOYSA-N	-1	3	329.320	1.645	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCC[C@@H](OC(F)F)C1	ZINC000826497652	594502286	/nfs/dbraw/zinc/50/22/86/594502286.db2.gz	ONSVPTNIEGJERQ-SECBINFHSA-N	-1	3	340.290	1.983	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCC[C@@H](OC(F)F)C1	ZINC000826497652	594502288	/nfs/dbraw/zinc/50/22/88/594502288.db2.gz	ONSVPTNIEGJERQ-SECBINFHSA-N	-1	3	340.290	1.983	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@H]([C@H]3CCOC3)C2)c(-c2nnn[n-]2)c1	ZINC000826500805	594503470	/nfs/dbraw/zinc/50/34/70/594503470.db2.gz	MTTBNCSROUMBNG-QWRGUYRKSA-N	-1	3	345.363	1.423	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@H]([C@H]3CCOC3)C2)c(-c2nn[n-]n2)c1	ZINC000826500805	594503471	/nfs/dbraw/zinc/50/34/71/594503471.db2.gz	MTTBNCSROUMBNG-QWRGUYRKSA-N	-1	3	345.363	1.423	20	5		EDBDHM
CN1CCC2(CCCN2C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC1	ZINC000833697948	594909123	/nfs/dbraw/zinc/90/91/23/594909123.db2.gz	KBYPOVWADPRNSA-UHFFFAOYSA-N	-1	3	347.371	1.993	20	5		EDBDHM
O=C(OCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C1CC1	ZINC000841536953	594917810	/nfs/dbraw/zinc/91/78/10/594917810.db2.gz	HJZFWWUIEBQVAP-UHFFFAOYSA-N	-1	3	348.764	1.480	20	5		EDBDHM
CCCO[N-]C(=O)c1cc(OC)c(OCCOC)cc1[N+](=O)[O-]	ZINC000844081299	595268675	/nfs/dbraw/zinc/26/86/75/595268675.db2.gz	WJLLNJHKOSVREN-UHFFFAOYSA-N	-1	3	328.321	1.700	20	5		EDBDHM
O=[N+]([O-])c1cn(Cc2nnc(-c3ccc(-c4nnn[n-]4)cc3)o2)cn1	ZINC000738370225	599162946	/nfs/dbraw/zinc/16/29/46/599162946.db2.gz	RVOPWOURNKOLMN-UHFFFAOYSA-N	-1	3	339.275	1.070	20	5		EDBDHM
O=[N+]([O-])c1cn(Cc2nnc(-c3ccc(-c4nn[n-]n4)cc3)o2)cn1	ZINC000738370225	599162948	/nfs/dbraw/zinc/16/29/48/599162948.db2.gz	RVOPWOURNKOLMN-UHFFFAOYSA-N	-1	3	339.275	1.070	20	5		EDBDHM
O=c1[n-]ccc(N2CCn3ncc(Br)c3C2)c1[N+](=O)[O-]	ZINC000853889628	595912946	/nfs/dbraw/zinc/91/29/46/595912946.db2.gz	LZMZGIJHBSIGKU-UHFFFAOYSA-N	-1	3	340.137	1.675	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@H]2CCN2C2CCCC2)cs1	ZINC000859346774	596058426	/nfs/dbraw/zinc/05/84/26/596058426.db2.gz	FZXXAGQOCGOGME-LLVKDONJSA-N	-1	3	345.446	1.952	20	5		EDBDHM
CCN1CCC([N-]S(=O)(=O)c2cc(F)c(C)cc2[N+](=O)[O-])CC1	ZINC000866478698	596891848	/nfs/dbraw/zinc/89/18/48/596891848.db2.gz	LOIUTJMUBJLNMS-UHFFFAOYSA-N	-1	3	345.396	1.805	20	5		EDBDHM
CCOC(=O)C[C@H](C)CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825499363	608018553	/nfs/dbraw/zinc/01/85/53/608018553.db2.gz	LILFGNWXFBVKRD-QMMMGPOBSA-N	-1	3	335.324	1.171	20	5		EDBDHM
CCOC(=O)C[C@H](C)CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825499363	608018554	/nfs/dbraw/zinc/01/85/54/608018554.db2.gz	LILFGNWXFBVKRD-QMMMGPOBSA-N	-1	3	335.324	1.171	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2C=C[C@H]3C[C@@H]2CO3)c(F)c1	ZINC000921612800	703645845	/nfs/dbraw/zinc/64/58/45/703645845.db2.gz	VYWUFLHWJMTGCV-UMNHJUIQSA-N	-1	3	342.348	1.603	20	5		EDBDHM
CN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)[C@H]1c1ccccc1	ZINC000246000277	283055338	/nfs/dbraw/zinc/05/53/38/283055338.db2.gz	YCQKUUWEULTMGZ-HUUCEWRRSA-N	-1	3	342.355	1.871	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CCC(=O)N(C)C)c1	ZINC000183508285	235117117	/nfs/dbraw/zinc/11/71/17/235117117.db2.gz	SBGGFNXABLAADI-UHFFFAOYSA-N	-1	3	349.796	1.313	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)[C@H](O)C(C)C	ZINC000416627680	251090187	/nfs/dbraw/zinc/09/01/87/251090187.db2.gz	QVPLMMHBQSOKBT-BXUZGUMPSA-N	-1	3	346.405	1.677	20	5		EDBDHM
COCCCC[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000264000508	139375034	/nfs/dbraw/zinc/37/50/34/139375034.db2.gz	NPUSPICJXGHVFW-UHFFFAOYSA-N	-1	3	346.361	1.071	20	5		EDBDHM
Cn1ccnc1-c1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2)n[n-]1	ZINC000119444914	221322031	/nfs/dbraw/zinc/32/20/31/221322031.db2.gz	AMTKHTGPTXUKJH-UHFFFAOYSA-N	-1	3	326.316	1.900	20	5		EDBDHM
Cn1ccnc1-c1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2)[n-]n1	ZINC000119444914	221322032	/nfs/dbraw/zinc/32/20/32/221322032.db2.gz	AMTKHTGPTXUKJH-UHFFFAOYSA-N	-1	3	326.316	1.900	20	5		EDBDHM
Cc1sc(C(=O)[N-]c2n[nH]c(SCCO)n2)cc1[N+](=O)[O-]	ZINC000270897620	140193415	/nfs/dbraw/zinc/19/34/15/140193415.db2.gz	RQEOVTNSDLCUCW-UHFFFAOYSA-N	-1	3	329.363	1.420	20	5		EDBDHM
CC(C)[C@@H](O)C1(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000271821248	140356240	/nfs/dbraw/zinc/35/62/40/140356240.db2.gz	NHJGLGUPIJSIAR-CYBMUJFWSA-N	-1	3	328.390	1.670	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCC[C@H](C)CO)c1C	ZINC000340068685	142255428	/nfs/dbraw/zinc/25/54/28/142255428.db2.gz	JGSLQPBSGWJFAX-JTQLQIEISA-N	-1	3	330.406	1.899	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CC[C@H](F)C1	ZINC000344921275	143027049	/nfs/dbraw/zinc/02/70/49/143027049.db2.gz	UOVLSJNHOXHHCZ-IUCAKERBSA-N	-1	3	346.336	1.550	20	5		EDBDHM
C[C@@H]1CCNC[C@H]1[N-]S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000193401621	296584690	/nfs/dbraw/zinc/58/46/90/296584690.db2.gz	GMWHDWDXKYZBQW-PSASIEDQSA-N	-1	3	333.797	1.525	20	5		EDBDHM
CCCN(CC)C[C@@H](C)[N-]S(=O)(=O)c1cn(CC)nc1[N+](=O)[O-]	ZINC000352585221	149073951	/nfs/dbraw/zinc/07/39/51/149073951.db2.gz	BMEYYYCYDLNZKB-LLVKDONJSA-N	-1	3	347.441	1.210	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C2CCN(C)CC2)c1C	ZINC000119397440	292291958	/nfs/dbraw/zinc/29/19/58/292291958.db2.gz	XBMOVATULCYSJP-UHFFFAOYSA-N	-1	3	327.406	1.584	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCN(C3CC3)C2)c1C	ZINC000339045277	292291871	/nfs/dbraw/zinc/29/18/71/292291871.db2.gz	SESRXXOHVFQPDF-GFCCVEGCSA-N	-1	3	339.417	1.727	20	5		EDBDHM
C[C@@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000122844609	222170664	/nfs/dbraw/zinc/17/06/64/222170664.db2.gz	PIQXQHDVXLVLDE-LURJTMIESA-N	-1	3	328.268	1.273	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H](C)[C@@H]2CCCO2)cc1[N+](=O)[O-]	ZINC000275126773	268284713	/nfs/dbraw/zinc/28/47/13/268284713.db2.gz	HUHDWJIUMQMPBE-UFBFGSQYSA-N	-1	3	348.352	1.588	20	5		EDBDHM
COCC[C@@H](C)[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	ZINC000275190117	268294655	/nfs/dbraw/zinc/29/46/55/268294655.db2.gz	MFEVNYGPWCVALQ-MRVPVSSYSA-N	-1	3	336.341	1.446	20	5		EDBDHM
CC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)OCCCO1	ZINC000276762542	268472299	/nfs/dbraw/zinc/47/22/99/268472299.db2.gz	BRWRYTCXDOXPPG-UHFFFAOYSA-N	-1	3	334.325	1.165	20	5		EDBDHM
O=C1[N-]C(=O)[C@]2(CCCN(c3ccc([N+](=O)[O-])c4cccnc43)C2)N1	ZINC000279071618	268781999	/nfs/dbraw/zinc/78/19/99/268781999.db2.gz	LUMGUWJLUJHGDW-MRXNPFEDSA-N	-1	3	341.327	1.321	20	5		EDBDHM
CC1(C[N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)OCCCO1	ZINC000277422293	273195126	/nfs/dbraw/zinc/19/51/26/273195126.db2.gz	CSLBOCZOADWMOU-UHFFFAOYSA-N	-1	3	330.287	1.956	20	5		EDBDHM
CCCCCNC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000280835069	273404558	/nfs/dbraw/zinc/40/45/58/273404558.db2.gz	USDAMZSTENGQMK-UHFFFAOYSA-N	-1	3	329.378	1.180	20	5		EDBDHM
COCC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)CCC1	ZINC000282482260	273660612	/nfs/dbraw/zinc/66/06/12/273660612.db2.gz	XQJSYLINLIVPLE-UHFFFAOYSA-N	-1	3	344.389	1.698	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCC(=O)N[C@H]2C)cc1C	ZINC000282575656	273681057	/nfs/dbraw/zinc/68/10/57/273681057.db2.gz	PDYRLEORHFCOIT-WDEREUQCSA-N	-1	3	341.389	1.157	20	5		EDBDHM
CC(C)[C@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1nncn1C	ZINC000285362306	274519998	/nfs/dbraw/zinc/51/99/98/274519998.db2.gz	QRDIVIFPOIQAEY-LBPRGKRZSA-N	-1	3	339.377	1.399	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CC[C@H](O)CC2)c(Cl)c1	ZINC000252707518	287822270	/nfs/dbraw/zinc/82/22/70/287822270.db2.gz	XIMYELRZRMAOAV-CZMCAQCFSA-N	-1	3	334.781	1.830	20	5		EDBDHM
CC(C)(CC(N)=O)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000186712836	277295496	/nfs/dbraw/zinc/29/54/96/277295496.db2.gz	CLFRZZGKGHIIRH-UHFFFAOYSA-N	-1	3	335.769	1.181	20	5		EDBDHM
COc1ccc([N-]C(=O)c2cn(C3CCOCC3)nn2)c([N+](=O)[O-])c1	ZINC000291104884	289002124	/nfs/dbraw/zinc/00/21/24/289002124.db2.gz	JTPOYKSGHNDNDZ-UHFFFAOYSA-N	-1	3	347.331	1.799	20	5		EDBDHM
COc1cc(S(=O)(=O)[N-]CC2CC(F)(F)C2)ccc1[N+](=O)[O-]	ZINC000292333508	289318732	/nfs/dbraw/zinc/31/87/32/289318732.db2.gz	OPKWHAFZINQWSA-UHFFFAOYSA-N	-1	3	336.316	1.927	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H](C)CCCO	ZINC000295185016	303185503	/nfs/dbraw/zinc/18/55/03/303185503.db2.gz	CIRJRAUKQAIMHN-SNVBAGLBSA-N	-1	3	332.378	1.290	20	5		EDBDHM
CCC[C@H](C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])OC	ZINC000296346222	303311880	/nfs/dbraw/zinc/31/18/80/303311880.db2.gz	VSOIPVKJPQSYIG-LLVKDONJSA-N	-1	3	332.378	1.697	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC1(CCO)CCC1	ZINC000443504039	305239061	/nfs/dbraw/zinc/23/90/61/305239061.db2.gz	VDCXOWDIZYAZEB-UHFFFAOYSA-N	-1	3	344.389	1.434	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)n[nH]1	ZINC000451601122	305355738	/nfs/dbraw/zinc/35/57/38/305355738.db2.gz	UDAUEPCDTNHKJD-UHFFFAOYSA-N	-1	3	339.377	1.371	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)[C@@H](O)C(F)F	ZINC000451706391	305363527	/nfs/dbraw/zinc/36/35/27/305363527.db2.gz	GGPBWASTEJZVBA-IMTBSYHQSA-N	-1	3	344.361	1.648	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCN1CCC(C)CC1	ZINC000046034398	441071388	/nfs/dbraw/zinc/07/13/88/441071388.db2.gz	XWZJRDNNSOWIIZ-UHFFFAOYSA-N	-1	3	341.433	1.913	20	5		EDBDHM
NC(=O)c1cccc(NC(=O)c2n[n-]c3ccc([N+](=O)[O-])cc32)c1	ZINC000046320876	441100610	/nfs/dbraw/zinc/10/06/10/441100610.db2.gz	VYUIXMWHSGTLRB-UHFFFAOYSA-N	-1	3	325.284	1.822	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC(=O)NC(C)(C)C)cc1C	ZINC000060497887	441247015	/nfs/dbraw/zinc/24/70/15/441247015.db2.gz	XEHAFEMODJIEIT-UHFFFAOYSA-N	-1	3	343.405	1.405	20	5		EDBDHM
O=C(Nc1cccc(N2CCOC2=O)c1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000029800399	441474762	/nfs/dbraw/zinc/47/47/62/441474762.db2.gz	AKGWKYBSDWTJFN-UHFFFAOYSA-N	-1	3	344.283	1.492	20	5		EDBDHM
Cn1ccnc1-c1cc(NC(=O)c2cccc([N+](=O)[O-])c2N)n[n-]1	ZINC000119849310	441963713	/nfs/dbraw/zinc/96/37/13/441963713.db2.gz	BRSLLVRPNMRIKH-UHFFFAOYSA-N	-1	3	327.304	1.553	20	5		EDBDHM
Cn1ccnc1-c1cc(NC(=O)c2cccc([N+](=O)[O-])c2N)[n-]n1	ZINC000119849310	441963718	/nfs/dbraw/zinc/96/37/18/441963718.db2.gz	BRSLLVRPNMRIKH-UHFFFAOYSA-N	-1	3	327.304	1.553	20	5		EDBDHM
CCN1CCC[C@H]1C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000162139709	442068303	/nfs/dbraw/zinc/06/83/03/442068303.db2.gz	COISOJPCWUBJNF-JTQLQIEISA-N	-1	3	333.435	1.727	20	5		EDBDHM
CCN1CCC[C@H]1C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000162200506	442072850	/nfs/dbraw/zinc/07/28/50/442072850.db2.gz	XENHJOXQJHNLQB-ZDUSSCGKSA-N	-1	3	341.433	1.974	20	5		EDBDHM
CC(C)[C@H](C)C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000172240162	442428535	/nfs/dbraw/zinc/42/85/35/442428535.db2.gz	BFKOYKRVOSBGDT-NSHDSACASA-N	-1	3	343.405	1.281	20	5		EDBDHM
Cc1nc(C)c(CCC(=O)Nc2ccc([N+](=O)[O-])c(C)n2)c(=O)[n-]1	ZINC000133723610	442431460	/nfs/dbraw/zinc/43/14/60/442431460.db2.gz	XDOIWJQIDGHCIO-UHFFFAOYSA-N	-1	3	331.332	1.570	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]c2ccncc2F)cc1[N+](=O)[O-]	ZINC000180166518	442551864	/nfs/dbraw/zinc/55/18/64/442551864.db2.gz	COEJPZUQRDGXIL-UHFFFAOYSA-N	-1	3	327.293	1.938	20	5		EDBDHM
O=[N+]([O-])c1cccc(CS(=O)(=O)[N-]Cc2ncccc2F)c1	ZINC000156711151	442512652	/nfs/dbraw/zinc/51/26/52/442512652.db2.gz	URPDONJFAUIAEL-UHFFFAOYSA-N	-1	3	325.321	1.749	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]CC1(CCO)CC1	ZINC000157295277	442569610	/nfs/dbraw/zinc/56/96/10/442569610.db2.gz	NJPUCRWDQGYQQN-UHFFFAOYSA-N	-1	3	334.781	1.689	20	5		EDBDHM
Cn1cnnc1-c1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000186905605	442627922	/nfs/dbraw/zinc/62/79/22/442627922.db2.gz	DYJAZPFDKNVCRY-UHFFFAOYSA-N	-1	3	340.299	1.743	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2CC[C@H](O)C2)c(Cl)c1	ZINC000188350239	442741886	/nfs/dbraw/zinc/74/18/86/442741886.db2.gz	LRSCXDVDGJDKSA-SCZZXKLOSA-N	-1	3	334.781	1.688	20	5		EDBDHM
O=C(c1ccc2n[n-]nc2c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000188583402	442765952	/nfs/dbraw/zinc/76/59/52/442765952.db2.gz	WOWSIWGAQVARHF-UHFFFAOYSA-N	-1	3	339.311	1.770	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCCO[C@H]2CCOC2)c(F)c1	ZINC000268254472	442919771	/nfs/dbraw/zinc/91/97/71/442919771.db2.gz	PJNRWEBSEDFSQH-NSHDSACASA-N	-1	3	348.352	1.208	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-][C@@H]1c2ccccc2C[C@H]1O	ZINC000194654370	442932068	/nfs/dbraw/zinc/93/20/68/442932068.db2.gz	UPOCQLDSHGIOKW-HZPDHXFCSA-N	-1	3	348.380	1.673	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-][C@H]1Cc2ccccc2[C@@H]1O	ZINC000184548849	443038551	/nfs/dbraw/zinc/03/85/51/443038551.db2.gz	YQJHNAJQVAMMMG-HOCLYGCPSA-N	-1	3	348.380	1.673	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-]	ZINC000184852772	443086547	/nfs/dbraw/zinc/08/65/47/443086547.db2.gz	ZHEXMCZTYVFHTD-YPMHNXCESA-N	-1	3	332.353	1.624	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCCC[C@H]2CO)c([N+](=O)[O-])c1	ZINC000269308617	443276657	/nfs/dbraw/zinc/27/66/57/443276657.db2.gz	VCVGIOKARBDPNV-CMPLNLGQSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])CCC1	ZINC000269467031	443315291	/nfs/dbraw/zinc/31/52/91/443315291.db2.gz	IGNDLAKZYSQWJE-UHFFFAOYSA-N	-1	3	342.373	1.586	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](CCO)C(C)(C)C	ZINC000269743701	443420519	/nfs/dbraw/zinc/42/05/19/443420519.db2.gz	VRCFVGBXOGCNSB-ZDUSSCGKSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CCCOC(=O)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000267542106	443491158	/nfs/dbraw/zinc/49/11/58/443491158.db2.gz	PQHGJBZOSXHPPH-UHFFFAOYSA-N	-1	3	334.325	1.356	20	5		EDBDHM
CCOC(=O)[C@@H](C)[C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000273161091	443553725	/nfs/dbraw/zinc/55/37/25/443553725.db2.gz	ZYALSRWEJUTLMI-DTWKUNHWSA-N	-1	3	348.352	1.600	20	5		EDBDHM
Cc1nc(N2CCC[C@H]2C[C@]2(C)NC(=O)[N-]C2=O)ccc1[N+](=O)[O-]	ZINC000286196100	443665406	/nfs/dbraw/zinc/66/54/06/443665406.db2.gz	ATPPBSWIRRSAMO-BONVTDFDSA-N	-1	3	333.348	1.255	20	5		EDBDHM
CC1(C)CCC[C@@]1(O)C[N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000292817687	443850787	/nfs/dbraw/zinc/85/07/87/443850787.db2.gz	NSRYFFBOIAXKFK-OAHLLOKOSA-N	-1	3	342.417	1.955	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)c1nnc(C)[nH]1	ZINC000285436032	443983703	/nfs/dbraw/zinc/98/37/03/443983703.db2.gz	RLCGDOUYEPHPDG-SSDOTTSWSA-N	-1	3	341.349	1.069	20	5		EDBDHM
CN1CCC[C@H]1C[N-]S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000299216417	443986190	/nfs/dbraw/zinc/98/61/90/443986190.db2.gz	HPYVFNKGMNEQBW-VIFPVBQESA-N	-1	3	333.797	1.621	20	5		EDBDHM
CCC[C@@H](C)[C@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000565083887	321168492	/nfs/dbraw/zinc/16/84/92/321168492.db2.gz	PVNKPPBWPJCWGY-SKDRFNHKSA-N	-1	3	334.369	1.809	20	5		EDBDHM
COc1cc(CNCc2ccc(C)n(C)c2=O)c([N+](=O)[O-])cc1[O-]	ZINC000278309462	444136142	/nfs/dbraw/zinc/13/61/42/444136142.db2.gz	ASOGFJLSOPIHJD-UHFFFAOYSA-N	-1	3	333.344	1.606	20	5		EDBDHM
NC(=O)c1cc([N+](=O)[O-])cnc1[N-]c1cnn(C[C@@H]2CCCO2)c1	ZINC000301104528	444145074	/nfs/dbraw/zinc/14/50/74/444145074.db2.gz	RYEZRONWRXBFGS-NSHDSACASA-N	-1	3	332.320	1.208	20	5		EDBDHM
CC[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC)OC	ZINC000289548703	444169490	/nfs/dbraw/zinc/16/94/90/444169490.db2.gz	OCQGLDADVNHKFI-SNVBAGLBSA-N	-1	3	346.361	1.085	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCCn2cncn2)c1[N+](=O)[O-]	ZINC000616408804	450412541	/nfs/dbraw/zinc/41/25/41/450412541.db2.gz	LAJRHUHOEUKTNJ-UHFFFAOYSA-N	-1	3	339.377	1.172	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-][C@H]2CCC[C@]2(C)CO)cc1[N+](=O)[O-]	ZINC000331041179	444370713	/nfs/dbraw/zinc/37/07/13/444370713.db2.gz	CQFOCYCZQQENMR-UONOGXRCSA-N	-1	3	346.380	1.872	20	5		EDBDHM
COC(=O)CCCC[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000337939007	444465453	/nfs/dbraw/zinc/46/54/53/444465453.db2.gz	YQUUNJGXTMHEJA-UHFFFAOYSA-N	-1	3	330.362	1.525	20	5		EDBDHM
CO[C@@H]1CC[C@@H]([N-]S(=O)(=O)c2cc(F)c(C)c([N+](=O)[O-])c2)C1	ZINC000330964180	445202838	/nfs/dbraw/zinc/20/28/38/445202838.db2.gz	AHTJMKXBFAQVRX-NXEZZACHSA-N	-1	3	332.353	1.888	20	5		EDBDHM
CN(C)C(=O)c1ccnc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000352057180	445463754	/nfs/dbraw/zinc/46/37/54/445463754.db2.gz	IQANQNJCEXAFNG-UHFFFAOYSA-N	-1	3	331.288	1.045	20	5		EDBDHM
COC(=O)COc1ccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)cc1	ZINC000360169885	445609285	/nfs/dbraw/zinc/60/92/85/445609285.db2.gz	GSBHIFPJUAJJOU-UHFFFAOYSA-N	-1	3	347.283	1.500	20	5		EDBDHM
CN(C)C(=O)c1cc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)ccn1	ZINC000361984795	446128660	/nfs/dbraw/zinc/12/86/60/446128660.db2.gz	VETXGRKGAGRXES-UHFFFAOYSA-N	-1	3	331.288	1.045	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H](CO)c1ccsc1	ZINC000351577905	446174303	/nfs/dbraw/zinc/17/43/03/446174303.db2.gz	VYIKTSLURZHWCF-SNVBAGLBSA-N	-1	3	328.371	1.668	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCc1ccco1	ZINC000359383780	446187947	/nfs/dbraw/zinc/18/79/47/446187947.db2.gz	ZDXPJGBESBYMHN-UHFFFAOYSA-N	-1	3	326.330	1.717	20	5		EDBDHM
O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1cc(F)cc2[n-]nnc21	ZINC000431819296	446436062	/nfs/dbraw/zinc/43/60/62/446436062.db2.gz	ZBDOSNUUWYKQED-UHFFFAOYSA-N	-1	3	341.262	2.134	20	5		EDBDHM
O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1cc(F)cc2nn[n-]c21	ZINC000431819296	446436069	/nfs/dbraw/zinc/43/60/69/446436069.db2.gz	ZBDOSNUUWYKQED-UHFFFAOYSA-N	-1	3	341.262	2.134	20	5		EDBDHM
O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1cc(F)cc2n[n-]nc21	ZINC000431819296	446436074	/nfs/dbraw/zinc/43/60/74/446436074.db2.gz	ZBDOSNUUWYKQED-UHFFFAOYSA-N	-1	3	341.262	2.134	20	5		EDBDHM
CC[C@H](C[C@@H](C)CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000443313902	447031354	/nfs/dbraw/zinc/03/13/54/447031354.db2.gz	ADHLMYYIPNXFAB-NXEZZACHSA-N	-1	3	334.369	1.809	20	5		EDBDHM
O=C([N-]c1nc2n(n1)CCCC2)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000457158771	447536132	/nfs/dbraw/zinc/53/61/32/447536132.db2.gz	SWIKIRNIOFFUAT-UHFFFAOYSA-N	-1	3	327.304	1.651	20	5		EDBDHM
O=c1[n-]c(Cn2nccc2[N+](=O)[O-])nc2c1cnn2-c1ccccc1	ZINC000428275335	447686295	/nfs/dbraw/zinc/68/62/95/447686295.db2.gz	HALIPNRHNACXCP-UHFFFAOYSA-N	-1	3	337.299	1.674	20	5		EDBDHM
COC1([C@H](C(=O)[O-])N2CCN(c3ccccc3[N+](=O)[O-])CC2)CCC1	ZINC000514945357	448231658	/nfs/dbraw/zinc/23/16/58/448231658.db2.gz	WLBDFFLTZUDUTE-HNNXBMFYSA-N	-1	3	349.387	1.739	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@H](C)N2CCCC2)cc1[N+](=O)[O-]	ZINC000548370276	449033191	/nfs/dbraw/zinc/03/31/91/449033191.db2.gz	BRHMPFLNOPLGPE-VIFPVBQESA-N	-1	3	333.435	1.727	20	5		EDBDHM
CC(C)C[C@H]1OCCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593578855	449085937	/nfs/dbraw/zinc/08/59/37/449085937.db2.gz	NSMOREZPNVZATD-CHWSQXEVSA-N	-1	3	343.405	1.862	20	5		EDBDHM
Cn1c([N-]C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)nnc1C1CC1	ZINC000597897199	449137219	/nfs/dbraw/zinc/13/72/19/449137219.db2.gz	KZEMDKNHZAKDOV-UHFFFAOYSA-N	-1	3	345.315	1.624	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCC1(CO)CCC1	ZINC000593664786	449137518	/nfs/dbraw/zinc/13/75/18/449137518.db2.gz	TXJCGACNOZRDRS-UHFFFAOYSA-N	-1	3	344.389	1.434	20	5		EDBDHM
CC[C@@H](C)CCNC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000597979510	449171655	/nfs/dbraw/zinc/17/16/55/449171655.db2.gz	WYAMSFJVPLKNCT-LLVKDONJSA-N	-1	3	343.405	1.426	20	5		EDBDHM
COC(=O)[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000590761248	449280597	/nfs/dbraw/zinc/28/05/97/449280597.db2.gz	SVPKUEJDGWGLOQ-BDAKNGLRSA-N	-1	3	348.402	1.585	20	5		EDBDHM
CCS[C@H]1CCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593557159	449347737	/nfs/dbraw/zinc/34/77/37/449347737.db2.gz	QEIZBOVNNDCRTL-QWRGUYRKSA-N	-1	3	331.419	1.942	20	5		EDBDHM
O=C(Cc1ccccc1)N1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596077388	449350473	/nfs/dbraw/zinc/35/04/73/449350473.db2.gz	VNOGHPFEYIWKCQ-UHFFFAOYSA-N	-1	3	342.355	1.587	20	5		EDBDHM
O=c1[n-]ccc(N2CCCN(Cc3cscn3)CC2)c1[N+](=O)[O-]	ZINC000596108124	449365380	/nfs/dbraw/zinc/36/53/80/449365380.db2.gz	LJIRVAWCZJNZMY-UHFFFAOYSA-N	-1	3	335.389	1.864	20	5		EDBDHM
CCn1ncnc1C[N-]S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1C	ZINC000598610565	449491626	/nfs/dbraw/zinc/49/16/26/449491626.db2.gz	OLUTZTUEFDCBKI-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCCN3CCCC[C@H]23)nc1	ZINC000594484589	449547738	/nfs/dbraw/zinc/54/77/38/449547738.db2.gz	VHYLLRPHRPWSNT-CHWSQXEVSA-N	-1	3	340.405	1.285	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H](C2CC2)[C@H]2CCCCO2)nc1	ZINC000594485352	449549709	/nfs/dbraw/zinc/54/97/09/449549709.db2.gz	QFJZXYVKYAPKFW-TZMCWYRMSA-N	-1	3	341.389	1.616	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)[C@@H]1CCCCO1	ZINC000594486119	449550985	/nfs/dbraw/zinc/55/09/85/449550985.db2.gz	DHIOMYKJMVCKLO-NEPJUHHUSA-N	-1	3	329.378	1.616	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H](CO)CC2CC2)cc1[N+](=O)[O-]	ZINC000614550892	449681931	/nfs/dbraw/zinc/68/19/31/449681931.db2.gz	GVRGULVTIIEXJF-SECBINFHSA-N	-1	3	348.352	1.182	20	5		EDBDHM
C[C@@H](O)C[C@H](C)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594771634	449684367	/nfs/dbraw/zinc/68/43/67/449684367.db2.gz	JAYNIQGRHSBTFQ-VHSXEESVSA-N	-1	3	339.373	1.581	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1C[C@H](C)n2ncnc21	ZINC000594806400	449718885	/nfs/dbraw/zinc/71/88/85/449718885.db2.gz	KCWLTWYSVCPDAX-UWVGGRQHSA-N	-1	3	337.361	1.479	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@H]1C[C@@H](O)C12CCC2	ZINC000594865926	449780862	/nfs/dbraw/zinc/78/08/62/449780862.db2.gz	TTYBJPYBMQGWDF-NWDGAFQWSA-N	-1	3	346.792	1.830	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCO[C@@H]1CC1(F)F	ZINC000594838291	449747015	/nfs/dbraw/zinc/74/70/15/449747015.db2.gz	BYCAYBDXOZZSNC-SNVBAGLBSA-N	-1	3	336.316	1.606	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[n-]1	ZINC000617873901	449891451	/nfs/dbraw/zinc/89/14/51/449891451.db2.gz	REXHJTBJTGFUEJ-UHFFFAOYSA-N	-1	3	344.287	1.623	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c[n-]1	ZINC000617873901	449891454	/nfs/dbraw/zinc/89/14/54/449891454.db2.gz	REXHJTBJTGFUEJ-UHFFFAOYSA-N	-1	3	344.287	1.623	20	5		EDBDHM
CCCN1CC[C@@H]([N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000595354960	450070642	/nfs/dbraw/zinc/07/06/42/450070642.db2.gz	PTHQIJPOZDXNRB-LLVKDONJSA-N	-1	3	343.405	1.366	20	5		EDBDHM
COc1cc(C(=O)[N-]c2nn3cnnc3s2)cc([N+](=O)[O-])c1C	ZINC000616751268	450474791	/nfs/dbraw/zinc/47/47/91/450474791.db2.gz	FYYUHVQLANUVNN-UHFFFAOYSA-N	-1	3	334.317	1.663	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)CCOc2ccccc2[N+](=O)[O-])[n-]1	ZINC000619449456	450477331	/nfs/dbraw/zinc/47/73/31/450477331.db2.gz	HUFKCWDEMGJMID-UHFFFAOYSA-N	-1	3	348.315	1.902	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)CCOc2ccccc2[N+](=O)[O-])c[n-]1	ZINC000619449456	450477334	/nfs/dbraw/zinc/47/73/34/450477334.db2.gz	HUFKCWDEMGJMID-UHFFFAOYSA-N	-1	3	348.315	1.902	20	5		EDBDHM
Cc1nc(C)c(CC(=O)OCCOc2ccc([N+](=O)[O-])cc2)c(=O)[n-]1	ZINC000742881395	579464536	/nfs/dbraw/zinc/46/45/36/579464536.db2.gz	NDEBWXJCBXFZAR-UHFFFAOYSA-N	-1	3	347.327	1.872	20	5		EDBDHM
CC(C)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C1=O	ZINC000735880740	578932036	/nfs/dbraw/zinc/93/20/36/578932036.db2.gz	BPQQNZCHDDAAFN-GFCCVEGCSA-N	-1	3	331.336	1.196	20	5		EDBDHM
CC(C)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C1=O	ZINC000735880740	578932037	/nfs/dbraw/zinc/93/20/37/578932037.db2.gz	BPQQNZCHDDAAFN-GFCCVEGCSA-N	-1	3	331.336	1.196	20	5		EDBDHM
COCCOC1CCN(c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000737004930	579039708	/nfs/dbraw/zinc/03/97/08/579039708.db2.gz	CJTVHHPRPSFICD-UHFFFAOYSA-N	-1	3	348.363	1.407	20	5		EDBDHM
COCCOC1CCN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000737004930	579039709	/nfs/dbraw/zinc/03/97/09/579039709.db2.gz	CJTVHHPRPSFICD-UHFFFAOYSA-N	-1	3	348.363	1.407	20	5		EDBDHM
O=C(NCc1ccc(-c2nnn[n-]2)cc1F)c1csc([N+](=O)[O-])c1	ZINC000738100936	579159953	/nfs/dbraw/zinc/15/99/53/579159953.db2.gz	BKXSUMGHSKPZLU-UHFFFAOYSA-N	-1	3	348.319	1.906	20	5		EDBDHM
O=C(NCc1ccc(-c2nn[n-]n2)cc1F)c1csc([N+](=O)[O-])c1	ZINC000738100936	579159954	/nfs/dbraw/zinc/15/99/54/579159954.db2.gz	BKXSUMGHSKPZLU-UHFFFAOYSA-N	-1	3	348.319	1.906	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@H](NC(=O)[O-])C1	ZINC000740151640	579294279	/nfs/dbraw/zinc/29/42/79/579294279.db2.gz	DANMKKWLZIXVQN-LLVKDONJSA-N	-1	3	336.348	1.574	20	5		EDBDHM
Cn1ncc2c1nc(CN1CCc3c(cccc3[N+](=O)[O-])C1)[n-]c2=O	ZINC000757167681	579965334	/nfs/dbraw/zinc/96/53/34/579965334.db2.gz	IZZGYCXCNAHLJQ-UHFFFAOYSA-N	-1	3	340.343	1.535	20	5		EDBDHM
O=[N+]([O-])c1ccc(Cl)c(C[N-]S(=O)(=O)Cc2ccon2)c1	ZINC000757352913	579967159	/nfs/dbraw/zinc/96/71/59/579967159.db2.gz	VQPODEPOSCMYSC-UHFFFAOYSA-N	-1	3	331.737	1.856	20	5		EDBDHM
O=C([N-]CCn1cc([N+](=O)[O-])cn1)C(F)(F)c1ccc(F)cc1	ZINC000769382352	580235273	/nfs/dbraw/zinc/23/52/73/580235273.db2.gz	MFKFXFWIQXLMPI-UHFFFAOYSA-N	-1	3	328.250	1.839	20	5		EDBDHM
COc1nc(NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])n[n-]1	ZINC000791139105	580784937	/nfs/dbraw/zinc/78/49/37/580784937.db2.gz	ONNIWDDIIKIAQF-UHFFFAOYSA-N	-1	3	329.675	1.695	20	5		EDBDHM
COc1nnc(NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])[n-]1	ZINC000791139105	580784938	/nfs/dbraw/zinc/78/49/38/580784938.db2.gz	ONNIWDDIIKIAQF-UHFFFAOYSA-N	-1	3	329.675	1.695	20	5		EDBDHM
COc1n[n-]c(NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])n1	ZINC000791139105	580784939	/nfs/dbraw/zinc/78/49/39/580784939.db2.gz	ONNIWDDIIKIAQF-UHFFFAOYSA-N	-1	3	329.675	1.695	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])OC/C=C\Cl	ZINC000796275033	580949760	/nfs/dbraw/zinc/94/97/60/580949760.db2.gz	FBMUXEQQLQVJRH-UTCJRWHESA-N	-1	3	334.737	1.169	20	5		EDBDHM
COc1c([O-])ccc(CN(C)[C@H](C)CN2CCOCC2)c1[N+](=O)[O-]	ZINC000894110874	591197426	/nfs/dbraw/zinc/19/74/26/591197426.db2.gz	SPYYROFZJBGELT-GFCCVEGCSA-N	-1	3	339.392	1.462	20	5		EDBDHM
O=C(COC(=O)c1cnn[n-]1)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000805605478	593111629	/nfs/dbraw/zinc/11/16/29/593111629.db2.gz	IUXJKDLIURGYDV-UHFFFAOYSA-N	-1	3	325.668	1.162	20	5		EDBDHM
O=C(COC(=O)c1c[n-]nn1)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000805605478	593111631	/nfs/dbraw/zinc/11/16/31/593111631.db2.gz	IUXJKDLIURGYDV-UHFFFAOYSA-N	-1	3	325.668	1.162	20	5		EDBDHM
O=C([N-][C@@H](CO)[C@@H]1CCCOC1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000839857431	593202044	/nfs/dbraw/zinc/20/20/44/593202044.db2.gz	PVMLNPJPKZKMRQ-MFKMUULPSA-N	-1	3	344.314	1.590	20	5		EDBDHM
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)[N-]C1=NC[C@@H](C)S1	ZINC000819774943	593768441	/nfs/dbraw/zinc/76/84/41/593768441.db2.gz	WBOZPRJMMAPJCL-VXNVDRBHSA-N	-1	3	340.409	1.435	20	5		EDBDHM
C[C@@H]1CN=C([N-]C(=O)c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])S1	ZINC000819783192	593769002	/nfs/dbraw/zinc/76/90/02/593769002.db2.gz	YWJNNAXIXSGYNK-SSDOTTSWSA-N	-1	3	343.386	1.219	20	5		EDBDHM
C[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)c1cccc(-c2nnn[n-]2)c1	ZINC000820397925	593816157	/nfs/dbraw/zinc/81/61/57/593816157.db2.gz	XCSHAXJKTUHETC-QMMMGPOBSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)c1cccc(-c2nn[n-]n2)c1	ZINC000820397925	593816158	/nfs/dbraw/zinc/81/61/58/593816158.db2.gz	XCSHAXJKTUHETC-QMMMGPOBSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@@]1(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CCCC[C@H]1O	ZINC000820623255	593847612	/nfs/dbraw/zinc/84/76/12/593847612.db2.gz	JRGOMYSNUAHRSG-RISCZKNCSA-N	-1	3	333.352	1.523	20	5		EDBDHM
C[C@@]1(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CCCC[C@H]1O	ZINC000820623255	593847613	/nfs/dbraw/zinc/84/76/13/593847613.db2.gz	JRGOMYSNUAHRSG-RISCZKNCSA-N	-1	3	333.352	1.523	20	5		EDBDHM
CN(C)c1nc(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cs1	ZINC000821591192	593872991	/nfs/dbraw/zinc/87/29/91/593872991.db2.gz	ZYRQUFXHBDFGHT-UHFFFAOYSA-N	-1	3	347.364	1.305	20	5		EDBDHM
CN(C)c1nc(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)cs1	ZINC000821591192	593872993	/nfs/dbraw/zinc/87/29/93/593872993.db2.gz	ZYRQUFXHBDFGHT-UHFFFAOYSA-N	-1	3	347.364	1.305	20	5		EDBDHM
COC(=O)[C@@H](Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C(C)(C)C	ZINC000821644474	593893203	/nfs/dbraw/zinc/89/32/03/593893203.db2.gz	ALRYWJIJSQRJOB-LLVKDONJSA-N	-1	3	334.336	1.775	20	5		EDBDHM
COC(=O)[C@@H](Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])C(C)(C)C	ZINC000821644474	593893204	/nfs/dbraw/zinc/89/32/04/593893204.db2.gz	ALRYWJIJSQRJOB-LLVKDONJSA-N	-1	3	334.336	1.775	20	5		EDBDHM
CCN(CCO)c1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000821215977	593991309	/nfs/dbraw/zinc/99/13/09/593991309.db2.gz	YIHYMTPEOLQUJZ-UHFFFAOYSA-N	-1	3	329.320	1.142	20	5		EDBDHM
CCN(CCO)c1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000821215977	593991311	/nfs/dbraw/zinc/99/13/11/593991311.db2.gz	YIHYMTPEOLQUJZ-UHFFFAOYSA-N	-1	3	329.320	1.142	20	5		EDBDHM
Cc1ccc(OCCNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cc1	ZINC000822262545	594020215	/nfs/dbraw/zinc/02/02/15/594020215.db2.gz	BFKVQQYSDUDOFJ-UHFFFAOYSA-N	-1	3	341.331	1.969	20	5		EDBDHM
Cc1ccc(OCCNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)cc1	ZINC000822262545	594020217	/nfs/dbraw/zinc/02/02/17/594020217.db2.gz	BFKVQQYSDUDOFJ-UHFFFAOYSA-N	-1	3	341.331	1.969	20	5		EDBDHM
C[C@H](NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000824514589	594028377	/nfs/dbraw/zinc/02/83/77/594028377.db2.gz	OYYVBEIMIVPSEZ-QMMMGPOBSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@H](NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000824514589	594028379	/nfs/dbraw/zinc/02/83/79/594028379.db2.gz	OYYVBEIMIVPSEZ-QMMMGPOBSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@@H](O)C[C@@H](C)Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000824699468	594058498	/nfs/dbraw/zinc/05/84/98/594058498.db2.gz	SWPRCPCYRFIOMD-RKDXNWHRSA-N	-1	3	343.347	1.894	20	5		EDBDHM
C[C@@H](O)C[C@@H](C)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000824699468	594058499	/nfs/dbraw/zinc/05/84/99/594058499.db2.gz	SWPRCPCYRFIOMD-RKDXNWHRSA-N	-1	3	343.347	1.894	20	5		EDBDHM
O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(-c2nnn[n-]2)cc1Cl	ZINC000823118861	594155970	/nfs/dbraw/zinc/15/59/70/594155970.db2.gz	SZTLSPAYRPCDOR-UHFFFAOYSA-N	-1	3	348.710	1.264	20	5		EDBDHM
O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(-c2nn[n-]n2)cc1Cl	ZINC000823118861	594155972	/nfs/dbraw/zinc/15/59/72/594155972.db2.gz	SZTLSPAYRPCDOR-UHFFFAOYSA-N	-1	3	348.710	1.264	20	5		EDBDHM
CCCN(CC(=O)OCC)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825307494	594164138	/nfs/dbraw/zinc/16/41/38/594164138.db2.gz	BNNKAKLHMDCWKB-UHFFFAOYSA-N	-1	3	334.336	1.554	20	5		EDBDHM
CCCN(CC(=O)OCC)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825307494	594164139	/nfs/dbraw/zinc/16/41/39/594164139.db2.gz	BNNKAKLHMDCWKB-UHFFFAOYSA-N	-1	3	334.336	1.554	20	5		EDBDHM
CCOCCOC1CN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000825599482	594205082	/nfs/dbraw/zinc/20/50/82/594205082.db2.gz	MYSGYZLGTDGQCF-UHFFFAOYSA-N	-1	3	334.336	1.017	20	5		EDBDHM
CCOCCOC1CN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1	ZINC000825599482	594205083	/nfs/dbraw/zinc/20/50/83/594205083.db2.gz	MYSGYZLGTDGQCF-UHFFFAOYSA-N	-1	3	334.336	1.017	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC(C(F)F)CC2)c(-c2nnn[n-]2)c1	ZINC000823647896	594224561	/nfs/dbraw/zinc/22/45/61/594224561.db2.gz	POPLLFQNNJXEKD-UHFFFAOYSA-N	-1	3	325.279	1.651	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC(C(F)F)CC2)c(-c2nn[n-]n2)c1	ZINC000823647896	594224562	/nfs/dbraw/zinc/22/45/62/594224562.db2.gz	POPLLFQNNJXEKD-UHFFFAOYSA-N	-1	3	325.279	1.651	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCc2ccccc2F)c(-c2nnn[n-]2)c1	ZINC000823651179	594224722	/nfs/dbraw/zinc/22/47/22/594224722.db2.gz	HYQFHLCOQJPROL-UHFFFAOYSA-N	-1	3	329.295	1.964	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCc2ccccc2F)c(-c2nn[n-]n2)c1	ZINC000823651179	594224723	/nfs/dbraw/zinc/22/47/23/594224723.db2.gz	HYQFHLCOQJPROL-UHFFFAOYSA-N	-1	3	329.295	1.964	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCc3ccc(O)cc3C2)c(-c2nnn[n-]2)c1	ZINC000823652209	594224798	/nfs/dbraw/zinc/22/47/98/594224798.db2.gz	WRBHQFZMPYGDFI-UHFFFAOYSA-N	-1	3	339.315	1.438	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCc3ccc(O)cc3C2)c(-c2nn[n-]n2)c1	ZINC000823652209	594224799	/nfs/dbraw/zinc/22/47/99/594224799.db2.gz	WRBHQFZMPYGDFI-UHFFFAOYSA-N	-1	3	339.315	1.438	20	5		EDBDHM
CCN1CCC[C@H]1CN(C)C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000829764912	594258900	/nfs/dbraw/zinc/25/89/00/594258900.db2.gz	BMQOQHRIUACUQI-ZDUSSCGKSA-N	-1	3	335.360	1.849	20	5		EDBDHM
C[C@@H]1CN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1C(=O)[O-]	ZINC000828431255	594417752	/nfs/dbraw/zinc/41/77/52/594417752.db2.gz	HFXIACBRECHDBS-SWHYSGLUSA-N	-1	3	333.344	1.353	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)OCc2ccc(-c3nnn[n-]3)cc2F)n1	ZINC000826362770	594445040	/nfs/dbraw/zinc/44/50/40/594445040.db2.gz	IBDCTCWBVPCABP-UHFFFAOYSA-N	-1	3	347.266	1.005	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)OCc2ccc(-c3nn[n-]n3)cc2F)n1	ZINC000826362770	594445042	/nfs/dbraw/zinc/44/50/42/594445042.db2.gz	IBDCTCWBVPCABP-UHFFFAOYSA-N	-1	3	347.266	1.005	20	5		EDBDHM
CC[C@](C)(CC(=O)[O-])NCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000828658552	594474211	/nfs/dbraw/zinc/47/42/11/594474211.db2.gz	WJCCWNCOBMETRN-OAHLLOKOSA-N	-1	3	339.348	1.775	20	5		EDBDHM
O=C([O-])N1CCC[C@H]1[C@@H]1CCCN(CCn2ccc([N+](=O)[O-])n2)C1	ZINC000832004297	594718628	/nfs/dbraw/zinc/71/86/28/594718628.db2.gz	DVFCQNCVDPEZEC-OLZOCXBDSA-N	-1	3	337.380	1.646	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)co1	ZINC000832473202	594752817	/nfs/dbraw/zinc/75/28/17/594752817.db2.gz	JYYVALROKVHDTG-UHFFFAOYSA-N	-1	3	325.346	1.765	20	5		EDBDHM
CCNC(=O)C(C)(C)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000837266814	595071551	/nfs/dbraw/zinc/07/15/51/595071551.db2.gz	IYRWWDREQDKDAY-UHFFFAOYSA-N	-1	3	329.303	1.718	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)CC1(C)OCCO1	ZINC000845884539	595088488	/nfs/dbraw/zinc/08/84/88/595088488.db2.gz	ZIHVKFBUSFUCFU-JTQLQIEISA-N	-1	3	345.377	1.057	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCc3ccccc3OC2)nc1	ZINC000845928598	595098182	/nfs/dbraw/zinc/09/81/82/595098182.db2.gz	XFZBNAYJQDVLMB-LBPRGKRZSA-N	-1	3	349.368	1.662	20	5		EDBDHM
O=C([N-][C@H](CCO)C1CC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848584238	595409332	/nfs/dbraw/zinc/40/93/32/595409332.db2.gz	RPIYCFSLIULTFY-GFCCVEGCSA-N	-1	3	330.287	1.844	20	5		EDBDHM
Cn1nncc1C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848588874	595411016	/nfs/dbraw/zinc/41/10/16/595411016.db2.gz	BHLGOPPCEYSBGK-UHFFFAOYSA-N	-1	3	327.247	1.011	20	5		EDBDHM
CO[C@@](C)(CO)C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848596138	595414087	/nfs/dbraw/zinc/41/40/87/595414087.db2.gz	OSONIVKEYQOQAU-GFCCVEGCSA-N	-1	3	334.275	1.080	20	5		EDBDHM
COC(=O)[C@]1(C(F)(F)F)CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1	ZINC000853617442	595833433	/nfs/dbraw/zinc/83/34/33/595833433.db2.gz	ZIBLLKVYPRVYGM-NSHDSACASA-N	-1	3	335.238	1.627	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@@H](O)c2ccco2)cc1[N+](=O)[O-]	ZINC000124253845	597072393	/nfs/dbraw/zinc/07/23/93/597072393.db2.gz	FFWWICJKUYBWNF-SECBINFHSA-N	-1	3	332.359	1.570	20	5		EDBDHM
CCC(CC)([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)OC	ZINC000337964820	282143696	/nfs/dbraw/zinc/14/36/96/282143696.db2.gz	WVZHIXYOTKYPMK-UHFFFAOYSA-N	-1	3	344.389	1.913	20	5		EDBDHM
CC[C@@H](C)[C@H]([N-]S(C)(=O)=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000074040784	138223164	/nfs/dbraw/zinc/22/31/64/138223164.db2.gz	OKXOSVDHYDOHTK-SKDRFNHKSA-N	-1	3	329.378	1.497	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@](C)(O)C(C)C)c1C	ZINC000178741042	138745407	/nfs/dbraw/zinc/74/54/07/138745407.db2.gz	BBOIOXRDMKTGGI-AWEZNQCLSA-N	-1	3	330.406	1.897	20	5		EDBDHM
O=C(NCCc1ccccc1[N+](=O)[O-])c1cc(=O)[n-]c(C2CC2)n1	ZINC000569589560	306512216	/nfs/dbraw/zinc/51/22/16/306512216.db2.gz	NFNBWEBXSCGUGS-UHFFFAOYSA-N	-1	3	328.328	1.940	20	5		EDBDHM
O=[N+]([O-])c1cnn(CC[N-]S(=O)(=O)c2cc(F)ccc2Cl)c1	ZINC000152840983	224019320	/nfs/dbraw/zinc/01/93/20/224019320.db2.gz	VDTFNMBJMVBDRE-UHFFFAOYSA-N	-1	3	348.743	1.562	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CCC(C)(C)O1	ZINC000494276400	255244006	/nfs/dbraw/zinc/24/40/06/255244006.db2.gz	IIFQYOFMFVBUHB-LLVKDONJSA-N	-1	3	344.389	1.839	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCOC(C)(C)C2)c([N+](=O)[O-])c1	ZINC000269947525	140023015	/nfs/dbraw/zinc/02/30/15/140023015.db2.gz	QORRZTJDZDUSDR-SNVBAGLBSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1ncc(S(=O)(=O)[N-]CCNc2ccccc2[N+](=O)[O-])s1	ZINC000270017918	140034344	/nfs/dbraw/zinc/03/43/44/140034344.db2.gz	VXWSMRZSMQFFTG-UHFFFAOYSA-N	-1	3	342.402	1.750	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C2CCS(=O)CC2)cc1C	ZINC000330841370	140935106	/nfs/dbraw/zinc/93/51/06/140935106.db2.gz	JVCZSGQCLRVCIF-UHFFFAOYSA-N	-1	3	346.430	1.401	20	5		EDBDHM
CCCc1[nH]nc(C(=O)[N-]c2nc(CC(N)=O)cs2)c1[N+](=O)[O-]	ZINC000345397318	143086199	/nfs/dbraw/zinc/08/61/99/143086199.db2.gz	VTGLGTHDDPABJW-UHFFFAOYSA-N	-1	3	338.349	1.007	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]c2c[nH]c(=O)cc2C)c([N+](=O)[O-])c1	ZINC000345550806	143104844	/nfs/dbraw/zinc/10/48/44/143104844.db2.gz	RVZHTHJVEJANLV-UHFFFAOYSA-N	-1	3	339.329	1.813	20	5		EDBDHM
COC(=O)c1cnc(C(=O)[N-]c2cc([N+](=O)[O-])ccc2OC)cn1	ZINC000355303103	150206840	/nfs/dbraw/zinc/20/68/40/150206840.db2.gz	QZXQOLCXSBJGAY-UHFFFAOYSA-N	-1	3	332.272	1.432	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCOC1	ZINC000355716211	150371820	/nfs/dbraw/zinc/37/18/20/150371820.db2.gz	QKGHRZRYSRQRGW-NXEZZACHSA-N	-1	3	332.353	1.827	20	5		EDBDHM
Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1	ZINC000371854397	156139584	/nfs/dbraw/zinc/13/95/84/156139584.db2.gz	WXILJLYOBNQMQY-UHFFFAOYSA-N	-1	3	326.276	1.004	20	5		EDBDHM
Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1	ZINC000371854397	156139585	/nfs/dbraw/zinc/13/95/85/156139585.db2.gz	WXILJLYOBNQMQY-UHFFFAOYSA-N	-1	3	326.276	1.004	20	5		EDBDHM
C[C@@H](O)C[N-]S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1	ZINC000123642751	222309458	/nfs/dbraw/zinc/30/94/58/222309458.db2.gz	AIORDUSSENVYBO-ZCFIWIBFSA-N	-1	3	339.167	1.016	20	5		EDBDHM
CC[C@@H](COC)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC	ZINC000273468711	268045844	/nfs/dbraw/zinc/04/58/44/268045844.db2.gz	FCGOPMAXNAKKQZ-VIFPVBQESA-N	-1	3	346.361	1.085	20	5		EDBDHM
CC1(C[N-]S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)OCCCO1	ZINC000276779228	268475029	/nfs/dbraw/zinc/47/50/29/268475029.db2.gz	DBRDAALWNZHLCO-UHFFFAOYSA-N	-1	3	344.389	1.210	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H](C)SC	ZINC000273587062	273046988	/nfs/dbraw/zinc/04/69/88/273046988.db2.gz	PZCFCUHGSACDNY-QMMMGPOBSA-N	-1	3	348.402	1.411	20	5		EDBDHM
CCO[C@@H]1C[C@@H]([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)[C@H]1OC	ZINC000274880564	273098433	/nfs/dbraw/zinc/09/84/33/273098433.db2.gz	FVZRTNDVUSHTOM-JHJVBQTASA-N	-1	3	344.314	1.995	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCOC(C)(C)C1	ZINC000269898852	277390144	/nfs/dbraw/zinc/39/01/44/277390144.db2.gz	FENLNQNZZXMSSL-JTQLQIEISA-N	-1	3	344.389	1.839	20	5		EDBDHM
CO[C@@H]1CCC[C@@H]1C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000341191062	293667655	/nfs/dbraw/zinc/66/76/55/293667655.db2.gz	NCPZCZKNMGTZIC-DGCLKSJQSA-N	-1	3	328.390	1.997	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCCC(=O)N(C)C)c1[N+](=O)[O-]	ZINC000189885184	301555811	/nfs/dbraw/zinc/55/58/11/301555811.db2.gz	KUKDZEHYHLFFHN-UHFFFAOYSA-N	-1	3	343.405	1.358	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CNCCC2(F)F)cc1C	ZINC000420437875	304757822	/nfs/dbraw/zinc/75/78/22/304757822.db2.gz	DCKYJSAATXDQLW-GFCCVEGCSA-N	-1	3	349.359	1.487	20	5		EDBDHM
CCn1ccnc1C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000295195238	303186946	/nfs/dbraw/zinc/18/69/46/303186946.db2.gz	BAVYUHWPJVPYAY-UHFFFAOYSA-N	-1	3	338.389	1.907	20	5		EDBDHM
C[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)c2nccn21	ZINC000451948456	305373387	/nfs/dbraw/zinc/37/33/87/305373387.db2.gz	UKIPWGRFLBQSMS-KCJUWKMLSA-N	-1	3	340.336	1.915	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)C(=O)OC(C)C)c1C	ZINC000452010057	305378080	/nfs/dbraw/zinc/37/80/80/305378080.db2.gz	JYKXPJLMIGJMSV-NSHDSACASA-N	-1	3	344.389	1.830	20	5		EDBDHM
C[C@@H](C1CC1)N(C)C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000553180255	306183460	/nfs/dbraw/zinc/18/34/60/306183460.db2.gz	RCZPSSUVDDKEOS-JTQLQIEISA-N	-1	3	341.389	1.130	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)no1	ZINC000063186684	441317894	/nfs/dbraw/zinc/31/78/94/441317894.db2.gz	NEVFVPUKGHLMBA-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)C(=O)[N-]C2=O	ZINC000065801060	441486111	/nfs/dbraw/zinc/48/61/11/441486111.db2.gz	PBXOOOKQSYCPJB-UHFFFAOYSA-N	-1	3	340.295	1.800	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@H]2CCC[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000121828884	441789941	/nfs/dbraw/zinc/78/99/41/441789941.db2.gz	GKRYEQNYCRZOPK-RYUDHWBXSA-N	-1	3	328.390	1.733	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1cc(C)on1	ZINC000147067566	441904059	/nfs/dbraw/zinc/90/40/59/441904059.db2.gz	MTHUNVYEDJCHQF-UHFFFAOYSA-N	-1	3	327.318	1.378	20	5		EDBDHM
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)[N-]CCN1CCCCCC1	ZINC000123705651	441896373	/nfs/dbraw/zinc/89/63/73/441896373.db2.gz	JIRSRWJXTVAXFJ-UHFFFAOYSA-N	-1	3	345.396	1.888	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCC[C@H]2CCO)cc1[N+](=O)[O-]	ZINC000494545471	447446144	/nfs/dbraw/zinc/44/61/44/447446144.db2.gz	GVQCIRKZAKUNQN-VHSXEESVSA-N	-1	3	334.419	1.794	20	5		EDBDHM
CCN1CCC[C@H]1C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000193202746	442722182	/nfs/dbraw/zinc/72/21/82/442722182.db2.gz	SYJVYSHCULHHRI-LBPRGKRZSA-N	-1	3	327.406	1.666	20	5		EDBDHM
CN(C)CCN(C[C@H]1CCCO1)C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000181984631	442725238	/nfs/dbraw/zinc/72/52/38/442725238.db2.gz	GURUXAMCNHGCAK-CYBMUJFWSA-N	-1	3	337.376	1.483	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]C[C@@H]2CC[C@@H](O)C2)cc1[N+](=O)[O-]	ZINC000188352340	442742461	/nfs/dbraw/zinc/74/24/61/442742461.db2.gz	RZJXDCCRNOOZAS-NXEZZACHSA-N	-1	3	332.353	1.482	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2(CO)CCC2)cc1C	ZINC000183301261	442919469	/nfs/dbraw/zinc/91/94/69/442919469.db2.gz	JFAFRVFVBHTKRQ-UHFFFAOYSA-N	-1	3	328.390	1.653	20	5		EDBDHM
CC(C)N1CC[C@@H]([N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])C1=O	ZINC000184491393	443028637	/nfs/dbraw/zinc/02/86/37/443028637.db2.gz	UICVKNARAVNWPJ-GFCCVEGCSA-N	-1	3	341.389	1.024	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC2(O)CCCC2)c1[N+](=O)[O-]	ZINC000189986578	443043317	/nfs/dbraw/zinc/04/33/17/443043317.db2.gz	ACPNKRQYJUPMIY-UHFFFAOYSA-N	-1	3	328.390	1.795	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCC1	ZINC000269504537	443329083	/nfs/dbraw/zinc/32/90/83/443329083.db2.gz	RBEHWDZCDAIEJT-UHFFFAOYSA-N	-1	3	332.309	1.108	20	5		EDBDHM
CC(C)(C)n1ncnc1C[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000282478294	443350490	/nfs/dbraw/zinc/35/04/90/443350490.db2.gz	XLJNOTKCPFJBAS-UHFFFAOYSA-N	-1	3	339.377	1.420	20	5		EDBDHM
CCC[C@](C)(O)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000269762326	443429537	/nfs/dbraw/zinc/42/95/37/443429537.db2.gz	KCCNKMIMOQUGCA-ZDUSSCGKSA-N	-1	3	332.378	1.433	20	5		EDBDHM
O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCc2c(=O)[n-]cnc2C1	ZINC000273192066	443558955	/nfs/dbraw/zinc/55/89/55/443558955.db2.gz	GUQWXRYVNVRBOQ-UHFFFAOYSA-N	-1	3	344.283	1.018	20	5		EDBDHM
COC(=O)CC[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl	ZINC000267719160	443553209	/nfs/dbraw/zinc/55/32/09/443553209.db2.gz	WXVJLUNBLVGYFD-UHFFFAOYSA-N	-1	3	336.753	1.398	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](CO)CC1CCC1	ZINC000280345448	443698655	/nfs/dbraw/zinc/69/86/55/443698655.db2.gz	VZZJWFBLHUUZEO-LBPRGKRZSA-N	-1	3	328.390	1.733	20	5		EDBDHM
O=C1[C@@H](Sc2n[n-]c(CO)n2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000527060098	320502278	/nfs/dbraw/zinc/50/22/78/320502278.db2.gz	DSHJDXXAPXLMKQ-JTQLQIEISA-N	-1	3	335.345	1.103	20	5		EDBDHM
CN(C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[n-]c1=O)c1ccsc1	ZINC000298385611	443758261	/nfs/dbraw/zinc/75/82/61/443758261.db2.gz	QRNNAZUHLJCWML-LBPRGKRZSA-N	-1	3	336.373	1.790	20	5		EDBDHM
CC[C@@H](C[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1)OC	ZINC000289503191	444160541	/nfs/dbraw/zinc/16/05/41/444160541.db2.gz	LBGTTXUGTYSXSR-QMMMGPOBSA-N	-1	3	336.341	1.446	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC[C@H](C)CCO)c1[N+](=O)[O-]	ZINC000296266634	444216124	/nfs/dbraw/zinc/21/61/24/444216124.db2.gz	QFKWOIYXGQYKBX-JTQLQIEISA-N	-1	3	330.406	1.899	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2CCCN(C)C2)c1[N+](=O)[O-]	ZINC000616411615	450413212	/nfs/dbraw/zinc/41/32/12/450413212.db2.gz	DMIDPHOBTBZGMF-GFCCVEGCSA-N	-1	3	327.406	1.584	20	5		EDBDHM
CC(C)n1cnc(S(=O)(=O)[N-]CCc2ccccc2[N+](=O)[O-])c1	ZINC000338229189	444575236	/nfs/dbraw/zinc/57/52/36/444575236.db2.gz	DHXUYFOMBOBMFF-UHFFFAOYSA-N	-1	3	338.389	1.893	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CN(C(C)C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000342546996	444739718	/nfs/dbraw/zinc/73/97/18/444739718.db2.gz	GECVNUPNYVFLQP-ONGXEEELSA-N	-1	3	347.462	1.972	20	5		EDBDHM
Nc1nc(=NCCc2ccc(Cl)cc2[N+](=O)[O-])nc2[nH][n-]cc1-2	ZINC000354589796	445305789	/nfs/dbraw/zinc/30/57/89/445305789.db2.gz	UDCZYTHUQHKLEX-UHFFFAOYSA-N	-1	3	333.739	1.525	20	5		EDBDHM
CCn1cnnc1C[N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1C	ZINC000351800436	445326022	/nfs/dbraw/zinc/32/60/22/445326022.db2.gz	ZTWKIVICCZCOTQ-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
COC(=O)c1cc([N-]C(=O)c2cncc(OC)n2)c(C)c([N+](=O)[O-])c1	ZINC000362645277	445476715	/nfs/dbraw/zinc/47/67/15/445476715.db2.gz	YRHQSGNDZRHNOP-UHFFFAOYSA-N	-1	3	346.299	1.741	20	5		EDBDHM
COCC[C@H](COC)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000352506792	445534161	/nfs/dbraw/zinc/53/41/61/445534161.db2.gz	NGCXCIWNYJCSPN-GFCCVEGCSA-N	-1	3	346.405	1.541	20	5		EDBDHM
COc1ccc([N-]C(=O)c2ccc(S(C)(=O)=O)o2)cc1[N+](=O)[O-]	ZINC000359956113	445503555	/nfs/dbraw/zinc/50/35/55/445503555.db2.gz	CEFAQZHWDGSGEY-UHFFFAOYSA-N	-1	3	340.313	1.852	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-][C@H]1[C@@H]3CCC[C@@H]31)OCCO2	ZINC000362971761	445632752	/nfs/dbraw/zinc/63/27/52/445632752.db2.gz	DOBVHATVYLCFSW-QRJZZWFUSA-N	-1	3	340.357	1.443	20	5		EDBDHM
CC(C)(C)c1ccc(NC(=O)C[C@H]2NC(=O)[N-]C2=O)cc1[N+](=O)[O-]	ZINC000356732519	445975587	/nfs/dbraw/zinc/97/55/87/445975587.db2.gz	KCKQGIKTIBDIJE-SNVBAGLBSA-N	-1	3	334.332	1.429	20	5		EDBDHM
COc1cc(C(=O)[N-]c2ncn(-c3cccnc3)n2)ccc1[N+](=O)[O-]	ZINC000373243147	446116692	/nfs/dbraw/zinc/11/66/92/446116692.db2.gz	IUHVROPALFLDIG-UHFFFAOYSA-N	-1	3	340.299	1.831	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)[N-]c1n[nH]c(-c2ccncc2)n1	ZINC000366592228	446272676	/nfs/dbraw/zinc/27/26/76/446272676.db2.gz	MJEODSFBAWCWBR-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
CC[C@@H](C[C@@H](C)CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000443313909	447030931	/nfs/dbraw/zinc/03/09/31/447030931.db2.gz	ADHLMYYIPNXFAB-ZJUUUORDSA-N	-1	3	334.369	1.809	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)c1nc2c([n-]1)CCC2	ZINC000427082448	447540880	/nfs/dbraw/zinc/54/08/80/447540880.db2.gz	RIRQNNDSFQPJKZ-UHFFFAOYSA-N	-1	3	337.357	1.789	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)c1ccn(C)n1	ZINC000416568291	447650722	/nfs/dbraw/zinc/65/07/22/447650722.db2.gz	YWKJLTUDHBIKKE-SECBINFHSA-N	-1	3	340.361	1.376	20	5		EDBDHM
COc1cnccc1C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000576122748	447980201	/nfs/dbraw/zinc/98/02/01/447980201.db2.gz	MGPUKQIGYQVAJL-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)CCNc2ccccc2[N+](=O)[O-])n[n-]1	ZINC000537546913	448558921	/nfs/dbraw/zinc/55/89/21/448558921.db2.gz	OLKQAWDGTSCPOR-UHFFFAOYSA-N	-1	3	347.331	1.935	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)CCNc2ccccc2[N+](=O)[O-])[n-]n1	ZINC000537546913	448558928	/nfs/dbraw/zinc/55/89/28/448558928.db2.gz	OLKQAWDGTSCPOR-UHFFFAOYSA-N	-1	3	347.331	1.935	20	5		EDBDHM
C[C@@H](C(=O)Nc1nnc(SCCO)[n-]1)c1cccc([N+](=O)[O-])c1	ZINC000578587868	448583722	/nfs/dbraw/zinc/58/37/22/448583722.db2.gz	KSLFDKQRYVCBLK-MRVPVSSYSA-N	-1	3	337.361	1.540	20	5		EDBDHM
C[C@@H](C(=O)Nc1nc(SCCO)n[n-]1)c1cccc([N+](=O)[O-])c1	ZINC000578587868	448583724	/nfs/dbraw/zinc/58/37/24/448583724.db2.gz	KSLFDKQRYVCBLK-MRVPVSSYSA-N	-1	3	337.361	1.540	20	5		EDBDHM
C[C@@H](C(=O)Nc1n[n-]c(SCCO)n1)c1cccc([N+](=O)[O-])c1	ZINC000578587868	448583729	/nfs/dbraw/zinc/58/37/29/448583729.db2.gz	KSLFDKQRYVCBLK-MRVPVSSYSA-N	-1	3	337.361	1.540	20	5		EDBDHM
CC[C@H](C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C(=O)OC	ZINC000592076475	448663083	/nfs/dbraw/zinc/66/30/83/448663083.db2.gz	AXKVZINVVBBSNY-LLVKDONJSA-N	-1	3	344.389	1.689	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCOC(C)(C)C	ZINC000521829339	449015111	/nfs/dbraw/zinc/01/51/11/449015111.db2.gz	DKIOMBBYONWADC-UHFFFAOYSA-N	-1	3	332.378	1.697	20	5		EDBDHM
CCOCCC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCC1	ZINC000593566611	449076013	/nfs/dbraw/zinc/07/60/13/449076013.db2.gz	NKPQUTRXNDWSPI-UHFFFAOYSA-N	-1	3	343.405	1.865	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCc3cc(O)ccc3C2)nc1	ZINC000593587308	449091986	/nfs/dbraw/zinc/09/19/86/449091986.db2.gz	DLKVQKPNCAUOHG-GFCCVEGCSA-N	-1	3	349.368	1.531	20	5		EDBDHM
CC[C@](C)([N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F)C(=O)OC	ZINC000590591980	449208407	/nfs/dbraw/zinc/20/84/07/449208407.db2.gz	WWNPACHTOXQLKW-ZDUSSCGKSA-N	-1	3	348.352	1.662	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CCC[C@@H]2N(C)C)c([N+](=O)[O-])s1	ZINC000601959240	449245638	/nfs/dbraw/zinc/24/56/38/449245638.db2.gz	IBBZVATXBKJIDK-UWVGGRQHSA-N	-1	3	333.435	1.726	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]CC1=CCOCC1	ZINC000590758950	449277041	/nfs/dbraw/zinc/27/70/41/449277041.db2.gz	BDGYUXPSODOGSW-UHFFFAOYSA-N	-1	3	328.346	1.228	20	5		EDBDHM
COC(=O)[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)CC(C)C	ZINC000593553102	449344428	/nfs/dbraw/zinc/34/44/28/449344428.db2.gz	PHWBAZDXNLFEJN-SNVBAGLBSA-N	-1	3	345.377	1.103	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2CCOc3ccccc32)nc1	ZINC000593541230	449335214	/nfs/dbraw/zinc/33/52/14/449335214.db2.gz	IIMDNWRSRSVFKR-NSHDSACASA-N	-1	3	349.368	1.834	20	5		EDBDHM
Cc1ccnc([C@H](C)[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])n1	ZINC000598735329	449569840	/nfs/dbraw/zinc/56/98/40/449569840.db2.gz	NXNBCSFQHVGEPO-NSHDSACASA-N	-1	3	336.373	1.874	20	5		EDBDHM
O=[N+]([O-])c1cc([O-])ccc1-n1cc(CCNCC(F)(F)F)nn1	ZINC000594651967	449608664	/nfs/dbraw/zinc/60/86/64/449608664.db2.gz	GULZGADPYPQLTB-UHFFFAOYSA-N	-1	3	331.254	1.576	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CN(C3CC3)C[C@H]2C)c([N+](=O)[O-])s1	ZINC000601370369	449884982	/nfs/dbraw/zinc/88/49/82/449884982.db2.gz	XTZDJXDBCIOFGG-KCJUWKMLSA-N	-1	3	345.446	1.726	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@]23C[C@@H]2COC3(C)C)cc1[N+](=O)[O-]	ZINC000599395560	449940714	/nfs/dbraw/zinc/94/07/14/449940714.db2.gz	ARSLWBHIVMDXPV-PELKAZGASA-N	-1	3	332.403	1.811	20	5		EDBDHM
O=C(CNC(=O)c1ccc([O-])cc1)NCc1cccc([N+](=O)[O-])c1	ZINC000608987010	449954613	/nfs/dbraw/zinc/95/46/13/449954613.db2.gz	SGDHIUZVMKYXDS-UHFFFAOYSA-N	-1	3	329.312	1.347	20	5		EDBDHM
Cc1ccc([C@@H](C)NC(=O)CC[C@H]2NC(=O)[N-]C2=O)cc1[N+](=O)[O-]	ZINC000610599271	450270673	/nfs/dbraw/zinc/27/06/73/450270673.db2.gz	GIHAYXSCCOPOFY-MWLCHTKSSA-N	-1	3	334.332	1.069	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1cccc(C)n1	ZINC000619477605	450484860	/nfs/dbraw/zinc/48/48/60/450484860.db2.gz	MPONTMSDGDPEAD-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1C[C@H](OC)C1(C)C	ZINC000619490063	450488889	/nfs/dbraw/zinc/48/88/89/450488889.db2.gz	QAANAPSBKKRQIP-NEPJUHHUSA-N	-1	3	344.389	1.695	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1C[N-]S(=O)(=O)c1cnc(C)s1	ZINC000270036138	536956221	/nfs/dbraw/zinc/95/62/21/536956221.db2.gz	ZAJMMDNXPJVPNV-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
CN1CCC[C@@H]([N-]S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000725827130	578284522	/nfs/dbraw/zinc/28/45/22/578284522.db2.gz	NALNGWWZIBDFJY-SNVBAGLBSA-N	-1	3	333.797	1.621	20	5		EDBDHM
CC(C)N1C[C@@H](Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1=O	ZINC000735874433	578931543	/nfs/dbraw/zinc/93/15/43/578931543.db2.gz	DPNYLIHFJPEMBF-JTQLQIEISA-N	-1	3	331.336	1.196	20	5		EDBDHM
CC(C)N1C[C@@H](Nc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1=O	ZINC000735874433	578931544	/nfs/dbraw/zinc/93/15/44/578931544.db2.gz	DPNYLIHFJPEMBF-JTQLQIEISA-N	-1	3	331.336	1.196	20	5		EDBDHM
CC(C)N1C[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1=O	ZINC000735876143	578931742	/nfs/dbraw/zinc/93/17/42/578931742.db2.gz	VLFBITDALPHNPB-VIFPVBQESA-N	-1	3	331.336	1.196	20	5		EDBDHM
CC(C)N1C[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1=O	ZINC000735876143	578931743	/nfs/dbraw/zinc/93/17/43/578931743.db2.gz	VLFBITDALPHNPB-VIFPVBQESA-N	-1	3	331.336	1.196	20	5		EDBDHM
C[C@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)c1cccc(-c2nnn[n-]2)c1	ZINC000736158330	578958057	/nfs/dbraw/zinc/95/80/57/578958057.db2.gz	FSYQVKNBBRJSAI-VIFPVBQESA-N	-1	3	343.303	1.276	20	5		EDBDHM
C[C@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)c1cccc(-c2nn[n-]n2)c1	ZINC000736158330	578958058	/nfs/dbraw/zinc/95/80/58/578958058.db2.gz	FSYQVKNBBRJSAI-VIFPVBQESA-N	-1	3	343.303	1.276	20	5		EDBDHM
C[C@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)c1cccc(-c2nnn[n-]2)c1	ZINC000736158332	578958092	/nfs/dbraw/zinc/95/80/92/578958092.db2.gz	FTNAMKCQJBIGSZ-VIFPVBQESA-N	-1	3	343.303	1.276	20	5		EDBDHM
C[C@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)c1cccc(-c2nn[n-]n2)c1	ZINC000736158332	578958093	/nfs/dbraw/zinc/95/80/93/578958093.db2.gz	FTNAMKCQJBIGSZ-VIFPVBQESA-N	-1	3	343.303	1.276	20	5		EDBDHM
COCCN1CCC[C@H](Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000737006404	579039952	/nfs/dbraw/zinc/03/99/52/579039952.db2.gz	IBLDOSIDNPTQSG-LBPRGKRZSA-N	-1	3	347.379	1.298	20	5		EDBDHM
Cn1cc([C@H]2CCN(c3ccc([N+](=O)[O-])cc3-c3nnn[n-]3)C2)cn1	ZINC000737605842	579119176	/nfs/dbraw/zinc/11/91/76/579119176.db2.gz	WOHMKPDRNDZDIB-JTQLQIEISA-N	-1	3	340.347	1.502	20	5		EDBDHM
Cn1cc([C@H]2CCN(c3ccc([N+](=O)[O-])cc3-c3nn[n-]n3)C2)cn1	ZINC000737605842	579119177	/nfs/dbraw/zinc/11/91/77/579119177.db2.gz	WOHMKPDRNDZDIB-JTQLQIEISA-N	-1	3	340.347	1.502	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CC[N-]S(=O)(=O)c1cccc2nonc21	ZINC000765196939	580137292	/nfs/dbraw/zinc/13/72/92/580137292.db2.gz	XQKBBFGUFRQPMU-UHFFFAOYSA-N	-1	3	348.340	1.652	20	5		EDBDHM
COCC[C@@]1([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CCOC1	ZINC000772720881	580318818	/nfs/dbraw/zinc/31/88/18/580318818.db2.gz	WQYMUTZXIGUHLR-CQSZACIVSA-N	-1	3	344.314	1.998	20	5		EDBDHM
CC[C@H](C(=O)[N-]S(=O)(=O)c1cc([N+](=O)[O-])cs1)N(CC)CC	ZINC000778641301	580469408	/nfs/dbraw/zinc/46/94/08/580469408.db2.gz	SRXDKSIJJMDTGK-SNVBAGLBSA-N	-1	3	349.434	1.582	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@@H](O)c2ccsc2)c(-c2nnn[n-]2)c1	ZINC000738368323	598854581	/nfs/dbraw/zinc/85/45/81/598854581.db2.gz	CMROZUSAVUCYLH-GFCCVEGCSA-N	-1	3	332.345	1.982	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@@H](O)c2ccsc2)c(-c2nn[n-]n2)c1	ZINC000738368323	598854582	/nfs/dbraw/zinc/85/45/82/598854582.db2.gz	CMROZUSAVUCYLH-GFCCVEGCSA-N	-1	3	332.345	1.982	20	5		EDBDHM
COCC[C@H]1COCCN1Cc1ccc([O-])c(OC)c1[N+](=O)[O-]	ZINC000894571346	591348036	/nfs/dbraw/zinc/34/80/36/591348036.db2.gz	PPOJYWNHUKHDAQ-LBPRGKRZSA-N	-1	3	326.349	1.546	20	5		EDBDHM
CC[C@]1(C)NC(=O)N([N-]C(=O)c2ccc(NC)c([N+](=O)[O-])c2)C1=O	ZINC000906487911	592830551	/nfs/dbraw/zinc/83/05/51/592830551.db2.gz	DXLGHVBFEAVRNK-AWEZNQCLSA-N	-1	3	335.320	1.002	20	5		EDBDHM
COCCN1CCCN(c2cc(C)c([N+](=O)[O-])cc2C(=O)[O-])CC1	ZINC000910347370	592839462	/nfs/dbraw/zinc/83/94/62/592839462.db2.gz	WOGMVRXMZGKQSY-UHFFFAOYSA-N	-1	3	337.376	1.760	20	5		EDBDHM
Cc1cc(N[C@@H](C)[C@H]2CN(C)CCN2C)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000910364584	592844934	/nfs/dbraw/zinc/84/49/34/592844934.db2.gz	SGUBFJQLRGZFPB-SMDDNHRTSA-N	-1	3	336.392	1.648	20	5		EDBDHM
Cc1c(CO)cc([N+](=O)[O-])c([N-]CC(=O)NC(C)C)c1[N+](=O)[O-]	ZINC000028624892	592963895	/nfs/dbraw/zinc/96/38/95/592963895.db2.gz	XNZDZMJLUPDDFI-UHFFFAOYSA-N	-1	3	326.309	1.240	20	5		EDBDHM
O=C(OCCn1cc([N+](=O)[O-])ccc1=O)c1cc(-c2ccco2)n[n-]1	ZINC000761377836	593415416	/nfs/dbraw/zinc/41/54/16/593415416.db2.gz	UJOYCRQDTMXSQB-UHFFFAOYSA-N	-1	3	344.283	1.597	20	5		EDBDHM
O=C(OCCn1cc([N+](=O)[O-])ccc1=O)c1cc(-c2ccco2)[n-]n1	ZINC000761377836	593415418	/nfs/dbraw/zinc/41/54/18/593415418.db2.gz	UJOYCRQDTMXSQB-UHFFFAOYSA-N	-1	3	344.283	1.597	20	5		EDBDHM
NC(=O)[C@H]1CC[C@H](C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000817141296	593575833	/nfs/dbraw/zinc/57/58/33/593575833.db2.gz	KUWUWEDDCSWDIL-KYZUINATSA-N	-1	3	347.418	1.226	20	5		EDBDHM
CCC[C@@H](C)C(=O)NCC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000814285800	593581681	/nfs/dbraw/zinc/58/16/81/593581681.db2.gz	OQYFDJILXNXXBC-SECBINFHSA-N	-1	3	349.434	1.487	20	5		EDBDHM
CN(c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C1CCC(CO)CC1	ZINC000821619126	593883521	/nfs/dbraw/zinc/88/35/21/593883521.db2.gz	KLSUJDXGEHHWST-UHFFFAOYSA-N	-1	3	332.364	1.762	20	5		EDBDHM
CN(c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])C1CCC(CO)CC1	ZINC000821619126	593883523	/nfs/dbraw/zinc/88/35/23/593883523.db2.gz	KLSUJDXGEHHWST-UHFFFAOYSA-N	-1	3	332.364	1.762	20	5		EDBDHM
CCC(=O)N1CCCN(c2ccc(-c3nnn[n-]3)c([N+](=O)[O-])c2)CC1	ZINC000820838296	593902828	/nfs/dbraw/zinc/90/28/28/593902828.db2.gz	RPMVDPOLACBCRC-UHFFFAOYSA-N	-1	3	345.363	1.224	20	5		EDBDHM
COc1ccc(OC(=O)c2cc(-c3nnn[n-]3)cn2C)c([N+](=O)[O-])c1	ZINC000821838002	593951274	/nfs/dbraw/zinc/95/12/74/593951274.db2.gz	JBOXAJIYOUSGFW-UHFFFAOYSA-N	-1	3	344.287	1.341	20	5		EDBDHM
COc1ccc(OC(=O)c2cc(-c3nn[n-]n3)cn2C)c([N+](=O)[O-])c1	ZINC000821838002	593951276	/nfs/dbraw/zinc/95/12/76/593951276.db2.gz	JBOXAJIYOUSGFW-UHFFFAOYSA-N	-1	3	344.287	1.341	20	5		EDBDHM
C[C@H](OC(=O)c1c([N+](=O)[O-])cnn1C)c1cccc(-c2nnn[n-]2)c1	ZINC000824712867	594060449	/nfs/dbraw/zinc/06/04/49/594060449.db2.gz	DTHDAXXEABIDGR-QMMMGPOBSA-N	-1	3	343.303	1.426	20	5		EDBDHM
C[C@H](OC(=O)c1c([N+](=O)[O-])cnn1C)c1cccc(-c2nn[n-]n2)c1	ZINC000824712867	594060450	/nfs/dbraw/zinc/06/04/50/594060450.db2.gz	DTHDAXXEABIDGR-QMMMGPOBSA-N	-1	3	343.303	1.426	20	5		EDBDHM
NC(=O)c1cc([N+](=O)[O-])cnc1Oc1ccc(-c2nnn[n-]2)cc1F	ZINC000822880227	594115932	/nfs/dbraw/zinc/11/59/32/594115932.db2.gz	LLGDAVCSLQYAQK-UHFFFAOYSA-N	-1	3	345.250	1.200	20	5		EDBDHM
NC(=O)c1cc([N+](=O)[O-])cnc1Oc1ccc(-c2nn[n-]n2)cc1F	ZINC000822880227	594115934	/nfs/dbraw/zinc/11/59/34/594115934.db2.gz	LLGDAVCSLQYAQK-UHFFFAOYSA-N	-1	3	345.250	1.200	20	5		EDBDHM
O=[N+]([O-])c1cccnc1NCCOc1ccc(-c2nnn[n-]2)cc1	ZINC000823648414	594224490	/nfs/dbraw/zinc/22/44/90/594224490.db2.gz	WODIUJDKKPFCAF-UHFFFAOYSA-N	-1	3	327.304	1.661	20	5		EDBDHM
O=[N+]([O-])c1cccnc1NCCOc1ccc(-c2nn[n-]n2)cc1	ZINC000823648414	594224491	/nfs/dbraw/zinc/22/44/91/594224491.db2.gz	WODIUJDKKPFCAF-UHFFFAOYSA-N	-1	3	327.304	1.661	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCOC[C@H]2CCCO2)c(-c2nnn[n-]2)c1	ZINC000823651166	594224621	/nfs/dbraw/zinc/22/46/21/594224621.db2.gz	HRJXFDNWUHKAEM-LLVKDONJSA-N	-1	3	349.351	1.168	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCOC[C@H]2CCCO2)c(-c2nn[n-]n2)c1	ZINC000823651166	594224622	/nfs/dbraw/zinc/22/46/22/594224622.db2.gz	HRJXFDNWUHKAEM-LLVKDONJSA-N	-1	3	349.351	1.168	20	5		EDBDHM
Cc1c(NC(=O)c2c([N+](=O)[O-])cnn2C)cccc1-c1nnn[n-]1	ZINC000826242118	594393725	/nfs/dbraw/zinc/39/37/25/594393725.db2.gz	AOFHPZFQADBDQL-UHFFFAOYSA-N	-1	3	328.292	1.069	20	5		EDBDHM
Cc1c(NC(=O)c2c([N+](=O)[O-])cnn2C)cccc1-c1nn[n-]n1	ZINC000826242118	594393726	/nfs/dbraw/zinc/39/37/26/594393726.db2.gz	AOFHPZFQADBDQL-UHFFFAOYSA-N	-1	3	328.292	1.069	20	5		EDBDHM
CN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000830927936	594514720	/nfs/dbraw/zinc/51/47/20/594514720.db2.gz	FMUALUQJQCPCFB-NHYWBVRUSA-N	-1	3	347.371	1.849	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(OCCC(=O)[N-]O[C@H](CO)C(C)C)c1	ZINC000836901541	595012512	/nfs/dbraw/zinc/01/25/12/595012512.db2.gz	SMUZXNQICJZLJA-CQSZACIVSA-N	-1	3	326.349	1.737	20	5		EDBDHM
CC1(C)COC(=O)[C@@H]1[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000837639264	595159390	/nfs/dbraw/zinc/15/93/90/595159390.db2.gz	XACOMKCQMWQMMI-JTQLQIEISA-N	-1	3	328.271	1.754	20	5		EDBDHM
Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CCc2c(=O)[n-]cnc2C1	ZINC000843852761	595201278	/nfs/dbraw/zinc/20/12/78/595201278.db2.gz	WQQIBGQMVFZJOZ-UHFFFAOYSA-N	-1	3	332.291	1.736	20	5		EDBDHM
CN1CCC[C@@H]([N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848586862	595410175	/nfs/dbraw/zinc/41/01/75/595410175.db2.gz	DHGOLYKRAPWMCC-LLVKDONJSA-N	-1	3	343.286	1.303	20	5		EDBDHM
C[S@@](=O)C1(C[N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000848590001	595411134	/nfs/dbraw/zinc/41/11/34/595411134.db2.gz	LGIOSQZACHQYLF-HSZRJFAPSA-N	-1	3	348.327	1.594	20	5		EDBDHM
CN(C[C@H](O)CNC(=O)OC(C)(C)C)c1cc[n-]c(=O)c1[N+](=O)[O-]	ZINC000853652263	595847127	/nfs/dbraw/zinc/84/71/27/595847127.db2.gz	GKWZVVUAONCBBH-SECBINFHSA-N	-1	3	342.352	1.017	20	5		EDBDHM
COC(=O)C1=CC[C@@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000859285461	596032723	/nfs/dbraw/zinc/03/27/23/596032723.db2.gz	AKZMTYKVRWWFMH-MRVPVSSYSA-N	-1	3	332.359	1.196	20	5		EDBDHM
CCON(CC)C(=O)C[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000862622814	596365671	/nfs/dbraw/zinc/36/56/71/596365671.db2.gz	MKQOLQULPHXPSM-UHFFFAOYSA-N	-1	3	345.302	1.603	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2[C@H]3C[C@H]4CO[C@H]2[C@H]4C3)c([N+](=O)[O-])s1	ZINC000867611730	596460119	/nfs/dbraw/zinc/46/01/19/596460119.db2.gz	OUIOQUYURLNGJK-VXIZUSDNSA-N	-1	3	344.414	1.666	20	5		EDBDHM
NC(=O)[N-]C(=O)OCCCSCCOc1ccc([N+](=O)[O-])cc1	ZINC000863353215	596559553	/nfs/dbraw/zinc/55/95/53/596559553.db2.gz	WHJDTEMQHINFFM-UHFFFAOYSA-N	-1	3	343.361	1.902	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H](CO)Cc2ccccc2)cs1	ZINC000125877443	597167362	/nfs/dbraw/zinc/16/73/62/597167362.db2.gz	VJYAIZOHTLIIPQ-LLVKDONJSA-N	-1	3	342.398	1.538	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCc2cccc(CO)c2)c(-c2nnn[n-]2)c1	ZINC000738371638	598245040	/nfs/dbraw/zinc/24/50/40/598245040.db2.gz	VLYHCBQMQZRKCV-UHFFFAOYSA-N	-1	3	326.316	1.879	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCc2cccc(CO)c2)c(-c2nn[n-]n2)c1	ZINC000738371638	598245041	/nfs/dbraw/zinc/24/50/41/598245041.db2.gz	VLYHCBQMQZRKCV-UHFFFAOYSA-N	-1	3	326.316	1.879	20	5		EDBDHM
CCOCCO[C@H]1CCN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000825605535	607543756	/nfs/dbraw/zinc/54/37/56/607543756.db2.gz	WXNNHOZSOVQASU-LBPRGKRZSA-N	-1	3	348.363	1.407	20	5		EDBDHM
CCOCCO[C@H]1CCN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1	ZINC000825605535	607543758	/nfs/dbraw/zinc/54/37/58/607543758.db2.gz	WXNNHOZSOVQASU-LBPRGKRZSA-N	-1	3	348.363	1.407	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]CC2(Br)CC2)cs1	ZINC000920058696	697388565	/nfs/dbraw/zinc/38/85/65/697388565.db2.gz	XRMMWZORYYRCNP-UHFFFAOYSA-N	-1	3	341.208	1.862	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@]23C[C@H]2COC32CCC2)c([N+](=O)[O-])s1	ZINC000922105583	709690429	/nfs/dbraw/zinc/69/04/29/709690429.db2.gz	HREGLUARPZMSIR-TVQRCGJNSA-N	-1	3	344.414	1.955	20	5		EDBDHM
Cc1c([C@@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)cnn1C	ZINC000055236739	214292175	/nfs/dbraw/zinc/29/21/75/214292175.db2.gz	FUFZXHZDOJSATR-MRVPVSSYSA-N	-1	3	342.352	1.815	20	5		EDBDHM
CC[C@@]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])(C(N)=O)C(C)C	ZINC000181527271	529518601	/nfs/dbraw/zinc/51/86/01/529518601.db2.gz	SSZAAIUXWCQQFU-ZDUSSCGKSA-N	-1	3	329.378	1.163	20	5		EDBDHM
CCC(CC)[C@H](O)C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000119155750	282281603	/nfs/dbraw/zinc/28/16/03/282281603.db2.gz	PGHOQQDLRIGIQU-CYBMUJFWSA-N	-1	3	330.406	1.979	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCNC(=O)C2CC2)c1C	ZINC000178281969	232123861	/nfs/dbraw/zinc/12/38/61/232123861.db2.gz	NKKBLURCVKKABI-UHFFFAOYSA-N	-1	3	341.389	1.016	20	5		EDBDHM
O=C(Nc1ccc(N2CCCC2)nc1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000186841204	236039546	/nfs/dbraw/zinc/03/95/46/236039546.db2.gz	WSKXLYOWTXTEAH-UHFFFAOYSA-N	-1	3	329.316	1.943	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCO)c([N-]S(=O)(=O)CCC2CC2)c1	ZINC000129980543	223109528	/nfs/dbraw/zinc/10/95/28/223109528.db2.gz	SEOHLBJFBCWSFU-UHFFFAOYSA-N	-1	3	329.378	1.541	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](C)C2CCOCC2)c([N+](=O)[O-])c1	ZINC000132922157	223373957	/nfs/dbraw/zinc/37/39/57/223373957.db2.gz	IGMFZEDKVFLPFH-LLVKDONJSA-N	-1	3	328.390	1.997	20	5		EDBDHM
O=C(c1cc([N+](=O)[O-])cnc1[O-])N1CCn2c3ccccc3nc21	ZINC000184342887	296187068	/nfs/dbraw/zinc/18/70/68/296187068.db2.gz	BIYIOEYXDMREHN-UHFFFAOYSA-N	-1	3	325.284	1.706	20	5		EDBDHM
O=C(c1cc([N+](=O)[O-])c[n-]c1=O)N1CCn2c3ccccc3nc21	ZINC000184342887	296187069	/nfs/dbraw/zinc/18/70/69/296187069.db2.gz	BIYIOEYXDMREHN-UHFFFAOYSA-N	-1	3	325.284	1.706	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@@H]2CC[C@@H](C)O2)cc1[N+](=O)[O-]	ZINC000416536540	251075390	/nfs/dbraw/zinc/07/53/90/251075390.db2.gz	PYSSZIRJHVGCLE-BDAKNGLRSA-N	-1	3	348.352	1.588	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H]2CCC(C)(C)O2)c([N+](=O)[O-])c1	ZINC000494346233	255247008	/nfs/dbraw/zinc/24/70/08/255247008.db2.gz	HRURXCHRIRCINB-LLVKDONJSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CCOC(=O)C[C@@H](C)C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000270558599	140123463	/nfs/dbraw/zinc/12/34/63/140123463.db2.gz	PCYMFMKXUXCREI-SNVBAGLBSA-N	-1	3	344.389	1.771	20	5		EDBDHM
CCc1nc([N-]C(=O)c2n[nH]cc2[N+](=O)[O-])sc1C(=O)OC	ZINC000271020347	140222133	/nfs/dbraw/zinc/22/21/33/140222133.db2.gz	NVCQTXGCGYMSBB-UHFFFAOYSA-N	-1	3	325.306	1.376	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CCO[C@@H](C)C1	ZINC000271303820	140274486	/nfs/dbraw/zinc/27/44/86/140274486.db2.gz	WXRJAYLGTUBSFZ-QWRGUYRKSA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2CCN(C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000360258162	292087816	/nfs/dbraw/zinc/08/78/16/292087816.db2.gz	OEFUBOQHBSUCEP-OLZOCXBDSA-N	-1	3	341.433	1.973	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H](C)c2nncn2C)cc1[N+](=O)[O-]	ZINC000343462096	142847967	/nfs/dbraw/zinc/84/79/67/142847967.db2.gz	KLWUZJIDACJAMJ-LURJTMIESA-N	-1	3	331.379	1.133	20	5		EDBDHM
CCC(C)(C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC	ZINC000345467006	143094312	/nfs/dbraw/zinc/09/43/12/143094312.db2.gz	REVLVYMCKYFLNN-UHFFFAOYSA-N	-1	3	330.362	1.848	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H]1C[C@H](C)O[C@@H]1C	ZINC000416608437	304337196	/nfs/dbraw/zinc/33/71/96/304337196.db2.gz	RRDHNZZSUFYLEJ-TUAOUCFPSA-N	-1	3	328.390	1.995	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1CC12CC2	ZINC000416639460	304340064	/nfs/dbraw/zinc/34/00/64/304340064.db2.gz	ASLBEOYWGMRXLR-VIFPVBQESA-N	-1	3	340.357	1.460	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)[N-]c2cc(F)ccc2-n2cccn2)n1	ZINC000355528789	150303513	/nfs/dbraw/zinc/30/35/13/150303513.db2.gz	NLXZEBGPVWPGEG-UHFFFAOYSA-N	-1	3	330.279	1.905	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)N1C[C@H](C)OC[C@@H]1C	ZINC000361133858	152316805	/nfs/dbraw/zinc/31/68/05/152316805.db2.gz	ZZCGCEQLUCJRNJ-UWVGGRQHSA-N	-1	3	345.377	1.369	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@@H]2CCOC[C@H]2C)cc1[N+](=O)[O-]	ZINC000352320797	162115942	/nfs/dbraw/zinc/11/59/42/162115942.db2.gz	SYVFWNWYXIDLIP-SCZZXKLOSA-N	-1	3	334.419	1.916	20	5		EDBDHM
CCC[C@@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(N)=O	ZINC000352527801	162232495	/nfs/dbraw/zinc/23/24/95/162232495.db2.gz	FJLMTQVMLCXNAG-SNVBAGLBSA-N	-1	3	329.378	1.144	20	5		EDBDHM
CC1(Cn2cc(C(=O)[N-]c3ccc([N+](=O)[O-])cc3F)nn2)COC1	ZINC000352833199	162259973	/nfs/dbraw/zinc/25/99/73/162259973.db2.gz	GYUYEYZKUGNRAX-UHFFFAOYSA-N	-1	3	335.295	1.614	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@@H]2CCC[C@@H]2O)cc1[N+](=O)[O-]	ZINC000275104557	268282221	/nfs/dbraw/zinc/28/22/21/268282221.db2.gz	UTKSPMKNEOODTB-UFBFGSQYSA-N	-1	3	348.352	1.182	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCC[C@H]2CCO)cc1[N+](=O)[O-]	ZINC000275240030	273108913	/nfs/dbraw/zinc/10/89/13/273108913.db2.gz	XAPZWZQXGOSBBP-GXFFZTMASA-N	-1	3	346.380	1.872	20	5		EDBDHM
CCOC(=O)c1nnc(C2CCN(c3ncc([N+](=O)[O-])cn3)CC2)[n-]1	ZINC000278130672	273249309	/nfs/dbraw/zinc/24/93/09/273249309.db2.gz	ZIPQMIVFFURVSO-UHFFFAOYSA-N	-1	3	347.335	1.064	20	5		EDBDHM
CCOC(=O)c1nc(C2CCN(c3ncc([N+](=O)[O-])cn3)CC2)n[n-]1	ZINC000278130672	273249310	/nfs/dbraw/zinc/24/93/10/273249310.db2.gz	ZIPQMIVFFURVSO-UHFFFAOYSA-N	-1	3	347.335	1.064	20	5		EDBDHM
CCOC(=O)c1n[n-]c(C2CCN(c3ncc([N+](=O)[O-])cn3)CC2)n1	ZINC000278130672	273249312	/nfs/dbraw/zinc/24/93/12/273249312.db2.gz	ZIPQMIVFFURVSO-UHFFFAOYSA-N	-1	3	347.335	1.064	20	5		EDBDHM
O=C(c1n[n-]c2ccc([N+](=O)[O-])cc21)N1CCOc2ncccc21	ZINC000361305965	275015957	/nfs/dbraw/zinc/01/59/57/275015957.db2.gz	QTLPGYLRXKXLCJ-UHFFFAOYSA-N	-1	3	325.284	1.905	20	5		EDBDHM
CCN1CCC[C@H]([N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C1	ZINC000060510876	279322858	/nfs/dbraw/zinc/32/28/58/279322858.db2.gz	FZVYYLJEALKQOV-ZDUSSCGKSA-N	-1	3	341.433	1.974	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@]2(C)CCOC2=O)c1	ZINC000289563324	288731206	/nfs/dbraw/zinc/73/12/06/288731206.db2.gz	NWMAKQAOZYSOCK-LBPRGKRZSA-N	-1	3	348.764	1.541	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C2CCS(=O)CC2)c1C	ZINC000330638111	301859544	/nfs/dbraw/zinc/85/95/44/301859544.db2.gz	VUXKTEYPRKMNTA-UHFFFAOYSA-N	-1	3	346.430	1.401	20	5		EDBDHM
CC/C=C/C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC	ZINC000295286157	303199738	/nfs/dbraw/zinc/19/97/38/303199738.db2.gz	GEDZUMSQTXSWRH-SNAWJCMRSA-N	-1	3	328.346	1.626	20	5		EDBDHM
CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCC[C@@]2(C1)NC(=O)[N-]C2=O	ZINC000435042131	305135295	/nfs/dbraw/zinc/13/52/95/305135295.db2.gz	LTUZPTVXLCLXFZ-UEOUDEGLSA-N	-1	3	344.371	1.672	20	5		EDBDHM
CSC[C@@H](CCO)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000443236447	305237458	/nfs/dbraw/zinc/23/74/58/305237458.db2.gz	XSKHIFOZZNWSRH-SNVBAGLBSA-N	-1	3	334.419	1.296	20	5		EDBDHM
Cn1cccc(NC(=O)NCc2nc3ccc([N+](=O)[O-])cc3[n-]2)c1=O	ZINC000444898218	305254483	/nfs/dbraw/zinc/25/44/83/305254483.db2.gz	GNGUFJMWFDLVQH-UHFFFAOYSA-N	-1	3	342.315	1.492	20	5		EDBDHM
O=C(Nc1cc2c(cc1F)NC(=O)CC2)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000445211053	305258080	/nfs/dbraw/zinc/25/80/80/305258080.db2.gz	JDZLXVCPVVAVNJ-UHFFFAOYSA-N	-1	3	346.274	1.972	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2COCC2(C)C)cc1C	ZINC000451964870	305374715	/nfs/dbraw/zinc/37/47/15/305374715.db2.gz	JYJAXNWMSWERHN-ZDUSSCGKSA-N	-1	3	328.390	1.915	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCC[C@@H]1CCOC1	ZINC000452018615	305378785	/nfs/dbraw/zinc/37/87/85/305378785.db2.gz	OPAVPNZGSFECQN-LLVKDONJSA-N	-1	3	344.389	1.698	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)CCc2ccccc2[N+](=O)[O-])on1	ZINC000534306465	306005628	/nfs/dbraw/zinc/00/56/28/306005628.db2.gz	ZTQVFEXVSHISDO-UHFFFAOYSA-N	-1	3	339.373	1.807	20	5		EDBDHM
CCCc1[nH]nc(C(=O)Nc2cc(C(=O)OCC)[n-]n2)c1[N+](=O)[O-]	ZINC000537546810	306027341	/nfs/dbraw/zinc/02/73/41/306027341.db2.gz	STGXBPWGZUULTJ-UHFFFAOYSA-N	-1	3	336.308	1.423	20	5		EDBDHM
CCCc1[nH]nc(C(=O)Nc2cc(C(=O)OCC)n[n-]2)c1[N+](=O)[O-]	ZINC000537546810	306027342	/nfs/dbraw/zinc/02/73/42/306027342.db2.gz	STGXBPWGZUULTJ-UHFFFAOYSA-N	-1	3	336.308	1.423	20	5		EDBDHM
O=C(c1cccc([O-])c1)N1CCN(c2ccc([N+](=O)[O-])cn2)CC1	ZINC000060355966	441237821	/nfs/dbraw/zinc/23/78/21/441237821.db2.gz	DKOAYHDOFBGBSC-UHFFFAOYSA-N	-1	3	328.328	1.658	20	5		EDBDHM
CN1CCC[C@H](C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000108406513	441452312	/nfs/dbraw/zinc/45/23/12/441452312.db2.gz	LKEKNJJWDJINTB-SNVBAGLBSA-N	-1	3	347.824	1.868	20	5		EDBDHM
O=[N+]([O-])c1c(F)cccc1S(=O)(=O)[N-][C@@H]1CCN2CCCC[C@H]12	ZINC000053667187	441535094	/nfs/dbraw/zinc/53/50/94/441535094.db2.gz	GIBWLFBMTWPSOB-VXGBXAGGSA-N	-1	3	343.380	1.639	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1cccs1)Nc1cccc([N+](=O)[O-])c1	ZINC000032643903	441562239	/nfs/dbraw/zinc/56/22/39/441562239.db2.gz	HODNZKDZEAWKBH-UHFFFAOYSA-N	-1	3	341.370	1.573	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H](C)Cn1cccn1	ZINC000056072788	441686372	/nfs/dbraw/zinc/68/63/72/441686372.db2.gz	KZFBCVDAOWBUER-LLVKDONJSA-N	-1	3	338.389	1.714	20	5		EDBDHM
CC1CCN(C[C@H](O)CNC(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC1	ZINC000116448308	441823210	/nfs/dbraw/zinc/82/32/10/441823210.db2.gz	QWURYKWNQRVKKM-CYBMUJFWSA-N	-1	3	337.376	1.123	20	5		EDBDHM
Cc1c(C[N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])cnn1C	ZINC000152579908	442227801	/nfs/dbraw/zinc/22/78/01/442227801.db2.gz	LUDDWTWXOIFHHM-UHFFFAOYSA-N	-1	3	338.389	1.732	20	5		EDBDHM
O=C(Nc1cccnc1-n1cccn1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000187553582	442680856	/nfs/dbraw/zinc/68/08/56/442680856.db2.gz	OYVLMJRCXFHRGT-UHFFFAOYSA-N	-1	3	326.272	1.528	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCCO[C@H]1CCOC1	ZINC000268228810	442909142	/nfs/dbraw/zinc/90/91/42/442909142.db2.gz	KNZFUMDJURDPGN-LBPRGKRZSA-N	-1	3	344.389	1.377	20	5		EDBDHM
CN(C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[n-]c1=O)c1ccccc1	ZINC000194625312	442926970	/nfs/dbraw/zinc/92/69/70/442926970.db2.gz	AYDXTQIDMKGNNY-AWEZNQCLSA-N	-1	3	330.344	1.728	20	5		EDBDHM
CCOC(=O)c1ccnc(Sc2nnc(COC)[n-]2)c1[N+](=O)[O-]	ZINC000268495461	443009779	/nfs/dbraw/zinc/00/97/79/443009779.db2.gz	QFKPQXNNZCSVGF-UHFFFAOYSA-N	-1	3	339.333	1.582	20	5		EDBDHM
CCOC(=O)c1ccnc(Sc2nc(COC)n[n-]2)c1[N+](=O)[O-]	ZINC000268495461	443009783	/nfs/dbraw/zinc/00/97/83/443009783.db2.gz	QFKPQXNNZCSVGF-UHFFFAOYSA-N	-1	3	339.333	1.582	20	5		EDBDHM
CCOC(=O)c1ccnc(Sc2n[n-]c(COC)n2)c1[N+](=O)[O-]	ZINC000268495461	443009787	/nfs/dbraw/zinc/00/97/87/443009787.db2.gz	QFKPQXNNZCSVGF-UHFFFAOYSA-N	-1	3	339.333	1.582	20	5		EDBDHM
CN(CC(=O)[O-])C[C@@H]1CN(c2c(Cl)cccc2[N+](=O)[O-])CCO1	ZINC000263447587	443230700	/nfs/dbraw/zinc/23/07/00/443230700.db2.gz	ZDHRIYLLSOPMIT-SNVBAGLBSA-N	-1	3	343.767	1.470	20	5		EDBDHM
O=C(c1cc([O-])cc([N+](=O)[O-])c1)N1CCN(CC2CCOCC2)CC1	ZINC000272486542	443336031	/nfs/dbraw/zinc/33/60/31/443336031.db2.gz	GPPAZJJJYKMYJC-UHFFFAOYSA-N	-1	3	349.387	1.485	20	5		EDBDHM
C[C@@H]([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1nncn1C	ZINC000272620957	443385215	/nfs/dbraw/zinc/38/52/15/443385215.db2.gz	YKVAUDUJTNPKGA-MRVPVSSYSA-N	-1	3	325.275	1.693	20	5		EDBDHM
CCCOC(=O)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000267125972	443349827	/nfs/dbraw/zinc/34/98/27/443349827.db2.gz	GBOZSZOAIGDQET-UHFFFAOYSA-N	-1	3	346.361	1.225	20	5		EDBDHM
CCC[C@](C)(O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000269715127	443407542	/nfs/dbraw/zinc/40/75/42/443407542.db2.gz	ANECFDMVMSWPRC-ZDUSSCGKSA-N	-1	3	332.378	1.433	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])[C@@H]1CCCO1	ZINC000278865768	443466539	/nfs/dbraw/zinc/46/65/39/443466539.db2.gz	YFUBSTASBMOKJF-YPMHNXCESA-N	-1	3	344.389	1.376	20	5		EDBDHM
COC[C@@H]([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCO1	ZINC000279061131	443505146	/nfs/dbraw/zinc/50/51/46/443505146.db2.gz	AWQAQWNYQPNNRV-CHWSQXEVSA-N	-1	3	344.314	1.997	20	5		EDBDHM
Cn1cc([C@H](CO)[N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)cn1	ZINC000272268909	443574703	/nfs/dbraw/zinc/57/47/03/443574703.db2.gz	CHDVRKLKUIGKML-LBPRGKRZSA-N	-1	3	340.286	1.270	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1C[C@@H]1C	ZINC000276240516	443674904	/nfs/dbraw/zinc/67/49/04/443674904.db2.gz	QHGQNKXXDZTQFF-IUCAKERBSA-N	-1	3	328.346	1.316	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1c1nc(=N)n(C)[n-]1	ZINC000567474134	321242995	/nfs/dbraw/zinc/24/29/95/321242995.db2.gz	HFEZFWGBUUSDSG-GFCCVEGCSA-N	-1	3	330.348	1.422	20	5		EDBDHM
CO[C@@H](C)[C@@H](C)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000289773852	444201621	/nfs/dbraw/zinc/20/16/21/444201621.db2.gz	ZZCNVJPVADBDGS-BDAKNGLRSA-N	-1	3	346.361	1.068	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCC[C@H](CO)C1	ZINC000323679385	444345026	/nfs/dbraw/zinc/34/50/26/444345026.db2.gz	YPYGLCWICFMZNN-WDEREUQCSA-N	-1	3	344.389	1.433	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CCO[C@@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000340605930	444457759	/nfs/dbraw/zinc/45/77/59/444457759.db2.gz	WUASJXYRPXLACC-SMDDNHRTSA-N	-1	3	326.374	1.749	20	5		EDBDHM
CCC[C@@](C)([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C(=O)OC	ZINC000337835036	444430363	/nfs/dbraw/zinc/43/03/63/444430363.db2.gz	HZOHROPTJCOACS-CQSZACIVSA-N	-1	3	344.389	1.913	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H](CO)CC1CCCC1	ZINC000338020895	444488512	/nfs/dbraw/zinc/48/85/12/444488512.db2.gz	FPUZDABOVDOHPF-GFCCVEGCSA-N	-1	3	328.390	1.814	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCn2ccccc2=O)cc1[N+](=O)[O-]	ZINC000342245527	444585284	/nfs/dbraw/zinc/58/52/84/444585284.db2.gz	GTKCTMVUBQYNSC-UHFFFAOYSA-N	-1	3	343.386	1.105	20	5		EDBDHM
C[C@@H](NC(=O)c1ccc2c(c1)C(=O)[N-]C2=O)c1ccccc1[N+](=O)[O-]	ZINC000342490193	444714190	/nfs/dbraw/zinc/71/41/90/444714190.db2.gz	NTGVHDUIBSSYKP-SECBINFHSA-N	-1	3	339.307	1.969	20	5		EDBDHM
CCc1nc([C@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)n[nH]1	ZINC000342775981	444862232	/nfs/dbraw/zinc/86/22/32/444862232.db2.gz	CWUKXTYFSKZQPY-LURJTMIESA-N	-1	3	331.379	1.376	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2F)cc1[N+](=O)[O-]	ZINC000339121950	445041371	/nfs/dbraw/zinc/04/13/71/445041371.db2.gz	FYQIGURKOWYHKT-WCBMZHEXSA-N	-1	3	336.316	1.911	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H](C)C(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000342003179	445117992	/nfs/dbraw/zinc/11/79/92/445117992.db2.gz	GIFWAGYZURPZSF-JTQLQIEISA-N	-1	3	344.389	1.912	20	5		EDBDHM
Nc1ncc([N+](=O)[O-])cc1C(=O)[N-]c1nnc(CC(F)(F)F)s1	ZINC000351727351	445295740	/nfs/dbraw/zinc/29/57/40/445295740.db2.gz	LMOKDGVATDMGRT-UHFFFAOYSA-N	-1	3	348.266	1.781	20	5		EDBDHM
O=C(NCCCNC(=O)c1ccccc1[N+](=O)[O-])c1cccc([O-])c1	ZINC000357139273	445449681	/nfs/dbraw/zinc/44/96/81/445449681.db2.gz	IRNJDRCCSNXIKI-UHFFFAOYSA-N	-1	3	343.339	1.850	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C(C)C)C(C)(C)O	ZINC000360132489	445586065	/nfs/dbraw/zinc/58/60/65/445586065.db2.gz	PSCSVIYQZWZMHY-CYBMUJFWSA-N	-1	3	346.405	1.677	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC[C@H](O)C(C)C)c1[N+](=O)[O-]	ZINC000360250271	445656939	/nfs/dbraw/zinc/65/69/39/445656939.db2.gz	OKEBDXBIXNMYEM-LBPRGKRZSA-N	-1	3	330.406	1.897	20	5		EDBDHM
COC(=O)[C@H](C)C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000358849729	445809204	/nfs/dbraw/zinc/80/92/04/445809204.db2.gz	CLNORXVERBIMDD-SSDOTTSWSA-N	-1	3	336.753	1.336	20	5		EDBDHM
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)[C@H]1OC	ZINC000358912214	445844909	/nfs/dbraw/zinc/84/49/09/445844909.db2.gz	YPCYCVSACXWTIH-BFHYXJOUSA-N	-1	3	344.389	1.207	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H](CCO)C1CCOCC1	ZINC000359218499	446048685	/nfs/dbraw/zinc/04/86/85/446048685.db2.gz	SNYRDMVYLIRTDZ-GFCCVEGCSA-N	-1	3	344.389	1.051	20	5		EDBDHM
CS[C@@H]1CN(c2nc(C(=O)[O-])ccc2[N+](=O)[O-])C[C@@H]1N(C)C	ZINC000583696189	326122027	/nfs/dbraw/zinc/12/20/27/326122027.db2.gz	INCHCAGJIFSFTG-WDEREUQCSA-N	-1	3	326.378	1.170	20	5		EDBDHM
O=C1CCC[C@@H](C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])N1	ZINC000433449053	446573013	/nfs/dbraw/zinc/57/30/13/446573013.db2.gz	DICAYSYPVUVCQC-VIFPVBQESA-N	-1	3	347.780	1.195	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC(S(=O)(=O)[N-]c3ccccc3)C2)s1	ZINC000375594317	446914095	/nfs/dbraw/zinc/91/40/95/446914095.db2.gz	ALBGELOOYXOFDR-UHFFFAOYSA-N	-1	3	340.386	1.682	20	5		EDBDHM
O=C(c1cccc([O-])c1)N1CCN(c2ncc([N+](=O)[O-])cc2F)CC1	ZINC000413113022	447010772	/nfs/dbraw/zinc/01/07/72/447010772.db2.gz	ROVFHFYZYWOQFH-UHFFFAOYSA-N	-1	3	346.318	1.797	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1C[C@@H]2OCCC[C@@H]12	ZINC000368920303	447202732	/nfs/dbraw/zinc/20/27/32/447202732.db2.gz	SQRZGEQEWFIAAP-LOWVWBTDSA-N	-1	3	342.373	1.449	20	5		EDBDHM
C[C@@]1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCC(=O)N1	ZINC000416503445	447628748	/nfs/dbraw/zinc/62/87/48/447628748.db2.gz	VRYJZTQAZUQNEY-LBPRGKRZSA-N	-1	3	347.780	1.195	20	5		EDBDHM
Nc1nc(=NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)nc2[nH][n-]cc1-2	ZINC000514928495	448226594	/nfs/dbraw/zinc/22/65/94/448226594.db2.gz	YKYBFGLQVKPWNM-UHFFFAOYSA-N	-1	3	338.331	1.353	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)n[n-]1	ZINC000563582545	448307751	/nfs/dbraw/zinc/30/77/51/448307751.db2.gz	KHTCMTCCITXHQX-UHFFFAOYSA-N	-1	3	348.315	2.064	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)[n-]n1	ZINC000563582545	448307759	/nfs/dbraw/zinc/30/77/59/448307759.db2.gz	KHTCMTCCITXHQX-UHFFFAOYSA-N	-1	3	348.315	2.064	20	5		EDBDHM
O=[N+]([O-])c1ccc2[nH]cc(CC[N-]S(=O)(=O)c3c[nH]cn3)c2c1	ZINC000582628454	448294840	/nfs/dbraw/zinc/29/48/40/448294840.db2.gz	WPVJICHDPFRORW-UHFFFAOYSA-N	-1	3	335.345	1.320	20	5		EDBDHM
C[C@H](C(=O)Nc1nnc(SCCO)[n-]1)c1cccc([N+](=O)[O-])c1	ZINC000578587869	448584143	/nfs/dbraw/zinc/58/41/43/448584143.db2.gz	KSLFDKQRYVCBLK-QMMMGPOBSA-N	-1	3	337.361	1.540	20	5		EDBDHM
C[C@H](C(=O)Nc1nc(SCCO)n[n-]1)c1cccc([N+](=O)[O-])c1	ZINC000578587869	448584149	/nfs/dbraw/zinc/58/41/49/448584149.db2.gz	KSLFDKQRYVCBLK-QMMMGPOBSA-N	-1	3	337.361	1.540	20	5		EDBDHM
C[C@H](C(=O)Nc1n[n-]c(SCCO)n1)c1cccc([N+](=O)[O-])c1	ZINC000578587869	448584155	/nfs/dbraw/zinc/58/41/55/448584155.db2.gz	KSLFDKQRYVCBLK-QMMMGPOBSA-N	-1	3	337.361	1.540	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1CCS[C@@H]1C	ZINC000592117597	448694779	/nfs/dbraw/zinc/69/47/79/448694779.db2.gz	ZBPQITRKTWEAPY-RKDXNWHRSA-N	-1	3	332.403	1.776	20	5		EDBDHM
C[C@@H](C(=O)N1CCC[C@H]1c1nc(=N)n(C)[n-]1)c1cccc([N+](=O)[O-])c1	ZINC000574405462	448866968	/nfs/dbraw/zinc/86/69/68/448866968.db2.gz	DIHVZNMHMSCGIR-MFKMUULPSA-N	-1	3	344.375	1.603	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2[C@H]3CCc4ccccc4[C@@H]23)nc1	ZINC000593565678	449074752	/nfs/dbraw/zinc/07/47/52/449074752.db2.gz	JGTNEZLHJUAAGT-NUEKZKHPSA-N	-1	3	345.380	1.997	20	5		EDBDHM
CCC[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(=O)OCC	ZINC000593587119	449092110	/nfs/dbraw/zinc/09/21/10/449092110.db2.gz	SHRBNRRPTWOVGX-JTQLQIEISA-N	-1	3	345.377	1.248	20	5		EDBDHM
COCC1(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCC1	ZINC000593600338	449099988	/nfs/dbraw/zinc/09/99/88/449099988.db2.gz	JGWLCTDVILCGIF-UHFFFAOYSA-N	-1	3	329.378	1.475	20	5		EDBDHM
CO[C@@](C)([C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C1CC1	ZINC000593609862	449106418	/nfs/dbraw/zinc/10/64/18/449106418.db2.gz	YTSQHYZOXBLMDD-RNCFNFMXSA-N	-1	3	329.378	1.472	20	5		EDBDHM
CC[C@H](C)[C@@H](O)C[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F	ZINC000590590340	449206922	/nfs/dbraw/zinc/20/69/22/449206922.db2.gz	FVBQGCMKRCIAAA-UFBFGSQYSA-N	-1	3	334.369	1.728	20	5		EDBDHM
C[C@]1(c2ccccc2)C[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593554052	449343946	/nfs/dbraw/zinc/34/39/46/449343946.db2.gz	XQKGFSVKAMVULZ-DZGCQCFKSA-N	-1	3	333.369	1.998	20	5		EDBDHM
CCO[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C12CCC2	ZINC000593554173	449344724	/nfs/dbraw/zinc/34/47/24/449344724.db2.gz	YODSQCWIYHEKEA-RYUDHWBXSA-N	-1	3	341.389	1.616	20	5		EDBDHM
CN1CCC[C@H](N2CCN(C(=O)c3cc([O-])cc([N+](=O)[O-])c3)CC2)C1	ZINC000611556734	449334674	/nfs/dbraw/zinc/33/46/74/449334674.db2.gz	UZFXBCQFZASWKV-AWEZNQCLSA-N	-1	3	348.403	1.152	20	5		EDBDHM
COc1ccc(N2CCN(c3cc[n-]c(=O)c3[N+](=O)[O-])CC2)nc1	ZINC000596260893	449444697	/nfs/dbraw/zinc/44/46/97/449444697.db2.gz	OTBWVJUKNSCFMQ-UHFFFAOYSA-N	-1	3	331.332	1.426	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H](C2CC2)[C@H]2CCCCO2)nc1	ZINC000594485351	449549582	/nfs/dbraw/zinc/54/95/82/449549582.db2.gz	QFJZXYVKYAPKFW-OCCSQVGLSA-N	-1	3	341.389	1.616	20	5		EDBDHM
CCN1CCC[C@@H](C[N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])C1	ZINC000594751689	449667030	/nfs/dbraw/zinc/66/70/30/449667030.db2.gz	BDOQVAPUYOQJOJ-NSHDSACASA-N	-1	3	328.394	1.000	20	5		EDBDHM
CC(C)[C@@H](O)C[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594760207	449674108	/nfs/dbraw/zinc/67/41/08/449674108.db2.gz	SBRXPXISLDKHDZ-LBPRGKRZSA-N	-1	3	339.373	1.438	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1COC(C)(C)C1	ZINC000594789553	449699271	/nfs/dbraw/zinc/69/92/71/449699271.db2.gz	NCWFNCATYFOPLO-VIFPVBQESA-N	-1	3	330.362	1.449	20	5		EDBDHM
CO[C@H](C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000594790729	449700755	/nfs/dbraw/zinc/70/07/55/449700755.db2.gz	GYTHCODGJXEMLV-DGCLKSJQSA-N	-1	3	344.389	1.233	20	5		EDBDHM
CC(C)(C)N1CC[C@@H]([N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])C1	ZINC000594800207	449711628	/nfs/dbraw/zinc/71/16/28/449711628.db2.gz	ZGDOIJJESFXERP-SNVBAGLBSA-N	-1	3	328.394	1.141	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](CO)CC2CC2)cc1C	ZINC000594865298	449779232	/nfs/dbraw/zinc/77/92/32/449779232.db2.gz	OQEHCQMQDQHGND-CYBMUJFWSA-N	-1	3	342.417	1.899	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CCN(C)[C@@H](C)C2)c([N+](=O)[O-])s1	ZINC000601357091	449870723	/nfs/dbraw/zinc/87/07/23/449870723.db2.gz	LFVFTXCYMKFPCK-WPRPVWTQSA-N	-1	3	333.435	1.726	20	5		EDBDHM
O=C(Nc1ccn(-c2ccccc2)n1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000602843695	449849843	/nfs/dbraw/zinc/84/98/43/449849843.db2.gz	CPLRUDGLEQEHHZ-UHFFFAOYSA-N	-1	3	325.284	2.133	20	5		EDBDHM
COCC1([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)CCC1	ZINC000601412894	449928863	/nfs/dbraw/zinc/92/88/63/449928863.db2.gz	QFHCVTBQSWLNEM-UHFFFAOYSA-N	-1	3	332.353	1.890	20	5		EDBDHM
CCn1nncc1C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000599360962	449918231	/nfs/dbraw/zinc/91/82/31/449918231.db2.gz	YKFNPZUQZNBFPR-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1nc(CN)cc(=O)[n-]1	ZINC000595232991	449963529	/nfs/dbraw/zinc/96/35/29/449963529.db2.gz	GUWPVHABVDTWBF-UHFFFAOYSA-N	-1	3	346.347	1.488	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2(N(C)C)CC2)cc1C	ZINC000601448859	449972781	/nfs/dbraw/zinc/97/27/81/449972781.db2.gz	QKWAYEQBIDKDRP-UHFFFAOYSA-N	-1	3	327.406	1.584	20	5		EDBDHM
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)[N-][C@@H]1CCN(CC2CC2)C1	ZINC000609387671	450021864	/nfs/dbraw/zinc/02/18/64/450021864.db2.gz	CMUBNDQMNSFRKO-LLVKDONJSA-N	-1	3	343.380	1.497	20	5		EDBDHM
O=C1[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCN1C1CCC1	ZINC000599523709	450041387	/nfs/dbraw/zinc/04/13/87/450041387.db2.gz	DMIWVIXXKLSHPX-LLVKDONJSA-N	-1	3	339.373	1.027	20	5		EDBDHM
CCOC(=O)c1nnc(CNC(=O)c2ccc(CC)c([N+](=O)[O-])c2)[n-]1	ZINC000615920392	450272462	/nfs/dbraw/zinc/27/24/62/450272462.db2.gz	RODMHKHWRWSNGP-UHFFFAOYSA-N	-1	3	347.331	1.382	20	5		EDBDHM
CCOC(=O)c1nnc(CNC(=O)CCc2cccc([N+](=O)[O-])c2)[n-]1	ZINC000615916551	450269640	/nfs/dbraw/zinc/26/96/40/450269640.db2.gz	CRENZDDYKTVTEG-UHFFFAOYSA-N	-1	3	347.331	1.139	20	5		EDBDHM
CCN1CCN(CCCNC(=O)c2cccc([N+](=O)[O-])c2[O-])CC1	ZINC000130402488	529144811	/nfs/dbraw/zinc/14/48/11/529144811.db2.gz	BGVDRYNGNZOGMW-UHFFFAOYSA-N	-1	3	336.392	1.058	20	5		EDBDHM
CC[C@@H](C)[C@@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)OC	ZINC000340389437	535671466	/nfs/dbraw/zinc/67/14/66/535671466.db2.gz	NKGYAFQSKKLCKN-BXKDBHETSA-N	-1	3	344.389	1.769	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)cc(CN[C@@H]2CCCS(=O)(=O)C2)c1[O-]	ZINC000754890178	578690894	/nfs/dbraw/zinc/69/08/94/578690894.db2.gz	NTBJIOKDXPRWHX-SNVBAGLBSA-N	-1	3	334.781	1.621	20	5		EDBDHM
Cc1nc2n(n1)C[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)CC2	ZINC000737488774	579097157	/nfs/dbraw/zinc/09/71/57/579097157.db2.gz	CYZICNKVVKJFHX-VIFPVBQESA-N	-1	3	341.335	1.102	20	5		EDBDHM
Cc1nc2n(n1)C[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)CC2	ZINC000737488774	579097158	/nfs/dbraw/zinc/09/71/58/579097158.db2.gz	CYZICNKVVKJFHX-VIFPVBQESA-N	-1	3	341.335	1.102	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1	ZINC000737488196	579097175	/nfs/dbraw/zinc/09/71/75/579097175.db2.gz	QTYCFBXONVEXNA-UHFFFAOYSA-N	-1	3	346.282	1.058	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1	ZINC000737488196	579097176	/nfs/dbraw/zinc/09/71/76/579097176.db2.gz	QTYCFBXONVEXNA-UHFFFAOYSA-N	-1	3	346.282	1.058	20	5		EDBDHM
CCOc1cc(C(=O)[N-]OC[C@@H]2CCOC2)c([N+](=O)[O-])cc1OC	ZINC000788117022	579226368	/nfs/dbraw/zinc/22/63/68/579226368.db2.gz	FTRNZPJJXGQHBJ-SNVBAGLBSA-N	-1	3	340.332	1.700	20	5		EDBDHM
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCc2nc[n-]c(=O)c2C1	ZINC000750566757	579771657	/nfs/dbraw/zinc/77/16/57/579771657.db2.gz	MKAFVHFXVGCNFW-UHFFFAOYSA-N	-1	3	329.316	1.013	20	5		EDBDHM
O=C(NCCNc1ccccc1[N+](=O)[O-])c1cc2n[n-]nc2cc1F	ZINC000753780392	579887229	/nfs/dbraw/zinc/88/72/29/579887229.db2.gz	IZERYBDEEPUEPS-UHFFFAOYSA-N	-1	3	344.306	1.847	20	5		EDBDHM
O=C(Nn1cc(Br)cn1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000765088773	580135029	/nfs/dbraw/zinc/13/50/29/580135029.db2.gz	WOJFDICZFPLEHX-UHFFFAOYSA-N	-1	3	328.082	1.038	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CC(=O)OCC2CC2)cc1[N+](=O)[O-]	ZINC000767748744	580198517	/nfs/dbraw/zinc/19/85/17/580198517.db2.gz	HTCBGMMGOLASFP-UHFFFAOYSA-N	-1	3	334.375	1.196	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)[C@@H](O)C(F)(F)F	ZINC000768881851	580223365	/nfs/dbraw/zinc/22/33/65/580223365.db2.gz	LIMVPMMLPYJSKA-POYBYMJQSA-N	-1	3	348.324	1.636	20	5		EDBDHM
Cc1cccc(S(=O)(=O)[N-]N=c2[nH]cccc2[N+](=O)[O-])c1F	ZINC000781561417	580552428	/nfs/dbraw/zinc/55/24/28/580552428.db2.gz	OSPNHGAXGJGHEB-UHFFFAOYSA-N	-1	3	326.309	1.743	20	5		EDBDHM
Cc1cccc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])c1F	ZINC000781561417	580552429	/nfs/dbraw/zinc/55/24/29/580552429.db2.gz	OSPNHGAXGJGHEB-UHFFFAOYSA-N	-1	3	326.309	1.743	20	5		EDBDHM
Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(-c2nnn[n-]2)c1	ZINC000786710865	580677420	/nfs/dbraw/zinc/67/74/20/580677420.db2.gz	MMZLMIFBNSLXON-UHFFFAOYSA-N	-1	3	325.288	1.609	20	5		EDBDHM
Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(-c2nn[n-]n2)c1	ZINC000786710865	580677421	/nfs/dbraw/zinc/67/74/21/580677421.db2.gz	MMZLMIFBNSLXON-UHFFFAOYSA-N	-1	3	325.288	1.609	20	5		EDBDHM
NC(=O)c1ccc(COC(=O)c2cccc3nn[n-]c32)c([N+](=O)[O-])c1	ZINC000790075464	580761714	/nfs/dbraw/zinc/76/17/14/580761714.db2.gz	XFXQZPHMENAKGI-UHFFFAOYSA-N	-1	3	341.283	1.322	20	5		EDBDHM
NC(=O)c1ccc(COC(=O)c2cccc3[n-]nnc32)c([N+](=O)[O-])c1	ZINC000790075464	580761715	/nfs/dbraw/zinc/76/17/15/580761715.db2.gz	XFXQZPHMENAKGI-UHFFFAOYSA-N	-1	3	341.283	1.322	20	5		EDBDHM
NC(=O)c1ccc(COC(=O)c2cccc3n[n-]nc32)c([N+](=O)[O-])c1	ZINC000790075464	580761716	/nfs/dbraw/zinc/76/17/16/580761716.db2.gz	XFXQZPHMENAKGI-UHFFFAOYSA-N	-1	3	341.283	1.322	20	5		EDBDHM
O=C(NCc1ncccc1[O-])c1cc2nsnc2c([N+](=O)[O-])c1	ZINC000792609592	580823824	/nfs/dbraw/zinc/82/38/24/580823824.db2.gz	DZJYRUDCFRNXCM-UHFFFAOYSA-N	-1	3	331.313	1.630	20	5		EDBDHM
CC[C@H](C)COC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000796272492	580949736	/nfs/dbraw/zinc/94/97/36/580949736.db2.gz	CBQLOTSWFDBDDA-JTQLQIEISA-N	-1	3	330.362	1.462	20	5		EDBDHM
O=C([N-][C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000903032309	592103328	/nfs/dbraw/zinc/10/33/28/592103328.db2.gz	XPYKLILRCHBVBF-FHUSYTEZSA-N	-1	3	340.282	1.858	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@@H](C)OC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)on1	ZINC000838280741	593148950	/nfs/dbraw/zinc/14/89/50/593148950.db2.gz	GNOMMLRJBKFWFA-RNCFNFMXSA-N	-1	3	349.299	1.495	20	5		EDBDHM
CN(C)C(=O)Cn1ccc([N-]c2c([N+](=O)[O-])cccc2[N+](=O)[O-])n1	ZINC000804502003	593420236	/nfs/dbraw/zinc/42/02/36/593420236.db2.gz	IVUCLNUKRPJTFT-UHFFFAOYSA-N	-1	3	334.292	1.531	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]Cc2cccc(CO)c2)cs1	ZINC000768845841	593442292	/nfs/dbraw/zinc/44/22/92/593442292.db2.gz	HNFIDELHFNQKDG-UHFFFAOYSA-N	-1	3	328.371	1.627	20	5		EDBDHM
CCCN1C[C@H](C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CC1=O	ZINC000817141590	593575695	/nfs/dbraw/zinc/57/56/95/593575695.db2.gz	MYGYHLIUGLFKLM-VIFPVBQESA-N	-1	3	347.418	1.193	20	5		EDBDHM
C[C@@](O)(CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)c1ccco1	ZINC000820467726	593820700	/nfs/dbraw/zinc/82/07/00/593820700.db2.gz	MICQFCNYDNOQIN-CYBMUJFWSA-N	-1	3	331.292	1.083	20	5		EDBDHM
C[C@@](O)(CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)c1ccco1	ZINC000820467726	593820701	/nfs/dbraw/zinc/82/07/01/593820701.db2.gz	MICQFCNYDNOQIN-CYBMUJFWSA-N	-1	3	331.292	1.083	20	5		EDBDHM
CN(C(=O)c1ccc([N+](=O)[O-])cn1)c1cccc(-c2nnn[n-]2)c1	ZINC000821574793	593866992	/nfs/dbraw/zinc/86/69/92/593866992.db2.gz	XJUYTJFBXYGBCQ-UHFFFAOYSA-N	-1	3	325.288	1.447	20	5		EDBDHM
CN(C(=O)c1ccc([N+](=O)[O-])cn1)c1cccc(-c2nn[n-]n2)c1	ZINC000821574793	593866994	/nfs/dbraw/zinc/86/69/94/593866994.db2.gz	XJUYTJFBXYGBCQ-UHFFFAOYSA-N	-1	3	325.288	1.447	20	5		EDBDHM
CCC[C@H](O)CNc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000821026987	593948906	/nfs/dbraw/zinc/94/89/06/593948906.db2.gz	JDLSIXXKPZOEIH-JTQLQIEISA-N	-1	3	343.347	1.896	20	5		EDBDHM
CCC[C@H](O)CNc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000821026987	593948908	/nfs/dbraw/zinc/94/89/08/593948908.db2.gz	JDLSIXXKPZOEIH-JTQLQIEISA-N	-1	3	343.347	1.896	20	5		EDBDHM
CC(C)c1nnc(CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])n1C	ZINC000824364934	593994787	/nfs/dbraw/zinc/99/47/87/593994787.db2.gz	WFBHAMVQELFZRN-UHFFFAOYSA-N	-1	3	343.351	1.639	20	5		EDBDHM
CC(C)c1nnc(CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])n1C	ZINC000824364934	593994788	/nfs/dbraw/zinc/99/47/88/593994788.db2.gz	WFBHAMVQELFZRN-UHFFFAOYSA-N	-1	3	343.351	1.639	20	5		EDBDHM
C[C@@]1(CCCO)CCCN1c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000824816339	594078955	/nfs/dbraw/zinc/07/89/55/594078955.db2.gz	CLJWGMKFCNCYAQ-HNNXBMFYSA-N	-1	3	332.364	1.906	20	5		EDBDHM
C[C@@]1(CCCO)CCCN1c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000824816339	594078956	/nfs/dbraw/zinc/07/89/56/594078956.db2.gz	CLJWGMKFCNCYAQ-HNNXBMFYSA-N	-1	3	332.364	1.906	20	5		EDBDHM
CCOC(=O)c1cnn(Cc2ccc([N+](=O)[O-])cc2)c1-c1nnn[n-]1	ZINC000825570694	594201974	/nfs/dbraw/zinc/20/19/74/594201974.db2.gz	NDKKEMOLJJEYCR-UHFFFAOYSA-N	-1	3	343.303	1.196	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N[C@@H]1CCc2c[nH]nc2C1	ZINC000823630521	594223144	/nfs/dbraw/zinc/22/31/44/594223144.db2.gz	ZJGRRLRLALGQFO-SNVBAGLBSA-N	-1	3	326.320	1.467	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N[C@@H]1CCc2c[nH]nc2C1	ZINC000823630521	594223145	/nfs/dbraw/zinc/22/31/45/594223145.db2.gz	ZJGRRLRLALGQFO-SNVBAGLBSA-N	-1	3	326.320	1.467	20	5		EDBDHM
CNC(=O)[C@@H]1CCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000826060190	594321037	/nfs/dbraw/zinc/32/10/37/594321037.db2.gz	IKROKTKBDJUFDC-KOLCDFICSA-N	-1	3	331.336	1.102	20	5		EDBDHM
CNC(=O)[C@@H]1CCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000826060190	594321039	/nfs/dbraw/zinc/32/10/39/594321039.db2.gz	IKROKTKBDJUFDC-KOLCDFICSA-N	-1	3	331.336	1.102	20	5		EDBDHM
Cc1ccc([C@@H](C)NCCN2CCN(C(=O)[O-])CC2)cc1[N+](=O)[O-]	ZINC000830256951	594363115	/nfs/dbraw/zinc/36/31/15/594363115.db2.gz	ODHBYHBXIGRMGK-CYBMUJFWSA-N	-1	3	336.392	1.849	20	5		EDBDHM
O=[N+]([O-])c1cnc2ccc(NCc3ccc(-c4nnn[n-]4)cc3)nn21	ZINC000826501115	594503378	/nfs/dbraw/zinc/50/33/78/594503378.db2.gz	ZUPWRJFSIYGWSE-UHFFFAOYSA-N	-1	3	337.303	1.430	20	5		EDBDHM
O=[N+]([O-])c1cnc2ccc(NCc3ccc(-c4nn[n-]n4)cc3)nn21	ZINC000826501115	594503379	/nfs/dbraw/zinc/50/33/79/594503379.db2.gz	ZUPWRJFSIYGWSE-UHFFFAOYSA-N	-1	3	337.303	1.430	20	5		EDBDHM
CN1CCN(C2CCN(C(=O)c3cccc([N+](=O)[O-])c3[O-])CC2)CC1	ZINC000827445715	594672952	/nfs/dbraw/zinc/67/29/52/594672952.db2.gz	WVORTDWZWRCPQL-UHFFFAOYSA-N	-1	3	348.403	1.152	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@H]([C@H](CO)C2CC2)C2CC2)cs1	ZINC000832232633	594736945	/nfs/dbraw/zinc/73/69/45/594736945.db2.gz	QFUYHGDDTSGHFL-YPMHNXCESA-N	-1	3	346.430	1.732	20	5		EDBDHM
CNC(=O)C[C@@H](C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl	ZINC000832483592	594753602	/nfs/dbraw/zinc/75/36/02/594753602.db2.gz	KMLSPLWLWCENCA-MRVPVSSYSA-N	-1	3	349.796	1.360	20	5		EDBDHM
C[C@H]1CN(CCC(=O)[O-])CCN1CCOc1cccc([N+](=O)[O-])c1	ZINC000833628195	594891496	/nfs/dbraw/zinc/89/14/96/594891496.db2.gz	CYDLFYGFQMDJAH-ZDUSSCGKSA-N	-1	3	337.376	1.454	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CC[C@](O)(C(F)(F)F)C1	ZINC000738360539	599118829	/nfs/dbraw/zinc/11/88/29/599118829.db2.gz	XWZMRLHDXLLZDN-LLVKDONJSA-N	-1	3	344.253	1.278	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CC[C@](O)(C(F)(F)F)C1	ZINC000738360539	599118831	/nfs/dbraw/zinc/11/88/31/599118831.db2.gz	XWZMRLHDXLLZDN-LLVKDONJSA-N	-1	3	344.253	1.278	20	5		EDBDHM
CC(C)[C@H](CO)O[N-]C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000836895048	595010522	/nfs/dbraw/zinc/01/05/22/595010522.db2.gz	BAOZUUOTLQFBLK-LBPRGKRZSA-N	-1	3	326.305	1.044	20	5		EDBDHM
COc1cc(C(=O)[N-]O[C@@H](CO)C(C)C)c([N+](=O)[O-])cc1OC	ZINC000836903102	595012955	/nfs/dbraw/zinc/01/29/55/595012955.db2.gz	XIVJMJKCGKYMED-ZDUSSCGKSA-N	-1	3	328.321	1.290	20	5		EDBDHM
Cn1cc2c(n1)CCC[C@@H]2[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000845928217	595098153	/nfs/dbraw/zinc/09/81/53/595098153.db2.gz	KSTKGGYPDLAZRF-LBPRGKRZSA-N	-1	3	337.361	1.079	20	5		EDBDHM
O=C([N-]CCCn1cncn1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848581317	595408105	/nfs/dbraw/zinc/40/81/05/595408105.db2.gz	OZLRHCUYXGWDNJ-UHFFFAOYSA-N	-1	3	341.274	1.364	20	5		EDBDHM
O=C([N-][C@H]1CCCCNC1=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848580539	595408437	/nfs/dbraw/zinc/40/84/37/595408437.db2.gz	XMKPIZWPJPNZGO-NSHDSACASA-N	-1	3	343.286	1.351	20	5		EDBDHM
CNC(=O)C[C@H](C)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848592184	595411926	/nfs/dbraw/zinc/41/19/26/595411926.db2.gz	RMEQWHNFCUXSOR-QMMMGPOBSA-N	-1	3	331.275	1.207	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])C(OC)OC	ZINC000849407485	595521894	/nfs/dbraw/zinc/52/18/94/595521894.db2.gz	SMRHYRMJVVCZQT-LLVKDONJSA-N	-1	3	332.378	1.412	20	5		EDBDHM
C[C@@H]1CN(CC[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000849429386	595525015	/nfs/dbraw/zinc/52/50/15/595525015.db2.gz	PCVKAPONPDUYDO-VHSXEESVSA-N	-1	3	349.434	1.044	20	5		EDBDHM
CCO/C=C\[C@@](O)(CNc1cc[n-]c(=O)c1[N+](=O)[O-])C(F)(F)F	ZINC000853624514	595836811	/nfs/dbraw/zinc/83/68/11/595836811.db2.gz	JEEYOQQZLHUHHL-VLWUPBBWSA-N	-1	3	337.254	1.951	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])nc1=N	ZINC000853659757	595848987	/nfs/dbraw/zinc/84/89/87/595848987.db2.gz	LMJOAFYDOICBOP-JTQLQIEISA-N	-1	3	333.308	1.386	20	5		EDBDHM
C[C@@H](O)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1Br	ZINC000123671392	596615089	/nfs/dbraw/zinc/61/50/89/596615089.db2.gz	PDROTFOCYNAPEN-ZCFIWIBFSA-N	-1	3	339.167	1.016	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@@H](O)c2ccccc2)cs1	ZINC000119804906	596742716	/nfs/dbraw/zinc/74/27/16/596742716.db2.gz	MPWZKICBMISGIK-LLVKDONJSA-N	-1	3	328.371	1.668	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@H](O)c2ccc(F)cc2)cs1	ZINC000119810287	596743498	/nfs/dbraw/zinc/74/34/98/596743498.db2.gz	LIKRKQLSQSFIQR-NSHDSACASA-N	-1	3	346.361	1.807	20	5		EDBDHM
C[C@@](O)(C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)c1ccsc1	ZINC000119838996	596749533	/nfs/dbraw/zinc/74/95/33/596749533.db2.gz	ZIBPSWJAXIYHKE-LLVKDONJSA-N	-1	3	348.427	1.904	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@H]2c2ccccn2)c(-c2nnn[n-]2)c1	ZINC000738368699	598499119	/nfs/dbraw/zinc/49/91/19/598499119.db2.gz	IWGBEPSUGSNNGB-ZDUSSCGKSA-N	-1	3	338.331	1.906	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@H]2c2ccccn2)c(-c2nn[n-]n2)c1	ZINC000738368699	598499120	/nfs/dbraw/zinc/49/91/20/598499120.db2.gz	IWGBEPSUGSNNGB-ZDUSSCGKSA-N	-1	3	338.331	1.906	20	5		EDBDHM
CCOCCO[C@H]1CCN(c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C1	ZINC000825604806	607543640	/nfs/dbraw/zinc/54/36/40/607543640.db2.gz	KWSKQIPZPVLWQB-LBPRGKRZSA-N	-1	3	348.363	1.407	20	5		EDBDHM
CCOCCO[C@H]1CCN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C1	ZINC000825604806	607543641	/nfs/dbraw/zinc/54/36/41/607543641.db2.gz	KWSKQIPZPVLWQB-LBPRGKRZSA-N	-1	3	348.363	1.407	20	5		EDBDHM
Cc1cocc1C(=O)N[C@@H]1[C@H]2CN(c3cc[n-]c(=O)c3[N+](=O)[O-])C[C@H]21	ZINC001060462922	695234622	/nfs/dbraw/zinc/23/46/22/695234622.db2.gz	DRQLHRPXKVUCBN-IWIIMEHWSA-N	-1	3	344.327	1.461	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]Cc1ccc(C(N)=O)cc1	ZINC000055972830	214351966	/nfs/dbraw/zinc/35/19/66/214351966.db2.gz	IOOOVMOMYSMQJM-UHFFFAOYSA-N	-1	3	349.368	1.481	20	5		EDBDHM
Nc1c(C(=O)Nc2nnc(C(F)(F)F)[n-]2)cc(F)cc1[N+](=O)[O-]	ZINC000102889506	219239024	/nfs/dbraw/zinc/23/90/24/219239024.db2.gz	CQQDJGWSKBFKLI-UHFFFAOYSA-N	-1	3	334.189	1.705	20	5		EDBDHM
Nc1c(C(=O)Nc2nc(C(F)(F)F)n[n-]2)cc(F)cc1[N+](=O)[O-]	ZINC000102889506	219239027	/nfs/dbraw/zinc/23/90/27/219239027.db2.gz	CQQDJGWSKBFKLI-UHFFFAOYSA-N	-1	3	334.189	1.705	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@H](C)[S@@](C)=O)c1C	ZINC000124005234	138322905	/nfs/dbraw/zinc/32/29/05/138322905.db2.gz	GAKVOMZFTZPQEQ-CWKPULSASA-N	-1	3	348.446	1.647	20	5		EDBDHM
Cc1c(C(=O)[N-]c2nncs2)nnn1-c1cccc([N+](=O)[O-])c1	ZINC000021216138	212216533	/nfs/dbraw/zinc/21/65/33/212216533.db2.gz	SAJOWGPBMSNTSQ-UHFFFAOYSA-N	-1	3	331.317	1.588	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCC[C@@H]1CCOC1	ZINC000452012914	305378283	/nfs/dbraw/zinc/37/82/83/305378283.db2.gz	GDYAQDUZFBOYEQ-GFCCVEGCSA-N	-1	3	328.390	1.998	20	5		EDBDHM
CCN1CCCC[C@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000111352688	220143576	/nfs/dbraw/zinc/14/35/76/220143576.db2.gz	XNRYYFBQGLUXHP-JTQLQIEISA-N	-1	3	333.435	1.809	20	5		EDBDHM
C[C@H](O)C[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000416400778	251065451	/nfs/dbraw/zinc/06/54/51/251065451.db2.gz	HRPLAZMLGPNDQU-LURJTMIESA-N	-1	3	328.268	1.273	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC(=O)NC(C)C)c1C	ZINC000119411856	221313452	/nfs/dbraw/zinc/31/34/52/221313452.db2.gz	ORSAKTRMRJELCB-UHFFFAOYSA-N	-1	3	329.378	1.015	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2(O)CCOCC2)c1C	ZINC000269844396	140005312	/nfs/dbraw/zinc/00/53/12/140005312.db2.gz	WMNINOSJEKNMEJ-UHFFFAOYSA-N	-1	3	344.389	1.031	20	5		EDBDHM
CCOC(=O)CC[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000270580753	140128003	/nfs/dbraw/zinc/12/80/03/140128003.db2.gz	WLSQZVWVPRWTCX-VIFPVBQESA-N	-1	3	348.352	1.744	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCCCC[C@@H]2O)cc1[N+](=O)[O-]	ZINC000344944847	143029546	/nfs/dbraw/zinc/02/95/46/143029546.db2.gz	DJEJIRLZWVHCEM-KOLCDFICSA-N	-1	3	334.419	1.937	20	5		EDBDHM
CN(C)c1nc(-c2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)cc(=O)[n-]1	ZINC000345660768	143117834	/nfs/dbraw/zinc/11/78/34/143117834.db2.gz	JCZVSCUGCGVJEN-UHFFFAOYSA-N	-1	3	343.303	1.456	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)c1ccn(C)n1	ZINC000416562091	304332163	/nfs/dbraw/zinc/33/21/63/304332163.db2.gz	PDJSPUIJBUAKCS-VIFPVBQESA-N	-1	3	340.361	1.376	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)N1CCCC1	ZINC000353160403	149306919	/nfs/dbraw/zinc/30/69/19/149306919.db2.gz	DGXKPLZSAZPROY-SECBINFHSA-N	-1	3	345.352	1.023	20	5		EDBDHM
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1cc([O-])ccc1[N+](=O)[O-]	ZINC000354922331	150034043	/nfs/dbraw/zinc/03/40/43/150034043.db2.gz	ZYPDCARLYQGEAK-LBPRGKRZSA-N	-1	3	336.392	1.056	20	5		EDBDHM
O=C(NCc1nnc(C(F)(F)F)[n-]1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000360838134	152225279	/nfs/dbraw/zinc/22/52/79/152225279.db2.gz	AXKMSZOXHOQVSH-UHFFFAOYSA-N	-1	3	333.201	1.801	20	5		EDBDHM
O=C(NCc1n[n-]c(C(F)(F)F)n1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000360838134	152225281	/nfs/dbraw/zinc/22/52/81/152225281.db2.gz	AXKMSZOXHOQVSH-UHFFFAOYSA-N	-1	3	333.201	1.801	20	5		EDBDHM
O=C(NCc1nc(C(F)(F)F)n[n-]1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000360838134	152225283	/nfs/dbraw/zinc/22/52/83/152225283.db2.gz	AXKMSZOXHOQVSH-UHFFFAOYSA-N	-1	3	333.201	1.801	20	5		EDBDHM
Cc1nc(C)c(CC(=O)NCCc2cccc([N+](=O)[O-])c2)c(=O)[n-]1	ZINC000089302623	287319868	/nfs/dbraw/zinc/31/98/68/287319868.db2.gz	VDQPXGPYWWQCFF-UHFFFAOYSA-N	-1	3	330.344	1.196	20	5		EDBDHM
CC[C@@]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)(C(N)=O)C(C)C	ZINC000126847027	287428741	/nfs/dbraw/zinc/42/87/41/287428741.db2.gz	OIWCNWFSFOATSA-LBPRGKRZSA-N	-1	3	349.434	1.533	20	5		EDBDHM
O=C(Nc1ccn(Cc2ccncc2)n1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000193499382	272994732	/nfs/dbraw/zinc/99/47/32/272994732.db2.gz	WDVCFXZXIIILHU-UHFFFAOYSA-N	-1	3	340.299	1.588	20	5		EDBDHM
CCS(=O)(=O)[N-]Cc1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1	ZINC000273721231	268077911	/nfs/dbraw/zinc/07/79/11/268077911.db2.gz	JIRDMQRPYFOKHS-UHFFFAOYSA-N	-1	3	326.334	1.393	20	5		EDBDHM
Cc1nc(C(C)(C)[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)no1	ZINC000273652368	273049311	/nfs/dbraw/zinc/04/93/11/273049311.db2.gz	UOQYXSIYTYEXON-UHFFFAOYSA-N	-1	3	326.334	1.500	20	5		EDBDHM
O=C([N-]C1(CO)CCOCC1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000273978922	273064152	/nfs/dbraw/zinc/06/41/52/273064152.db2.gz	KNVFEPDTDZTJII-UHFFFAOYSA-N	-1	3	330.287	1.344	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1CCCCC1	ZINC000276251068	273155396	/nfs/dbraw/zinc/15/53/96/273155396.db2.gz	RZMBBTPYZDPPQZ-UHFFFAOYSA-N	-1	3	342.373	1.992	20	5		EDBDHM
O=C1[N-]C(=O)[C@@]2(CCCN(c3ccc4ncccc4c3[N+](=O)[O-])C2)N1	ZINC000279084976	273279361	/nfs/dbraw/zinc/27/93/61/273279361.db2.gz	MZMBMJLZGIKYNE-INIZCTEOSA-N	-1	3	341.327	1.321	20	5		EDBDHM
C[C@H]1NC(=O)CC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000282536409	273672287	/nfs/dbraw/zinc/67/22/87/273672287.db2.gz	MTVKPEVQCSICLZ-XCBNKYQSSA-N	-1	3	347.780	1.194	20	5		EDBDHM
O=c1[n-]cnc2c1CN(c1nc(-c3ccc([N+](=O)[O-])cc3)no1)CC2	ZINC000357663805	275034809	/nfs/dbraw/zinc/03/48/09/275034809.db2.gz	RZUZYOSYEAINES-UHFFFAOYSA-N	-1	3	340.299	1.703	20	5		EDBDHM
CC1(C)CC[C@@H]1[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000286565369	288035700	/nfs/dbraw/zinc/03/57/00/288035700.db2.gz	DOUKWVTUJRRXQG-ZDUSSCGKSA-N	-1	3	342.373	1.833	20	5		EDBDHM
CC[C@H](C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)OC	ZINC000289678200	288758228	/nfs/dbraw/zinc/75/82/28/288758228.db2.gz	WYNUQORROFOCMB-SECBINFHSA-N	-1	3	346.361	1.069	20	5		EDBDHM
CCC[C@@H](C)C(=O)NCCNCc1cc(OC)c([O-])cc1[N+](=O)[O-]	ZINC000292606759	289393957	/nfs/dbraw/zinc/39/39/57/289393957.db2.gz	HTUFERMYVZZDJM-LLVKDONJSA-N	-1	3	339.392	1.951	20	5		EDBDHM
NC(=O)[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000420718171	304775424	/nfs/dbraw/zinc/77/54/24/304775424.db2.gz	NNLQIXYHVMBMLF-BDAKNGLRSA-N	-1	3	347.780	1.181	20	5		EDBDHM
C[C@H]1COCC[C@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000432322713	305091298	/nfs/dbraw/zinc/09/12/98/305091298.db2.gz	BZXMKYOCMVDAAT-WCBMZHEXSA-N	-1	3	334.781	1.952	20	5		EDBDHM
Cn1cc(Cl)c(C[N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)n1	ZINC000451804060	305370045	/nfs/dbraw/zinc/37/00/45/305370045.db2.gz	AGLUGUUDJRSNME-UHFFFAOYSA-N	-1	3	344.780	1.601	20	5		EDBDHM
CCC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)COC1	ZINC000451953946	305373744	/nfs/dbraw/zinc/37/37/44/305373744.db2.gz	VWCPVAKMFBWCFI-UHFFFAOYSA-N	-1	3	334.781	1.953	20	5		EDBDHM
C[C@@H](Cc1cnn(C)c1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000451959751	305374138	/nfs/dbraw/zinc/37/41/38/305374138.db2.gz	DMIIFVFVHUXYGA-VIFPVBQESA-N	-1	3	342.352	1.377	20	5		EDBDHM
Cc1ccccc1[C@@H](CO)[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000545465269	306085203	/nfs/dbraw/zinc/08/52/03/306085203.db2.gz	GTAQUXDNODOPMQ-OAHLLOKOSA-N	-1	3	336.369	1.915	20	5		EDBDHM
CC(=O)N1CCC(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000104764306	441206191	/nfs/dbraw/zinc/20/61/91/441206191.db2.gz	HKRDLDKITHJFEU-UHFFFAOYSA-N	-1	3	341.389	1.132	20	5		EDBDHM
CCOC(=O)C(C)(C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000066937896	441591661	/nfs/dbraw/zinc/59/16/61/441591661.db2.gz	IPLCHADCBOPWQZ-UHFFFAOYSA-N	-1	3	346.361	1.223	20	5		EDBDHM
O=c1[n-]c(Cn2cc([N+](=O)[O-])cn2)nc2c1cnn2-c1ccccc1	ZINC000077932044	441887824	/nfs/dbraw/zinc/88/78/24/441887824.db2.gz	NFJSEUWWCILGSZ-UHFFFAOYSA-N	-1	3	337.299	1.262	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H](C)N(C)C1CC1	ZINC000069129166	441895420	/nfs/dbraw/zinc/89/54/20/441895420.db2.gz	ISIBHNSMWPATRP-LLVKDONJSA-N	-1	3	327.406	1.664	20	5		EDBDHM
CCc1cc(=O)[n-]c(CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)n1	ZINC000160862005	441929915	/nfs/dbraw/zinc/92/99/15/441929915.db2.gz	NEPRVBNFHVNCRU-UHFFFAOYSA-N	-1	3	343.387	1.975	20	5		EDBDHM
C[C@]1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCCC[C@H]1O	ZINC000124806346	441955298	/nfs/dbraw/zinc/95/52/98/441955298.db2.gz	MOHAPAYESDVKQO-ZIAGYGMSSA-N	-1	3	346.380	1.953	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H]1CCO[C@H](C2CC2)C1	ZINC000162658588	442112207	/nfs/dbraw/zinc/11/22/07/442112207.db2.gz	WPLBAOIUYACVIH-AAEUAGOBSA-N	-1	3	326.374	1.831	20	5		EDBDHM
O=C(NCCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C1CCC1	ZINC000176913518	442272433	/nfs/dbraw/zinc/27/24/33/442272433.db2.gz	WNULRGFXNDSRFG-UHFFFAOYSA-N	-1	3	341.389	1.180	20	5		EDBDHM
CNC(=O)[C@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(C)C	ZINC000178928562	442528629	/nfs/dbraw/zinc/52/86/29/442528629.db2.gz	FCTQHAMNAVJHBU-CYBMUJFWSA-N	-1	3	343.405	1.261	20	5		EDBDHM
CC(C)(CC(N)=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000186711169	442598164	/nfs/dbraw/zinc/59/81/64/442598164.db2.gz	QTVFPIHRDRDRIT-UHFFFAOYSA-N	-1	3	335.769	1.181	20	5		EDBDHM
O=c1[n-]c(SCCOc2cccc([N+](=O)[O-])c2)nc2[nH]ncc21	ZINC000192450279	442647575	/nfs/dbraw/zinc/64/75/75/442647575.db2.gz	HKJFOADRUJEDLK-UHFFFAOYSA-N	-1	3	333.329	1.726	20	5		EDBDHM
O=C(NC[C@@H](c1ccco1)N1CCCC1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000193331359	442733814	/nfs/dbraw/zinc/73/38/14/442733814.db2.gz	QIIKOOFDHDYCSS-ZDUSSCGKSA-N	-1	3	346.343	1.855	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H]2CC[C@@H](O)C2)cc1C	ZINC000188356690	442742875	/nfs/dbraw/zinc/74/28/75/442742875.db2.gz	RUPBDMQXJFEEQN-VXGBXAGGSA-N	-1	3	328.390	1.651	20	5		EDBDHM
O=C(Nc1cnn(Cc2ccccn2)c1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000195229357	442999659	/nfs/dbraw/zinc/99/96/59/442999659.db2.gz	AJKKUXCSHXTJET-UHFFFAOYSA-N	-1	3	340.299	1.588	20	5		EDBDHM
C[C@@H](CCO)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000296172458	318670797	/nfs/dbraw/zinc/67/07/97/318670797.db2.gz	LCEORXBUJQPDRJ-SECBINFHSA-N	-1	3	336.797	1.935	20	5		EDBDHM
CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1[n-]nnc1C(N)=O	ZINC000410857717	319161861	/nfs/dbraw/zinc/16/18/61/319161861.db2.gz	ITAWDEAPFZXGTD-SECBINFHSA-N	-1	3	332.320	1.019	20	5		EDBDHM
CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nn[n-]c1C(N)=O	ZINC000410857717	319161862	/nfs/dbraw/zinc/16/18/62/319161862.db2.gz	ITAWDEAPFZXGTD-SECBINFHSA-N	-1	3	332.320	1.019	20	5		EDBDHM
CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1n[n-]nc1C(N)=O	ZINC000410857717	319161864	/nfs/dbraw/zinc/16/18/64/319161864.db2.gz	ITAWDEAPFZXGTD-SECBINFHSA-N	-1	3	332.320	1.019	20	5		EDBDHM
CN(CC(=O)N1CCc2nc[n-]c(=O)c2C1)c1ccccc1[N+](=O)[O-]	ZINC000269662029	443385076	/nfs/dbraw/zinc/38/50/76/443385076.db2.gz	DBFLRASILFNUAH-UHFFFAOYSA-N	-1	3	343.343	1.112	20	5		EDBDHM
Cc1noc([C@H](C)[N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)n1	ZINC000443751481	320111903	/nfs/dbraw/zinc/11/19/03/320111903.db2.gz	AUTHAOYDWFKLTD-QMMMGPOBSA-N	-1	3	326.334	1.467	20	5		EDBDHM
COc1ccc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)nc1	ZINC000443929917	320115288	/nfs/dbraw/zinc/11/52/88/320115288.db2.gz	UHPJSECTRXWQDP-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
COc1cc(N2CCC[C@H]2C[C@@]2(C)NC(=O)[N-]C2=O)ccc1[N+](=O)[O-]	ZINC000286279737	443682693	/nfs/dbraw/zinc/68/26/93/443682693.db2.gz	GVFNDVPCKAFEBL-MEDUHNTESA-N	-1	3	348.359	1.560	20	5		EDBDHM
CC1(CC[N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000280482252	443723642	/nfs/dbraw/zinc/72/36/42/443723642.db2.gz	NWHIRPGVJZEOKC-UHFFFAOYSA-N	-1	3	342.373	1.835	20	5		EDBDHM
CCCOC(=O)CC[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276787644	443827018	/nfs/dbraw/zinc/82/70/18/443827018.db2.gz	JBSQTUYGZXKWHW-UHFFFAOYSA-N	-1	3	344.389	1.833	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](C)Cn2cncn2)c1[N+](=O)[O-]	ZINC000276804027	443833439	/nfs/dbraw/zinc/83/34/39/443833439.db2.gz	LAZRALGHVXKCGL-NSHDSACASA-N	-1	3	339.377	1.170	20	5		EDBDHM
CCOc1ccc([N+](=O)[O-])cc1NC([O-])=NOCCCC(=O)OC	ZINC000288932955	444017380	/nfs/dbraw/zinc/01/73/80/444017380.db2.gz	VVGDNZYTMVAHIH-UHFFFAOYSA-N	-1	3	341.320	2.000	20	5		EDBDHM
CCOc1ccc([N+](=O)[O-])cc1NC(=O)[N-]OCCCC(=O)OC	ZINC000288932955	444017383	/nfs/dbraw/zinc/01/73/83/444017383.db2.gz	VVGDNZYTMVAHIH-UHFFFAOYSA-N	-1	3	341.320	2.000	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC(=O)NC(C)C)c1[N+](=O)[O-]	ZINC000189809753	533704927	/nfs/dbraw/zinc/70/49/27/533704927.db2.gz	MOZGACQOXKPXRK-UHFFFAOYSA-N	-1	3	329.378	1.015	20	5		EDBDHM
CN(C)CCOC1CCN(c2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1	ZINC000564456342	321132939	/nfs/dbraw/zinc/13/29/39/321132939.db2.gz	LYAZIYWEVSPJKJ-UHFFFAOYSA-N	-1	3	337.376	1.840	20	5		EDBDHM
CNc1nccc(C(=O)[N-]c2cc(C3(C)CCCC3)on2)c1[N+](=O)[O-]	ZINC000565432027	321186298	/nfs/dbraw/zinc/18/62/98/321186298.db2.gz	JRGDUOYAZIPTCO-UHFFFAOYSA-N	-1	3	345.359	1.947	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H](CO)C2CCCC2)c(F)c1	ZINC000289587205	444177258	/nfs/dbraw/zinc/17/72/58/444177258.db2.gz	QPONBCVGIAEEKN-LBPRGKRZSA-N	-1	3	332.353	1.563	20	5		EDBDHM
CC[C@H](C)[C@H]([N-]c1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C(N)=O	ZINC000302103222	444204147	/nfs/dbraw/zinc/20/41/47/444204147.db2.gz	VZSORHBKEYVYQS-RCOVLWMOSA-N	-1	3	335.407	1.372	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H]1CCC[C@@H](CO)C1	ZINC000323365737	444342905	/nfs/dbraw/zinc/34/29/05/444342905.db2.gz	YLMHUDPKAYWJGD-CHWSQXEVSA-N	-1	3	342.417	1.980	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCC[C@@]1(C)CO	ZINC000331164957	444426282	/nfs/dbraw/zinc/42/62/82/444426282.db2.gz	HLDLQPKDJSVRNB-KGLIPLIRSA-N	-1	3	344.389	1.433	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCCN(C)[C@@H]2C)cc1C	ZINC000343975631	444705031	/nfs/dbraw/zinc/70/50/31/444705031.db2.gz	IVNXAQOOGYYEPZ-CHWSQXEVSA-N	-1	3	341.433	1.973	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCC[C@@H]1F	ZINC000339117639	445040013	/nfs/dbraw/zinc/04/00/13/445040013.db2.gz	BHNXZMBHQUQKPS-WDEREUQCSA-N	-1	3	346.336	1.550	20	5		EDBDHM
Cc1nc(-c2ncccn2)sc1C(=O)[N-]c1c([N+](=O)[O-])cnn1C	ZINC000354463634	445248547	/nfs/dbraw/zinc/24/85/47/445248547.db2.gz	NNGISEFINOMCIN-UHFFFAOYSA-N	-1	3	345.344	1.803	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1ccc(F)cn1	ZINC000357165052	445462868	/nfs/dbraw/zinc/46/28/68/445462868.db2.gz	GQJPAXJWIJCQNQ-UHFFFAOYSA-N	-1	3	341.320	1.616	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCc2ncccc2[O-])c1C	ZINC000360013226	445528479	/nfs/dbraw/zinc/52/84/79/445528479.db2.gz	ZNLJHRSYYQXJKO-UHFFFAOYSA-N	-1	3	337.357	1.791	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCCN(C)C2=O)c1C	ZINC000360227308	445641442	/nfs/dbraw/zinc/64/14/42/445641442.db2.gz	JKZZUKSTSVGODA-NSHDSACASA-N	-1	3	341.389	1.111	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCOCC(F)F)cc1[N+](=O)[O-]	ZINC000349986429	445742323	/nfs/dbraw/zinc/74/23/23/445742323.db2.gz	XMJAGKZSQIJIPB-UHFFFAOYSA-N	-1	3	330.334	1.525	20	5		EDBDHM
Nc1ncc([N+](=O)[O-])cc1C(=O)[N-]c1nnc(-c2ccco2)s1	ZINC000350105510	445769234	/nfs/dbraw/zinc/76/92/34/445769234.db2.gz	OSVUZKCGEIWUPR-UHFFFAOYSA-N	-1	3	332.301	1.936	20	5		EDBDHM
O=C([O-])C1(NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCCC1	ZINC000583855645	326151702	/nfs/dbraw/zinc/15/17/02/326151702.db2.gz	UGWBJASLYNKYAS-UHFFFAOYSA-N	-1	3	342.373	1.356	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCN(C2CC2)C1	ZINC000354280475	446078200	/nfs/dbraw/zinc/07/82/00/446078200.db2.gz	FYCPVXZHSYGCOC-SNVBAGLBSA-N	-1	3	341.389	1.118	20	5		EDBDHM
Cn1cc2c(n1)CCC[C@H]2[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000366970702	446435689	/nfs/dbraw/zinc/43/56/89/446435689.db2.gz	UMTORZVRMCGMGX-GFCCVEGCSA-N	-1	3	336.373	1.684	20	5		EDBDHM
COC(=O)[C@H]1CN(C(=O)c2cc(C)[n-]c(=O)c2[N+](=O)[O-])C[C@@H]1C1CC1	ZINC000376486262	446527638	/nfs/dbraw/zinc/52/76/38/446527638.db2.gz	QVTRWGFBJVLPDZ-NEPJUHHUSA-N	-1	3	349.343	1.275	20	5		EDBDHM
O=[N+]([O-])c1ccc(CCS(=O)(=O)[N-][C@H]2CNCCC2(F)F)cc1	ZINC000420444675	446620357	/nfs/dbraw/zinc/62/03/57/446620357.db2.gz	MIOQXULSDKENDC-LBPRGKRZSA-N	-1	3	349.359	1.054	20	5		EDBDHM
COC(=O)c1cc([N-]C(=O)c2cc3n(n2)CCO3)cc([N+](=O)[O-])c1	ZINC000368270596	446750476	/nfs/dbraw/zinc/75/04/76/446750476.db2.gz	ZAONDNPIKZUNAW-UHFFFAOYSA-N	-1	3	332.272	1.223	20	5		EDBDHM
CC[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)CCO1	ZINC000420731572	446777542	/nfs/dbraw/zinc/77/75/42/446777542.db2.gz	SDPCOXCFWMUSOP-ZYHUDNBSSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1cc(C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)[n-]c(=O)n1	ZINC000444642669	447113630	/nfs/dbraw/zinc/11/36/30/447113630.db2.gz	JBAULSKXKMNSLR-UHFFFAOYSA-N	-1	3	328.288	1.205	20	5		EDBDHM
CN(C)C(=O)c1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000444824764	447138285	/nfs/dbraw/zinc/13/82/85/447138285.db2.gz	HQMSMMISSBWBIF-UHFFFAOYSA-N	-1	3	330.300	1.650	20	5		EDBDHM
COCC[C@]1([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCOC1	ZINC000445097858	447170015	/nfs/dbraw/zinc/17/00/15/447170015.db2.gz	YRYZFCGIOXDICA-ZDUSSCGKSA-N	-1	3	330.362	1.069	20	5		EDBDHM
CC[C@@H]1C[C@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC	ZINC000387954315	447474960	/nfs/dbraw/zinc/47/49/60/447474960.db2.gz	CCOXFXUPYDBQIQ-ZJUUUORDSA-N	-1	3	342.373	1.706	20	5		EDBDHM
CCN1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1=O	ZINC000451864883	447767677	/nfs/dbraw/zinc/76/76/77/447767677.db2.gz	JDOWDQPROTYWLB-MRVPVSSYSA-N	-1	3	347.780	1.147	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCN2CCCC2=O)c1C	ZINC000577498223	448314034	/nfs/dbraw/zinc/31/40/34/448314034.db2.gz	OLVJROCLNGUEFA-UHFFFAOYSA-N	-1	3	341.389	1.112	20	5		EDBDHM
CN(CCn1cc([N+](=O)[O-])cn1)Cc1ccc(OCC(=O)[O-])cc1	ZINC000517241919	448561269	/nfs/dbraw/zinc/56/12/69/448561269.db2.gz	WYJNSQCIRFXZRA-UHFFFAOYSA-N	-1	3	334.332	1.387	20	5		EDBDHM
CC(C)(C)c1ccc(NC(=O)CC[C@H]2NC(=O)[N-]C2=O)cc1[N+](=O)[O-]	ZINC000585750746	448755636	/nfs/dbraw/zinc/75/56/36/448755636.db2.gz	OCJJUUQXEGBCTB-LLVKDONJSA-N	-1	3	348.359	1.819	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCSCC(F)(F)F)nc1	ZINC000593571966	449081309	/nfs/dbraw/zinc/08/13/09/449081309.db2.gz	KCQUAWRUCYKGCO-UHFFFAOYSA-N	-1	3	345.324	1.564	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)COCC2CC2)c([N+](=O)[O-])c1	ZINC000593653706	449131490	/nfs/dbraw/zinc/13/14/90/449131490.db2.gz	IIFLAJAEOBLCOI-SNVBAGLBSA-N	-1	3	344.389	1.697	20	5		EDBDHM
C[C@H]1CC(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C[C@H](C)O1	ZINC000593592175	449094773	/nfs/dbraw/zinc/09/47/73/449094773.db2.gz	GSBIEQPJPGJOST-QWRGUYRKSA-N	-1	3	343.405	1.862	20	5		EDBDHM
COc1cccc([C@@H]2C[C@H]2[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)c1	ZINC000593608879	449106776	/nfs/dbraw/zinc/10/67/76/449106776.db2.gz	NPVFEWCKBPPIGI-UONOGXRCSA-N	-1	3	349.368	1.833	20	5		EDBDHM
COC(=O)[C@H](CC(C)(C)C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593613039	449108745	/nfs/dbraw/zinc/10/87/45/449108745.db2.gz	PTQMSIDPOPGQLZ-JTQLQIEISA-N	-1	3	345.377	1.246	20	5		EDBDHM
CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000590401546	449149027	/nfs/dbraw/zinc/14/90/27/449149027.db2.gz	MYQGYSYGFRJDDC-KBPBESRZSA-N	-1	3	335.360	1.236	20	5		EDBDHM
CCOc1cccc([N+](=O)[O-])c1C(=O)NCCCc1cc(=O)[nH][n-]1	ZINC000590549807	449185455	/nfs/dbraw/zinc/18/54/55/449185455.db2.gz	MLFUAJYGIXBCCP-UHFFFAOYSA-N	-1	3	334.332	1.379	20	5		EDBDHM
COCCCn1c(=O)[n-]nc1SCc1onc(C)c1[N+](=O)[O-]	ZINC000596018484	449318689	/nfs/dbraw/zinc/31/86/89/449318689.db2.gz	ZVBHQBKFYYUWGF-UHFFFAOYSA-N	-1	3	329.338	1.517	20	5		EDBDHM
CC[C@H](CN1CCCC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593557443	449347795	/nfs/dbraw/zinc/34/77/95/449347795.db2.gz	DYTWRYUJRWITGG-LLVKDONJSA-N	-1	3	328.394	1.143	20	5		EDBDHM
COC(=O)C(C)(C)n1cc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cn1	ZINC000598374334	449368861	/nfs/dbraw/zinc/36/88/61/449368861.db2.gz	VKLXFAKRPJEJMZ-UHFFFAOYSA-N	-1	3	349.303	1.052	20	5		EDBDHM
CS[C@@H]1CCC[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000593547237	449339101	/nfs/dbraw/zinc/33/91/01/449339101.db2.gz	PHDIXIOBEOLEKR-GXSJLCMTSA-N	-1	3	331.419	1.942	20	5		EDBDHM
CN(C)c1n[nH]c(C2CCN(c3cc[n-]c(=O)c3[N+](=O)[O-])CC2)n1	ZINC000596223696	449423652	/nfs/dbraw/zinc/42/36/52/449423652.db2.gz	UXBOYBAPLQRCNK-UHFFFAOYSA-N	-1	3	333.352	1.264	20	5		EDBDHM
O=C(c1cc(F)c[n-]c1=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000598686046	449543933	/nfs/dbraw/zinc/54/39/33/449543933.db2.gz	HKQZWOJWWXSMBD-SNVBAGLBSA-N	-1	3	347.306	1.556	20	5		EDBDHM
CC(C)(C)OC(=O)c1ccnc([N-]C(=O)c2n[nH]cc2[N+](=O)[O-])c1	ZINC000598747491	449579667	/nfs/dbraw/zinc/57/96/67/449579667.db2.gz	ZATZLTLFIMTUSI-UHFFFAOYSA-N	-1	3	333.304	1.921	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])N1CCCC[C@H]1C	ZINC000594748176	449664331	/nfs/dbraw/zinc/66/43/31/449664331.db2.gz	KVBZFWBIFFWWPH-NEPJUHHUSA-N	-1	3	342.421	1.531	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-][C@@H]1CCCOC1	ZINC000594754246	449669952	/nfs/dbraw/zinc/66/99/52/449669952.db2.gz	JXOVXGGHIPHLIB-SNVBAGLBSA-N	-1	3	337.357	1.600	20	5		EDBDHM
C[C@@H](CCO)C[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594756763	449672372	/nfs/dbraw/zinc/67/23/72/449672372.db2.gz	IRXNLNIIJYPYNC-JTQLQIEISA-N	-1	3	339.373	1.440	20	5		EDBDHM
CC(C)(C)N1CC[C@@H]1C[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000594788803	449697042	/nfs/dbraw/zinc/69/70/42/449697042.db2.gz	GKWPMIFLEABYEU-SNVBAGLBSA-N	-1	3	328.394	1.141	20	5		EDBDHM
CO[C@H](C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000594790730	449700690	/nfs/dbraw/zinc/70/06/90/449700690.db2.gz	GYTHCODGJXEMLV-WCQYABFASA-N	-1	3	344.389	1.233	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2C[C@H](O)C23CCC3)cc1[N+](=O)[O-]	ZINC000594865539	449779461	/nfs/dbraw/zinc/77/94/61/449779461.db2.gz	UUSKESAIKKMABG-ZJUUUORDSA-N	-1	3	332.403	1.547	20	5		EDBDHM
CCN(CC)[C@@H](C)C[N-]S(=O)(=O)c1cc(C)sc1[N+](=O)[O-]	ZINC000601303298	449813000	/nfs/dbraw/zinc/81/30/00/449813000.db2.gz	DJSBBWDURPFYEZ-VIFPVBQESA-N	-1	3	335.451	1.973	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@H]2CCCN2C)c(F)cc1[N+](=O)[O-]	ZINC000601319856	449829369	/nfs/dbraw/zinc/82/93/69/449829369.db2.gz	JGHAQTRBGAKUBN-JTQLQIEISA-N	-1	3	331.369	1.415	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@]23C[C@@H]2COC3(C)C)c([N+](=O)[O-])c1	ZINC000599397302	449943070	/nfs/dbraw/zinc/94/30/70/449943070.db2.gz	OUMUQAFLQJGKHJ-OTYXRUKQSA-N	-1	3	342.373	1.449	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@H]2CCN(C)C2)c(F)cc1[N+](=O)[O-]	ZINC000601434795	449955851	/nfs/dbraw/zinc/95/58/51/449955851.db2.gz	VRFDGZLQINRNQL-SNVBAGLBSA-N	-1	3	331.369	1.272	20	5		EDBDHM
CCCN1CC[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000595353332	450067398	/nfs/dbraw/zinc/06/73/98/450067398.db2.gz	FKYGXNRMUKMUMI-SNVBAGLBSA-N	-1	3	331.369	1.497	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)c2nccn2C)cc1C	ZINC000595384542	450099229	/nfs/dbraw/zinc/09/92/29/450099229.db2.gz	WUZPTDLBAUCBOX-NSHDSACASA-N	-1	3	338.389	1.985	20	5		EDBDHM
CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000597695083	450203341	/nfs/dbraw/zinc/20/33/41/450203341.db2.gz	PWASCSRSMLGOHR-KBPBESRZSA-N	-1	3	335.360	1.236	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)C[C@@H]1CCOC1	ZINC000610739744	450317585	/nfs/dbraw/zinc/31/75/85/450317585.db2.gz	NOCAHLRNDIVODE-MNOVXSKESA-N	-1	3	344.389	1.697	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](C)c1nc(C)no1	ZINC000619480580	450485500	/nfs/dbraw/zinc/48/55/00/450485500.db2.gz	AKUJPDODYFOKOU-SSDOTTSWSA-N	-1	3	342.333	1.334	20	5		EDBDHM
C/C=C/C[C@H](CO)[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000619497307	450492543	/nfs/dbraw/zinc/49/25/43/450492543.db2.gz	FUSKIKYJYFESPD-HMDXOVGESA-N	-1	3	330.362	1.209	20	5		EDBDHM
C[C@H]1CCN(CC[N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000524790481	486871948	/nfs/dbraw/zinc/87/19/48/486871948.db2.gz	UZWPFSMEUFAJKJ-JTQLQIEISA-N	-1	3	331.369	1.354	20	5		EDBDHM
CC[S@](=O)CC[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000733899310	578787791	/nfs/dbraw/zinc/78/77/91/578787791.db2.gz	FRPNVUMMGDMKCB-FQEVSTJZSA-N	-1	3	334.419	1.259	20	5		EDBDHM
C[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)[C@H](C)N1CCOCC1	ZINC000736139722	578956422	/nfs/dbraw/zinc/95/64/22/578956422.db2.gz	QTKOQTQGUPDQLS-QWRGUYRKSA-N	-1	3	347.379	1.296	20	5		EDBDHM
C[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)[C@H](C)N1CCOCC1	ZINC000736139722	578956423	/nfs/dbraw/zinc/95/64/23/578956423.db2.gz	QTKOQTQGUPDQLS-QWRGUYRKSA-N	-1	3	347.379	1.296	20	5		EDBDHM
CCOC(=O)C1(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CCC1	ZINC000736590961	579004063	/nfs/dbraw/zinc/00/40/63/579004063.db2.gz	MUKNSPUQOHNZGW-UHFFFAOYSA-N	-1	3	347.335	1.315	20	5		EDBDHM
CCOC(=O)C1(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CCC1	ZINC000736590961	579004064	/nfs/dbraw/zinc/00/40/64/579004064.db2.gz	MUKNSPUQOHNZGW-UHFFFAOYSA-N	-1	3	347.335	1.315	20	5		EDBDHM
Cc1cc(C)n(C2CN(c3ccc(-c4nnn[n-]4)cc3[N+](=O)[O-])C2)n1	ZINC000737257407	579060580	/nfs/dbraw/zinc/06/05/80/579060580.db2.gz	RWUIDTDQQUCQCX-UHFFFAOYSA-N	-1	3	340.347	1.650	20	5		EDBDHM
Cc1cc(C)n(C2CN(c3ccc(-c4nn[n-]n4)cc3[N+](=O)[O-])C2)n1	ZINC000737257407	579060581	/nfs/dbraw/zinc/06/05/81/579060581.db2.gz	RWUIDTDQQUCQCX-UHFFFAOYSA-N	-1	3	340.347	1.650	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccccc1-c1nnn[n-]1	ZINC000737488889	579097278	/nfs/dbraw/zinc/09/72/78/579097278.db2.gz	ZPFMBWIOXFDPAW-UHFFFAOYSA-N	-1	3	342.319	1.309	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccccc1-c1nn[n-]n1	ZINC000737488889	579097280	/nfs/dbraw/zinc/09/72/80/579097280.db2.gz	ZPFMBWIOXFDPAW-UHFFFAOYSA-N	-1	3	342.319	1.309	20	5		EDBDHM
CC(C)(C)OC(=O)CC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768842573	580222051	/nfs/dbraw/zinc/22/20/51/580222051.db2.gz	NMCZJRXZXDAPIR-UHFFFAOYSA-N	-1	3	336.391	1.666	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)c(F)c(S(=O)(=O)[N-]CCc2nc[nH]n2)c1	ZINC000795878753	580940179	/nfs/dbraw/zinc/94/01/79/580940179.db2.gz	YLXWKJBGXRHDTR-UHFFFAOYSA-N	-1	3	349.731	1.026	20	5		EDBDHM
CC/C=C/CCOC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000796274187	580949750	/nfs/dbraw/zinc/94/97/50/580949750.db2.gz	KUUZVMDLMHOTAO-ONEGZZNKSA-N	-1	3	342.373	1.773	20	5		EDBDHM
COc1ccc(-n2c([O-])c3n(c2=O)CC(F)(F)C3)cc1[N+](=O)[O-]	ZINC000905441809	592535114	/nfs/dbraw/zinc/53/51/14/592535114.db2.gz	AQWYLBCUDDEWAV-VIFPVBQESA-N	-1	3	327.243	1.780	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@H]23)cc1C	ZINC000907766457	592783562	/nfs/dbraw/zinc/78/35/62/592783562.db2.gz	GVOIQENOWARIQB-LIIPTPMRSA-N	-1	3	338.385	1.666	20	5		EDBDHM
CCN1CCN(CCNc2ccc(CC(=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000910347416	592839592	/nfs/dbraw/zinc/83/95/92/592839592.db2.gz	XDPPHNRZZVQKDR-UHFFFAOYSA-N	-1	3	336.392	1.271	20	5		EDBDHM
CCn1cc(CN(C)c2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cn1	ZINC000736722560	593026244	/nfs/dbraw/zinc/02/62/44/593026244.db2.gz	PWQOWCAHZQVASH-UHFFFAOYSA-N	-1	3	329.324	1.023	20	5		EDBDHM
CCn1cc(CN(C)c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)cn1	ZINC000736722560	593026245	/nfs/dbraw/zinc/02/62/45/593026245.db2.gz	PWQOWCAHZQVASH-UHFFFAOYSA-N	-1	3	329.324	1.023	20	5		EDBDHM
COc1cc(OCC(=O)[N-]C2=NC[C@@H](C)S2)ccc1[N+](=O)[O-]	ZINC000819766943	593767733	/nfs/dbraw/zinc/76/77/33/593767733.db2.gz	QMBFAIDXYJKMHD-MRVPVSSYSA-N	-1	3	325.346	1.590	20	5		EDBDHM
CC(C)C[C@H](CCO)CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820056198	593787050	/nfs/dbraw/zinc/78/70/50/593787050.db2.gz	NNCVTCRCXABPHH-JTQLQIEISA-N	-1	3	335.368	1.627	20	5		EDBDHM
CC(C)C[C@H](CCO)CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820056198	593787051	/nfs/dbraw/zinc/78/70/51/593787051.db2.gz	NNCVTCRCXABPHH-JTQLQIEISA-N	-1	3	335.368	1.627	20	5		EDBDHM
C[C@@H](CCCO)Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820243061	593802233	/nfs/dbraw/zinc/80/22/33/593802233.db2.gz	UUFDVDJPCCVLHF-VIFPVBQESA-N	-1	3	343.347	1.896	20	5		EDBDHM
C[C@@H](CCCO)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820243061	593802234	/nfs/dbraw/zinc/80/22/34/593802234.db2.gz	UUFDVDJPCCVLHF-VIFPVBQESA-N	-1	3	343.347	1.896	20	5		EDBDHM
O=C([O-])CN1CCC[C@H]1COC(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000821531197	593856094	/nfs/dbraw/zinc/85/60/94/593856094.db2.gz	KENPDJDSUNNZLD-JTQLQIEISA-N	-1	3	342.735	1.954	20	5		EDBDHM
COc1ccc([N+](=O)[O-])c(C(=O)OC[C@H]2CCCN2CC(=O)[O-])c1	ZINC000820853036	593905555	/nfs/dbraw/zinc/90/55/55/593905555.db2.gz	AMQLCFOZKPZEHL-SNVBAGLBSA-N	-1	3	338.316	1.309	20	5		EDBDHM
O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc(F)cc1-c1nnn[n-]1	ZINC000822986859	594132198	/nfs/dbraw/zinc/13/21/98/594132198.db2.gz	MHQQAIQGRQVCFK-UHFFFAOYSA-N	-1	3	346.282	1.139	20	5		EDBDHM
O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc(F)cc1-c1nn[n-]n1	ZINC000822986859	594132199	/nfs/dbraw/zinc/13/21/99/594132199.db2.gz	MHQQAIQGRQVCFK-UHFFFAOYSA-N	-1	3	346.282	1.139	20	5		EDBDHM
CCN(C(=O)c1ccc([N+](=O)[O-])cn1)c1ccc(-c2nnn[n-]2)cc1	ZINC000825386150	594177001	/nfs/dbraw/zinc/17/70/01/594177001.db2.gz	ZEEIRBQFHDYXST-UHFFFAOYSA-N	-1	3	339.315	1.837	20	5		EDBDHM
CCN(C(=O)c1ccc([N+](=O)[O-])cn1)c1ccc(-c2nn[n-]n2)cc1	ZINC000825386150	594177002	/nfs/dbraw/zinc/17/70/02/594177002.db2.gz	ZEEIRBQFHDYXST-UHFFFAOYSA-N	-1	3	339.315	1.837	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCCOC[C@@H]2CCCO2)c(-c2nnn[n-]2)c1	ZINC000823639945	594223951	/nfs/dbraw/zinc/22/39/51/594223951.db2.gz	MZINFFITHFQGHS-LBPRGKRZSA-N	-1	3	348.363	1.773	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCCOC[C@@H]2CCCO2)c(-c2nn[n-]n2)c1	ZINC000823639945	594223952	/nfs/dbraw/zinc/22/39/52/594223952.db2.gz	MZINFFITHFQGHS-LBPRGKRZSA-N	-1	3	348.363	1.773	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C[C@H](C)N(C)C)cc1[N+](=O)[O-]	ZINC000832405766	594748149	/nfs/dbraw/zinc/74/81/49/594748149.db2.gz	MQOSHMCKRRIEIE-VIFPVBQESA-N	-1	3	335.813	1.785	20	5		EDBDHM
O=C([O-])N[C@@H]1CCC[C@@H]2CN(C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC000834186806	595046359	/nfs/dbraw/zinc/04/63/59/595046359.db2.gz	KSLVOIHYVYGNDQ-DTZQCDIJSA-N	-1	3	349.387	1.996	20	5		EDBDHM
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC[C@@H]2CN3CCC[C@@H]3CO2)n1	ZINC000844208176	595302587	/nfs/dbraw/zinc/30/25/87/595302587.db2.gz	JWZHDVQRQBLQMS-GHMZBOCLSA-N	-1	3	336.348	1.272	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H](CO)C2CCC2)cc1[N+](=O)[O-]	ZINC000849419256	595524013	/nfs/dbraw/zinc/52/40/13/595524013.db2.gz	HCVAFCWIXRQIJB-NSHDSACASA-N	-1	3	348.808	1.996	20	5		EDBDHM
COC(=O)[C@@H]1OCC[C@@H]1[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000855452724	595715256	/nfs/dbraw/zinc/71/52/56/595715256.db2.gz	ODTIUYJYLRQQRH-WDEREUQCSA-N	-1	3	344.270	1.133	20	5		EDBDHM
O=C(N1CCC(CNc2cc[n-]c(=O)c2[N+](=O)[O-])CC1)C(F)(F)F	ZINC000853431992	595750387	/nfs/dbraw/zinc/75/03/87/595750387.db2.gz	LZBXFPSIVDVGNT-UHFFFAOYSA-N	-1	3	348.281	1.908	20	5		EDBDHM
Cc1c(F)ccc([N+](=O)[O-])c1C(=O)[N-]OCCN1CCCC1=O	ZINC000856045183	595885106	/nfs/dbraw/zinc/88/51/06/595885106.db2.gz	MMOGKLGUWVWLSX-UHFFFAOYSA-N	-1	3	325.296	1.326	20	5		EDBDHM
Cc1c(Br)cc(C(=O)[N-]N2CCOC2=O)cc1[N+](=O)[O-]	ZINC000862701789	596391564	/nfs/dbraw/zinc/39/15/64/596391564.db2.gz	LDPKYWPZZHOZII-UHFFFAOYSA-N	-1	3	344.121	1.763	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2[C@@H]3OC[C@@H]4C[C@H]2C[C@@H]43)c(F)c1	ZINC000867614627	596461875	/nfs/dbraw/zinc/46/18/75/596461875.db2.gz	URDFZIAFSUEMEB-LIHPDXLKSA-N	-1	3	342.348	1.436	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](C)N2CCCC2)cc1F	ZINC000866490411	596892847	/nfs/dbraw/zinc/89/28/47/596892847.db2.gz	OQZQBNDSKAINGT-NSHDSACASA-N	-1	3	345.396	1.805	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@H](O)Cc2ccccc2)c(-c2nnn[n-]2)c1	ZINC000738370883	598797990	/nfs/dbraw/zinc/79/79/90/598797990.db2.gz	RLXADMQDXFPTSY-CYBMUJFWSA-N	-1	3	340.343	1.790	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@H](O)Cc2ccccc2)c(-c2nn[n-]n2)c1	ZINC000738370883	598797993	/nfs/dbraw/zinc/79/79/93/598797993.db2.gz	RLXADMQDXFPTSY-CYBMUJFWSA-N	-1	3	340.343	1.790	20	5		EDBDHM
CCN(C(=O)c1nn(C)cc1[N+](=O)[O-])c1ccc(-c2nnn[n-]2)cc1	ZINC000825390288	609588633	/nfs/dbraw/zinc/58/86/33/609588633.db2.gz	CHRFDOQKFHMGSK-UHFFFAOYSA-N	-1	3	342.319	1.175	20	5		EDBDHM
CCN(C(=O)c1nn(C)cc1[N+](=O)[O-])c1ccc(-c2nn[n-]n2)cc1	ZINC000825390288	609588634	/nfs/dbraw/zinc/58/86/34/609588634.db2.gz	CHRFDOQKFHMGSK-UHFFFAOYSA-N	-1	3	342.319	1.175	20	5		EDBDHM
O=c1[n-]nc(SCc2ccccc2[N+](=O)[O-])n1C[C@H]1CCCO1	ZINC000068901458	215344174	/nfs/dbraw/zinc/34/41/74/215344174.db2.gz	VKFBQZMTELEKJO-LLVKDONJSA-N	-1	3	336.373	1.951	20	5		EDBDHM
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2nnn[n-]2)cc1	ZINC000123594178	138319600	/nfs/dbraw/zinc/31/96/00/138319600.db2.gz	RRRKCRCWQVQCIW-UHFFFAOYSA-N	-1	3	340.299	1.792	20	5		EDBDHM
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2nn[n-]n2)cc1	ZINC000123594178	138319601	/nfs/dbraw/zinc/31/96/01/138319601.db2.gz	RRRKCRCWQVQCIW-UHFFFAOYSA-N	-1	3	340.299	1.792	20	5		EDBDHM
CN(C)Cc1cc(CNC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)ccc1F	ZINC000187097470	236116932	/nfs/dbraw/zinc/11/69/32/236116932.db2.gz	GVBADRZZZATEEQ-UHFFFAOYSA-N	-1	3	348.334	1.826	20	5		EDBDHM
CN1CCC([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000079247658	217202721	/nfs/dbraw/zinc/20/27/21/217202721.db2.gz	KIBBPAUHHFOROL-UHFFFAOYSA-N	-1	3	333.797	1.621	20	5		EDBDHM
Cn1[n-]c([C@H]2CCCN2C(=O)/C=C/c2cccc([N+](=O)[O-])c2)nc1=N	ZINC000493047533	255189819	/nfs/dbraw/zinc/18/98/19/255189819.db2.gz	LRJYANQEFKLBHX-SBDDDAINSA-N	-1	3	342.359	1.513	20	5		EDBDHM
Cc1ccc([C@H](O)C[N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)o1	ZINC000269764005	139988852	/nfs/dbraw/zinc/98/88/52/139988852.db2.gz	KNJJVTAXMVTNIW-CYBMUJFWSA-N	-1	3	340.357	1.649	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCCO1	ZINC000272095118	140399968	/nfs/dbraw/zinc/39/99/68/140399968.db2.gz	VTPHUUYJWYOWRZ-SKDRFNHKSA-N	-1	3	332.353	1.970	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@]1(C)CCCO1	ZINC000331336617	141008882	/nfs/dbraw/zinc/00/88/82/141008882.db2.gz	KOWWYRNCIHRNIM-ZDUSSCGKSA-N	-1	3	330.362	1.451	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CC[C@H](F)C1	ZINC000344907384	143025804	/nfs/dbraw/zinc/02/58/04/143025804.db2.gz	IFECTHIYLBFJCT-DTWKUNHWSA-N	-1	3	346.336	1.550	20	5		EDBDHM
Cn1ccc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)n1	ZINC000345505106	143099473	/nfs/dbraw/zinc/09/94/73/143099473.db2.gz	JWZHIEWYVQOJKZ-UHFFFAOYSA-N	-1	3	330.753	1.460	20	5		EDBDHM
CC(=O)Nc1ccncc1NC(=O)c1n[n-]c2ccc([N+](=O)[O-])cc21	ZINC000346516831	143212922	/nfs/dbraw/zinc/21/29/22/143212922.db2.gz	GGVKJZQSYTUIQB-UHFFFAOYSA-N	-1	3	340.299	1.499	20	5		EDBDHM
CCn1ccc(C[N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])n1	ZINC000416575779	304333138	/nfs/dbraw/zinc/33/31/38/304333138.db2.gz	BYEGAYQJIUFOOS-UHFFFAOYSA-N	-1	3	338.389	1.907	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[C@H](O)C(C)C	ZINC000416628928	304338323	/nfs/dbraw/zinc/33/83/23/304338323.db2.gz	SAAZEOLOLOZSDF-WCQYABFASA-N	-1	3	334.369	1.808	20	5		EDBDHM
Cc1cc([C@@H]2CCCN(C(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)C2)n[nH]1	ZINC000369737089	155156723	/nfs/dbraw/zinc/15/67/23/155156723.db2.gz	RCWMTIWMYFYXSN-SNVBAGLBSA-N	-1	3	331.332	1.747	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000355327552	150218768	/nfs/dbraw/zinc/21/87/68/150218768.db2.gz	RCLIWWRJHNCHMW-RKDXNWHRSA-N	-1	3	334.781	1.952	20	5		EDBDHM
O=C(Nc1cnn(C[C@H]2CCCO2)c1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000364467938	153246456	/nfs/dbraw/zinc/24/64/56/153246456.db2.gz	WLYQOMVNWLZWQL-LLVKDONJSA-N	-1	3	333.304	1.323	20	5		EDBDHM
CC1(C)C[C@H]1C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000352470231	162199003	/nfs/dbraw/zinc/19/90/03/162199003.db2.gz	IITJRFNYLGKVDN-VIFPVBQESA-N	-1	3	342.373	1.690	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CCC[C@H](C(N)=O)C1	ZINC000160225635	225365291	/nfs/dbraw/zinc/36/52/91/225365291.db2.gz	PNUXLEFWQXAEFK-QWRGUYRKSA-N	-1	3	341.389	1.226	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@H]2CCOC2)cc1[N+](=O)[O-]	ZINC000275271151	268311575	/nfs/dbraw/zinc/31/15/75/268311575.db2.gz	QJJMCEXYVJPFRK-MRVPVSSYSA-N	-1	3	334.325	1.057	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CSC1(C)C	ZINC000276358627	273163370	/nfs/dbraw/zinc/16/33/70/273163370.db2.gz	SRGNFIYPZPLFGO-NSHDSACASA-N	-1	3	332.403	1.776	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)c1ccco1	ZINC000155331690	287658385	/nfs/dbraw/zinc/65/83/85/287658385.db2.gz	MTDWCELQNMKFHH-CYBMUJFWSA-N	-1	3	340.357	1.995	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCCN(C)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000343982697	274116448	/nfs/dbraw/zinc/11/64/48/274116448.db2.gz	ORJPWIDAPGNQAH-ZYHUDNBSSA-N	-1	3	343.405	1.364	20	5		EDBDHM
Cc1cc(C(=O)N[C@H]2c3ccccc3C[C@H]2O)c([N+](=O)[O-])c(=O)[n-]1	ZINC000367175346	280365277	/nfs/dbraw/zinc/36/52/77/280365277.db2.gz	WLSWFLRWFWOBBO-OLZOCXBDSA-N	-1	3	329.312	1.392	20	5		EDBDHM
COCc1nnc(Sc2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])[n-]1	ZINC000288030938	288385911	/nfs/dbraw/zinc/38/59/11/288385911.db2.gz	WXZYYORSXYFMIX-UHFFFAOYSA-N	-1	3	339.333	1.501	20	5		EDBDHM
COCc1n[n-]c(Sc2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])n1	ZINC000288030938	288385912	/nfs/dbraw/zinc/38/59/12/288385912.db2.gz	WXZYYORSXYFMIX-UHFFFAOYSA-N	-1	3	339.333	1.501	20	5		EDBDHM
COCc1nc(Sc2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])n[n-]1	ZINC000288030938	288385913	/nfs/dbraw/zinc/38/59/13/288385913.db2.gz	WXZYYORSXYFMIX-UHFFFAOYSA-N	-1	3	339.333	1.501	20	5		EDBDHM
O=C1[N-]C(=O)[C@@]2(CCCN(c3c4ccccc4ncc3[N+](=O)[O-])C2)N1	ZINC000291985778	289232260	/nfs/dbraw/zinc/23/22/60/289232260.db2.gz	QEOJTKRMXZAXLO-INIZCTEOSA-N	-1	3	341.327	1.321	20	5		EDBDHM
CC1=C([O-])N(C)S(=O)(=O)N1Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000295480585	303225118	/nfs/dbraw/zinc/22/51/18/303225118.db2.gz	YQYGUJGXKHXBIJ-ZETCQYMHSA-N	-1	3	333.753	1.156	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]Cc2nnc(C(C)C)[nH]2)cc1[N+](=O)[O-]	ZINC000451680493	305361814	/nfs/dbraw/zinc/36/18/14/305361814.db2.gz	JNNWWDVXWUQLIP-UHFFFAOYSA-N	-1	3	345.406	1.685	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CC2=CCOCC2)cc1[N+](=O)[O-]	ZINC000451684574	305362109	/nfs/dbraw/zinc/36/21/09/305362109.db2.gz	VSURGUFWGGQTPC-UHFFFAOYSA-N	-1	3	346.336	1.368	20	5		EDBDHM
CO[C@@H]1COCC[C@@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000451780991	305368605	/nfs/dbraw/zinc/36/86/05/305368605.db2.gz	WTDPKSGUKFWLET-BXKDBHETSA-N	-1	3	348.352	1.064	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](C)C(=O)OC(C)C)c1[N+](=O)[O-]	ZINC000452013856	305378425	/nfs/dbraw/zinc/37/84/25/305378425.db2.gz	MTKAXFJIKITRKP-NSHDSACASA-N	-1	3	344.389	1.830	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCC[C@@H]2CCOC2)c(F)c1	ZINC000452016161	305378548	/nfs/dbraw/zinc/37/85/48/305378548.db2.gz	LCCQEOYGGUQHIP-SNVBAGLBSA-N	-1	3	332.353	1.829	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@H](O)C2CCC2)cc1[N+](=O)[O-]	ZINC000452045497	305379951	/nfs/dbraw/zinc/37/99/51/305379951.db2.gz	KQNCLKQQIPRINV-LBPRGKRZSA-N	-1	3	348.352	1.182	20	5		EDBDHM
CCO[C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000452061636	305381269	/nfs/dbraw/zinc/38/12/69/305381269.db2.gz	PUEZFZVTVWVAHY-VXGBXAGGSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)n[n-]1	ZINC000537580770	306027752	/nfs/dbraw/zinc/02/77/52/306027752.db2.gz	YDTGVLMNNJLARI-UHFFFAOYSA-N	-1	3	344.287	1.623	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[n-]n1	ZINC000537580770	306027753	/nfs/dbraw/zinc/02/77/53/306027753.db2.gz	YDTGVLMNNJLARI-UHFFFAOYSA-N	-1	3	344.287	1.623	20	5		EDBDHM
Cc1noc(C)c1C[N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000063199058	441317446	/nfs/dbraw/zinc/31/74/46/441317446.db2.gz	KKMXXBXYEFWIOJ-UHFFFAOYSA-N	-1	3	325.346	1.819	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@H]2CCC[C@@H](O)C2)cc1[N+](=O)[O-]	ZINC000124536256	441935215	/nfs/dbraw/zinc/93/52/15/441935215.db2.gz	SNWGZIMSSRIRCB-VHSXEESVSA-N	-1	3	334.419	1.794	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2cccc(F)c2C(=O)OC)n1	ZINC000191601292	442474044	/nfs/dbraw/zinc/47/40/44/442474044.db2.gz	GDWMMPVDAILLFG-UHFFFAOYSA-N	-1	3	336.279	1.989	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]Cc2ccco2)cc1[N+](=O)[O-]	ZINC000186167366	442476821	/nfs/dbraw/zinc/47/68/21/442476821.db2.gz	XLMRLALYIVTBKY-UHFFFAOYSA-N	-1	3	330.293	1.814	20	5		EDBDHM
CCc1ccc(C(=O)N2CCc3nc[n-]c(=O)c3C2)cc1[N+](=O)[O-]	ZINC000179046430	442559012	/nfs/dbraw/zinc/55/90/12/442559012.db2.gz	NVQUHWNDDJRBSB-UHFFFAOYSA-N	-1	3	328.328	1.439	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H]2CCCOC2)cc1C	ZINC000193815573	442792259	/nfs/dbraw/zinc/79/22/59/442792259.db2.gz	PFMUGLQVMMBSAD-LBPRGKRZSA-N	-1	3	328.390	1.917	20	5		EDBDHM
C[C@@H](CN1CCC[C@@H](C)C1)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000249180417	442958932	/nfs/dbraw/zinc/95/89/32/442958932.db2.gz	NBTZURGZISWNGR-OLZOCXBDSA-N	-1	3	341.433	1.994	20	5		EDBDHM
CCOc1cc([N+](=O)[O-])c(C(=O)[N-]OC(C)(C)CO)cc1OC	ZINC000297159620	318752956	/nfs/dbraw/zinc/75/29/56/318752956.db2.gz	JQXBIZFTXUMPNU-UHFFFAOYSA-N	-1	3	328.321	1.434	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCC1	ZINC000269477738	443319878	/nfs/dbraw/zinc/31/98/78/443319878.db2.gz	KPDNDVZXQJBRCE-UHFFFAOYSA-N	-1	3	348.764	1.622	20	5		EDBDHM
NC(=O)CC1(C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000420707469	319638167	/nfs/dbraw/zinc/63/81/67/319638167.db2.gz	TYVXSWQTLRVXIF-UHFFFAOYSA-N	-1	3	347.780	1.182	20	5		EDBDHM
Cn1cc([C@@H](O)C[N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)cn1	ZINC000272426155	443621758	/nfs/dbraw/zinc/62/17/58/443621758.db2.gz	YDXHTAUZOGRIMF-LBPRGKRZSA-N	-1	3	340.286	1.270	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCC[C@H]1C	ZINC000276194103	443666574	/nfs/dbraw/zinc/66/65/74/443666574.db2.gz	IKPAGSKWDGLWIS-BXKDBHETSA-N	-1	3	342.373	1.848	20	5		EDBDHM
C[C@H]([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC1	ZINC000281036404	443802137	/nfs/dbraw/zinc/80/21/37/443802137.db2.gz	IMHZYFFQWGAQEE-JTQLQIEISA-N	-1	3	341.314	1.814	20	5		EDBDHM
Cc1nc([C@@H](C)[N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])n[nH]1	ZINC000285290153	443929114	/nfs/dbraw/zinc/92/91/14/443929114.db2.gz	GHKKMRDXZSJHCW-SECBINFHSA-N	-1	3	339.377	1.678	20	5		EDBDHM
Cc1nnc([C@@H](C)[N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])[nH]1	ZINC000285290153	443929117	/nfs/dbraw/zinc/92/91/17/443929117.db2.gz	GHKKMRDXZSJHCW-SECBINFHSA-N	-1	3	339.377	1.678	20	5		EDBDHM
Cc1nc([C@H](C)[N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])n[nH]1	ZINC000285490542	444004137	/nfs/dbraw/zinc/00/41/37/444004137.db2.gz	WRVSAAPNAZWBTF-VIFPVBQESA-N	-1	3	339.377	1.678	20	5		EDBDHM
Cc1nnc([C@H](C)[N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])[nH]1	ZINC000285490542	444004142	/nfs/dbraw/zinc/00/41/42/444004142.db2.gz	WRVSAAPNAZWBTF-VIFPVBQESA-N	-1	3	339.377	1.678	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)c1nnc(C)[nH]1	ZINC000285408200	443973106	/nfs/dbraw/zinc/97/31/06/443973106.db2.gz	PJBFGOYWTGGMDH-SSDOTTSWSA-N	-1	3	341.349	1.069	20	5		EDBDHM
CCn1cc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)cn1	ZINC000285622448	444050939	/nfs/dbraw/zinc/05/09/39/444050939.db2.gz	NIYQOHFCUAWZKP-UHFFFAOYSA-N	-1	3	340.361	1.298	20	5		EDBDHM
CC[C@](C)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)OC	ZINC000299584313	444086534	/nfs/dbraw/zinc/08/65/34/444086534.db2.gz	DLXRJVJAVNIQPL-LBPRGKRZSA-N	-1	3	334.325	1.354	20	5		EDBDHM
CCN1CCN([C@@H](C)CNc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1	ZINC000565039038	321165506	/nfs/dbraw/zinc/16/55/06/321165506.db2.gz	ZUZMTJWFYXCTOD-LBPRGKRZSA-N	-1	3	336.392	1.731	20	5		EDBDHM
CN(CC(=O)N1CCc2c(=O)[n-]cnc2C1)c1ccccc1[N+](=O)[O-]	ZINC000575785199	321527238	/nfs/dbraw/zinc/52/72/38/321527238.db2.gz	WFUSFBTXBANYHX-UHFFFAOYSA-N	-1	3	343.343	1.112	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC2CCC(O)CC2)c(F)c1	ZINC000318429337	444319342	/nfs/dbraw/zinc/31/93/42/444319342.db2.gz	ABMNUNUCEJPOIK-UHFFFAOYSA-N	-1	3	332.353	1.563	20	5		EDBDHM
CCOC(=O)c1nc(C2CCN(c3ccncc3[N+](=O)[O-])CC2)n[n-]1	ZINC000340867747	444551271	/nfs/dbraw/zinc/55/12/71/444551271.db2.gz	ZQYAPUCZLUIIIE-UHFFFAOYSA-N	-1	3	346.347	1.669	20	5		EDBDHM
CCOC(=O)c1nnc(C2CCN(c3ccncc3[N+](=O)[O-])CC2)[n-]1	ZINC000340867747	444551272	/nfs/dbraw/zinc/55/12/72/444551272.db2.gz	ZQYAPUCZLUIIIE-UHFFFAOYSA-N	-1	3	346.347	1.669	20	5		EDBDHM
CCOC(=O)c1n[n-]c(C2CCN(c3ccncc3[N+](=O)[O-])CC2)n1	ZINC000340867747	444551278	/nfs/dbraw/zinc/55/12/78/444551278.db2.gz	ZQYAPUCZLUIIIE-UHFFFAOYSA-N	-1	3	346.347	1.669	20	5		EDBDHM
C[C@H]1CN(S(=O)(=O)[N-]c2cc(F)cc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000340960326	444599452	/nfs/dbraw/zinc/59/94/52/444599452.db2.gz	DPQXZEZGNBRWSI-IUCAKERBSA-N	-1	3	333.341	1.500	20	5		EDBDHM
Cc1ccc(S(=O)(=O)NCc2cnc(C)[n-]c2=O)c([N+](=O)[O-])c1	ZINC000344093450	444777991	/nfs/dbraw/zinc/77/79/91/444777991.db2.gz	RKOLBBJEZPCTNP-UHFFFAOYSA-N	-1	3	338.345	1.186	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](CO)CC2CC2)c1[N+](=O)[O-]	ZINC000616425933	450418349	/nfs/dbraw/zinc/41/83/49/450418349.db2.gz	LGMCUOMLTWLBHR-LBPRGKRZSA-N	-1	3	328.390	1.651	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc(=O)[n-]c(N(C)C)n1	ZINC000338770896	444845995	/nfs/dbraw/zinc/84/59/95/444845995.db2.gz	YIKLJKRAZSPTCK-UHFFFAOYSA-N	-1	3	347.331	1.095	20	5		EDBDHM
C[C@H](F)CC[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000339034216	444999199	/nfs/dbraw/zinc/99/91/99/444999199.db2.gz	QHLRSSDULHVEJU-QMMMGPOBSA-N	-1	3	334.325	1.392	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCC[C@H]2F)cc1[N+](=O)[O-]	ZINC000339121945	445041736	/nfs/dbraw/zinc/04/17/36/445041736.db2.gz	FYQIGURKOWYHKT-PSASIEDQSA-N	-1	3	336.316	1.911	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCN(C)[C@@H](C)C1	ZINC000360653043	445719627	/nfs/dbraw/zinc/71/96/27/445719627.db2.gz	NTMLZHMLVSKLNV-NWDGAFQWSA-N	-1	3	327.406	1.664	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H](C)c2ncnn2C)c([N+](=O)[O-])c1	ZINC000353850487	445784002	/nfs/dbraw/zinc/78/40/02/445784002.db2.gz	PVGYKKCOMOTJPO-VIFPVBQESA-N	-1	3	325.350	1.071	20	5		EDBDHM
CC[C@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCO1	ZINC000420718995	446767976	/nfs/dbraw/zinc/76/79/76/446767976.db2.gz	FWBSFHUDFVXSKT-ONGXEEELSA-N	-1	3	332.353	1.970	20	5		EDBDHM
CC(=O)N(C)c1ccccc1NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000444992199	447153838	/nfs/dbraw/zinc/15/38/38/447153838.db2.gz	NUSXUVBVYICYRH-UHFFFAOYSA-N	-1	3	330.300	1.930	20	5		EDBDHM
CC[C@H](C)[C@H](C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])OC	ZINC000451671195	447745343	/nfs/dbraw/zinc/74/53/43/447745343.db2.gz	FKJKQSYMFWZBIW-GWCFXTLKSA-N	-1	3	346.405	1.943	20	5		EDBDHM
CN(C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000572768172	448460390	/nfs/dbraw/zinc/46/03/90/448460390.db2.gz	WWDHZXUUNAUJBU-UHFFFAOYSA-N	-1	3	329.378	1.130	20	5		EDBDHM
O=C([O-])CCN(CCOc1ccc([N+](=O)[O-])cc1)C[C@H]1CCCO1	ZINC000567358956	448675323	/nfs/dbraw/zinc/67/53/23/448675323.db2.gz	CDNJDQITYCWGDF-OAHLLOKOSA-N	-1	3	338.360	1.929	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]([C@@H](CO)C2CC2)C2CC2)nc1	ZINC000593601855	449101147	/nfs/dbraw/zinc/10/11/47/449101147.db2.gz	QWFMPVNPWKKFRB-GXTWGEPZSA-N	-1	3	341.389	1.065	20	5		EDBDHM
O=[N+]([O-])c1ccc([O-])cc1CN[C@@H](C1CC1)C1(CO)CCOCC1	ZINC000590378435	449139378	/nfs/dbraw/zinc/13/93/78/449139378.db2.gz	IKKYJSPNIWNEKK-INIZCTEOSA-N	-1	3	336.388	1.958	20	5		EDBDHM
Cc1cccc([O-])c1C(=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000599996839	449142676	/nfs/dbraw/zinc/14/26/76/449142676.db2.gz	IXTGLYQOYLWBFR-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCN(C3CC3)C2)c(F)c1	ZINC000611107083	449170666	/nfs/dbraw/zinc/17/06/66/449170666.db2.gz	ZIPSOMDATVRXEZ-VIFPVBQESA-N	-1	3	329.353	1.249	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](CO)CC2CC2)c([N+](=O)[O-])c1	ZINC000611108102	449170834	/nfs/dbraw/zinc/17/08/34/449170834.db2.gz	YARBJKUTQGUGFJ-SNVBAGLBSA-N	-1	3	330.362	1.043	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2C[C@H]2Cc2ccccc2)nc1	ZINC000593551802	449343004	/nfs/dbraw/zinc/34/30/04/449343004.db2.gz	FJBKNHDIFVNBGY-OCCSQVGLSA-N	-1	3	333.369	1.899	20	5		EDBDHM
Cc1ccsc1[C@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593562356	449352293	/nfs/dbraw/zinc/35/22/93/449352293.db2.gz	TYXIEKDTGQAXIQ-JTQLQIEISA-N	-1	3	343.386	1.372	20	5		EDBDHM
C[C@@H]1CCC[C@H](C)N1CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593542039	449336297	/nfs/dbraw/zinc/33/62/97/449336297.db2.gz	DNDOCDUUWFHQDN-TXEJJXNPSA-N	-1	3	342.421	1.531	20	5		EDBDHM
COC[C@@H](C)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594743916	449662311	/nfs/dbraw/zinc/66/23/11/449662311.db2.gz	AKZNQOUDBGEBQC-SECBINFHSA-N	-1	3	325.346	1.456	20	5		EDBDHM
CO[C@@H](C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000594800816	449712209	/nfs/dbraw/zinc/71/22/09/449712209.db2.gz	LIWZKIKDDPNDNL-RISCZKNCSA-N	-1	3	344.389	1.066	20	5		EDBDHM
CN1CCC[C@@H](CC[N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])C1	ZINC000594783864	449693347	/nfs/dbraw/zinc/69/33/47/449693347.db2.gz	PAYKVPXGNZGRNA-NSHDSACASA-N	-1	3	328.394	1.000	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1C[C@H](O)C12CCC2	ZINC000594866250	449780286	/nfs/dbraw/zinc/78/02/86/449780286.db2.gz	UIKNHVSMYDPJCY-RYUDHWBXSA-N	-1	3	326.374	1.485	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2C[C@@H](O)C23CCC3)cc1C	ZINC000594866974	449782595	/nfs/dbraw/zinc/78/25/95/449782595.db2.gz	ZYXTUDQDMZJTMY-ZIAGYGMSSA-N	-1	3	340.401	1.793	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@H]2CCCCO2)c(F)cc1[N+](=O)[O-]	ZINC000601317998	449826561	/nfs/dbraw/zinc/82/65/61/449826561.db2.gz	GIMFHJBTJUKXDQ-JTQLQIEISA-N	-1	3	332.353	1.890	20	5		EDBDHM
COC1(C[N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)CCC1	ZINC000601388619	449903709	/nfs/dbraw/zinc/90/37/09/449903709.db2.gz	WWYNHABALSBHHM-UHFFFAOYSA-N	-1	3	332.353	1.890	20	5		EDBDHM
CO[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc3ncccc3c2[N+](=O)[O-])C1	ZINC000599511181	450033187	/nfs/dbraw/zinc/03/31/87/450033187.db2.gz	FJWZHGMCCKKITQ-MGCOHNPYSA-N	-1	3	337.357	1.599	20	5		EDBDHM
CCOC(=O)c1[n-]c(C)nc1NC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000610108944	450142251	/nfs/dbraw/zinc/14/22/51/450142251.db2.gz	QKWQOFXKOVLFJK-UHFFFAOYSA-N	-1	3	332.316	1.984	20	5		EDBDHM
CCOC(=O)c1nc(C)[n-]c1NC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000610108944	450142255	/nfs/dbraw/zinc/14/22/55/450142255.db2.gz	QKWQOFXKOVLFJK-UHFFFAOYSA-N	-1	3	332.316	1.984	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCN2CC[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000610409251	450210099	/nfs/dbraw/zinc/21/00/99/450210099.db2.gz	DVMXVZSOHWEJCZ-GFCCVEGCSA-N	-1	3	327.406	1.523	20	5		EDBDHM
Cc1ccc([C@H](C)NC(=O)CC[C@H]2NC(=O)[N-]C2=O)cc1[N+](=O)[O-]	ZINC000610599269	450270804	/nfs/dbraw/zinc/27/08/04/450270804.db2.gz	GIHAYXSCCOPOFY-GXSJLCMTSA-N	-1	3	334.332	1.069	20	5		EDBDHM
CCN1CC[C@H]([N-]c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1=O	ZINC000619794744	450336478	/nfs/dbraw/zinc/33/64/78/450336478.db2.gz	WXMLLLQNMOGEAT-ZETCQYMHSA-N	-1	3	333.391	1.093	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)C[C@@H]1CCOC1	ZINC000610739948	450317473	/nfs/dbraw/zinc/31/74/73/450317473.db2.gz	YAJBQWZCBURKJR-QWRGUYRKSA-N	-1	3	344.389	1.697	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)[n-]1	ZINC000619446299	450475829	/nfs/dbraw/zinc/47/58/29/450475829.db2.gz	DYPSDEGJWJDGNN-UHFFFAOYSA-N	-1	3	332.316	1.984	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)c[n-]1	ZINC000619446299	450475832	/nfs/dbraw/zinc/47/58/32/450475832.db2.gz	DYPSDEGJWJDGNN-UHFFFAOYSA-N	-1	3	332.316	1.984	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1ccn(C)c1	ZINC000619488928	450488251	/nfs/dbraw/zinc/48/82/51/450488251.db2.gz	PYWBYYYSWMNHEM-UHFFFAOYSA-N	-1	3	325.346	1.420	20	5		EDBDHM
C[C@@H](CO)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000159737771	534112325	/nfs/dbraw/zinc/11/23/25/534112325.db2.gz	OIEBUCQKAUEVBK-SSDOTTSWSA-N	-1	3	342.295	1.520	20	5		EDBDHM
COc1cc(C(=O)Nc2nnc(SCCO)[n-]2)ccc1[N+](=O)[O-]	ZINC000270863851	536539402	/nfs/dbraw/zinc/53/94/02/536539402.db2.gz	MIOHQXJRZDBREH-UHFFFAOYSA-N	-1	3	339.333	1.058	20	5		EDBDHM
COc1cc(C(=O)Nc2nc(SCCO)n[n-]2)ccc1[N+](=O)[O-]	ZINC000270863851	536539405	/nfs/dbraw/zinc/53/94/05/536539405.db2.gz	MIOHQXJRZDBREH-UHFFFAOYSA-N	-1	3	339.333	1.058	20	5		EDBDHM
C[C@@H](CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)CC1(C)OCCO1	ZINC000736027067	578947865	/nfs/dbraw/zinc/94/78/65/578947865.db2.gz	WOVMARIFGHTDAL-SNVBAGLBSA-N	-1	3	348.363	1.976	20	5		EDBDHM
C[C@@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)CC1(C)OCCO1	ZINC000736027067	578947866	/nfs/dbraw/zinc/94/78/66/578947866.db2.gz	WOVMARIFGHTDAL-SNVBAGLBSA-N	-1	3	348.363	1.976	20	5		EDBDHM
C[C@H](CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)CC1(C)OCCO1	ZINC000736027066	578947901	/nfs/dbraw/zinc/94/79/01/578947901.db2.gz	WOVMARIFGHTDAL-JTQLQIEISA-N	-1	3	348.363	1.976	20	5		EDBDHM
C[C@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)CC1(C)OCCO1	ZINC000736027066	578947902	/nfs/dbraw/zinc/94/79/02/578947902.db2.gz	WOVMARIFGHTDAL-JTQLQIEISA-N	-1	3	348.363	1.976	20	5		EDBDHM
CCN1CCC(N(C)C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC1	ZINC000737111417	579048056	/nfs/dbraw/zinc/04/80/56/579048056.db2.gz	CGRXLGXNVXSVGI-UHFFFAOYSA-N	-1	3	335.360	1.849	20	5		EDBDHM
O=C1CCCCN1CCCNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000738304335	579183987	/nfs/dbraw/zinc/18/39/87/579183987.db2.gz	XNCBVBHYRJGPIM-UHFFFAOYSA-N	-1	3	345.363	1.589	20	5		EDBDHM
O=C1CCCCN1CCCNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000738304335	579183988	/nfs/dbraw/zinc/18/39/88/579183988.db2.gz	XNCBVBHYRJGPIM-UHFFFAOYSA-N	-1	3	345.363	1.589	20	5		EDBDHM
O=C1[C@@H](NCc2cc([N+](=O)[O-])ccc2[O-])CCN1C1CCOCC1	ZINC000747621837	579651149	/nfs/dbraw/zinc/65/11/49/579651149.db2.gz	AURNACOBKZOQBE-AWEZNQCLSA-N	-1	3	335.360	1.170	20	5		EDBDHM
CCC[C@](C)([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C(=O)OC	ZINC000768806789	580220844	/nfs/dbraw/zinc/22/08/44/580220844.db2.gz	YWDCOWJHHXJHIO-NSHDSACASA-N	-1	3	336.391	1.666	20	5		EDBDHM
C[C@@](O)(C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C(F)(F)F	ZINC000768866931	580222995	/nfs/dbraw/zinc/22/29/95/580222995.db2.gz	FPDGZOMJLSLHCB-SSDOTTSWSA-N	-1	3	334.297	1.248	20	5		EDBDHM
COC(=O)[C@H](CC(F)F)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768880868	580223300	/nfs/dbraw/zinc/22/33/00/580223300.db2.gz	DUNLWQBNVXXBGW-LURJTMIESA-N	-1	3	344.317	1.131	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)n[nH]1	ZINC000771756655	580292929	/nfs/dbraw/zinc/29/29/29/580292929.db2.gz	AFXCYEPJKIXSID-UHFFFAOYSA-N	-1	3	328.325	1.552	20	5		EDBDHM
CON(C)C(=O)c1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc1	ZINC000776645386	580425265	/nfs/dbraw/zinc/42/52/65/580425265.db2.gz	NLCNVTCKEGSYSR-UHFFFAOYSA-N	-1	3	346.299	1.581	20	5		EDBDHM
CC(C)([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)N1CCCC1	ZINC000795370737	580920343	/nfs/dbraw/zinc/92/03/43/580920343.db2.gz	IEAFAJFFSGEDCI-UHFFFAOYSA-N	-1	3	341.389	1.274	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCN(C)[C@@H](C)C2)cc1F	ZINC000866871505	590780821	/nfs/dbraw/zinc/78/08/21/590780821.db2.gz	OCUOJMPMUANKDR-QWRGUYRKSA-N	-1	3	345.396	1.803	20	5		EDBDHM
COc1c([O-])ccc(CN2CC[S@](=O)[C@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000892086099	590790440	/nfs/dbraw/zinc/79/04/40/590790440.db2.gz	RWKSWWDZPDRZKI-QKESZYPNSA-N	-1	3	328.390	1.650	20	5		EDBDHM
COc1c([O-])ccc(CN2CCN(C(=O)C(C)C)CC2)c1[N+](=O)[O-]	ZINC000891492388	591091848	/nfs/dbraw/zinc/09/18/48/591091848.db2.gz	GDZXCCHXJGOXPO-UHFFFAOYSA-N	-1	3	337.376	1.609	20	5		EDBDHM
COc1c([O-])ccc(CN2CCN(C[C@H](C)O)C[C@H]2C)c1[N+](=O)[O-]	ZINC000894158942	591211548	/nfs/dbraw/zinc/21/15/48/591211548.db2.gz	RCCISRCJBLDDBM-NEPJUHHUSA-N	-1	3	339.392	1.196	20	5		EDBDHM
COc1c([O-])ccc(CN2C[C@H](C)O[C@@]3(CCOC3)C2)c1[N+](=O)[O-]	ZINC000894181524	591219885	/nfs/dbraw/zinc/21/98/85/591219885.db2.gz	NEXZSKLAPLDEFJ-ZBEGNZNMSA-N	-1	3	338.360	1.689	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2COC[C@@H]2C2CC2)c1C	ZINC000908409585	592484246	/nfs/dbraw/zinc/48/42/46/592484246.db2.gz	LIMQMUMJOWBBRQ-CHWSQXEVSA-N	-1	3	340.401	1.915	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2COC[C@H]2C2CC2)cc1C	ZINC000908411512	592485814	/nfs/dbraw/zinc/48/58/14/592485814.db2.gz	NPKBTCODHRKKQL-STQMWFEESA-N	-1	3	340.401	1.915	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H]1CC[C@H](C2CC2)O1	ZINC000907468737	592651203	/nfs/dbraw/zinc/65/12/03/592651203.db2.gz	KNHJEACJKAAITL-WCQYABFASA-N	-1	3	326.374	1.831	20	5		EDBDHM
O=C(COC(=O)c1cnn[n-]1)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000805602885	593110686	/nfs/dbraw/zinc/11/06/86/593110686.db2.gz	DGETYHGDBGFJCW-UHFFFAOYSA-N	-1	3	325.668	1.162	20	5		EDBDHM
O=C(COC(=O)c1c[n-]nn1)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000805602885	593110687	/nfs/dbraw/zinc/11/06/87/593110687.db2.gz	DGETYHGDBGFJCW-UHFFFAOYSA-N	-1	3	325.668	1.162	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOC[C@H]2CCCO2)c(-c2nnn[n-]2)c1	ZINC000738371657	599059729	/nfs/dbraw/zinc/05/97/29/599059729.db2.gz	WARGLBNQJZQMNM-LLVKDONJSA-N	-1	3	334.336	1.382	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOC[C@H]2CCCO2)c(-c2nn[n-]n2)c1	ZINC000738371657	599059732	/nfs/dbraw/zinc/05/97/32/599059732.db2.gz	WARGLBNQJZQMNM-LLVKDONJSA-N	-1	3	334.336	1.382	20	5		EDBDHM
CCOC(=O)[C@H](CC1CC1)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768847537	593442716	/nfs/dbraw/zinc/44/27/16/593442716.db2.gz	PESAWONCFCAEOD-JTQLQIEISA-N	-1	3	348.402	1.666	20	5		EDBDHM
Cc1n[n-]nc1C(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000805546396	593465678	/nfs/dbraw/zinc/46/56/78/593465678.db2.gz	MAHUMHDBCZQZEG-UHFFFAOYSA-N	-1	3	339.695	1.470	20	5		EDBDHM
Cc1ccc(NC(=O)c2cc(-c3nnn[n-]3)cn2C)cc1[N+](=O)[O-]	ZINC000822254793	594018900	/nfs/dbraw/zinc/01/89/00/594018900.db2.gz	RKOVIFCEFCWUJA-UHFFFAOYSA-N	-1	3	327.304	1.674	20	5		EDBDHM
Cc1ccc(NC(=O)c2cc(-c3nn[n-]n3)cn2C)cc1[N+](=O)[O-]	ZINC000822254793	594018903	/nfs/dbraw/zinc/01/89/03/594018903.db2.gz	RKOVIFCEFCWUJA-UHFFFAOYSA-N	-1	3	327.304	1.674	20	5		EDBDHM
Cc1ccc(OC(=O)c2cc(-c3nnn[n-]3)cn2C)c([N+](=O)[O-])c1	ZINC000822259374	594020018	/nfs/dbraw/zinc/02/00/18/594020018.db2.gz	WUMUCWGCBWTTEU-UHFFFAOYSA-N	-1	3	328.288	1.641	20	5		EDBDHM
Cc1ccc(OC(=O)c2cc(-c3nn[n-]n3)cn2C)c([N+](=O)[O-])c1	ZINC000822259374	594020020	/nfs/dbraw/zinc/02/00/20/594020020.db2.gz	WUMUCWGCBWTTEU-UHFFFAOYSA-N	-1	3	328.288	1.641	20	5		EDBDHM
CCC1(CO)CCN(c2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000825175979	594142092	/nfs/dbraw/zinc/14/20/92/594142092.db2.gz	AOUZXEAVPRVRIM-UHFFFAOYSA-N	-1	3	333.352	1.159	20	5		EDBDHM
CCC1(CO)CCN(c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000825175979	594142093	/nfs/dbraw/zinc/14/20/93/594142093.db2.gz	AOUZXEAVPRVRIM-UHFFFAOYSA-N	-1	3	333.352	1.159	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCC(OCCCO)CC1	ZINC000823629966	594223015	/nfs/dbraw/zinc/22/30/15/594223015.db2.gz	OJSGAKDOXONQDC-UHFFFAOYSA-N	-1	3	348.363	1.143	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCC(OCCCO)CC1	ZINC000823629966	594223016	/nfs/dbraw/zinc/22/30/16/594223016.db2.gz	OJSGAKDOXONQDC-UHFFFAOYSA-N	-1	3	348.363	1.143	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@H](O)c2cccnc2)c(-c2nnn[n-]2)c1	ZINC000823639847	594223819	/nfs/dbraw/zinc/22/38/19/594223819.db2.gz	IPZOYGMHEVDWMN-ZDUSSCGKSA-N	-1	3	327.304	1.315	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@H](O)c2cccnc2)c(-c2nn[n-]n2)c1	ZINC000823639847	594223820	/nfs/dbraw/zinc/22/38/20/594223820.db2.gz	IPZOYGMHEVDWMN-ZDUSSCGKSA-N	-1	3	327.304	1.315	20	5		EDBDHM
O=[N+]([O-])c1cnc(Sc2ncc3ccccn32)c(-c2nnn[n-]2)c1	ZINC000823652303	594224968	/nfs/dbraw/zinc/22/49/68/594224968.db2.gz	ZGPNVLRXZFFZMK-UHFFFAOYSA-N	-1	3	340.328	1.969	20	5		EDBDHM
CNC(=O)[C@@H]1CCC[C@H]1Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000826060487	594322087	/nfs/dbraw/zinc/32/20/87/594322087.db2.gz	NJDKTYGPOUYAIW-NXEZZACHSA-N	-1	3	331.336	1.102	20	5		EDBDHM
CNC(=O)[C@@H]1CCC[C@H]1Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000826060487	594322089	/nfs/dbraw/zinc/32/20/89/594322089.db2.gz	NJDKTYGPOUYAIW-NXEZZACHSA-N	-1	3	331.336	1.102	20	5		EDBDHM
Cc1cc(-c2nnn[n-]2)ccc1COC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000826254411	594400418	/nfs/dbraw/zinc/40/04/18/594400418.db2.gz	JVPINTOYVKRLAC-UHFFFAOYSA-N	-1	3	340.299	1.835	20	5		EDBDHM
Cc1cc(-c2nn[n-]n2)ccc1COC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000826254411	594400419	/nfs/dbraw/zinc/40/04/19/594400419.db2.gz	JVPINTOYVKRLAC-UHFFFAOYSA-N	-1	3	340.299	1.835	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@@H]([C@@H]3CCOC3)C2)c(-c2nnn[n-]2)c1	ZINC000826500803	594503408	/nfs/dbraw/zinc/50/34/08/594503408.db2.gz	MTTBNCSROUMBNG-GHMZBOCLSA-N	-1	3	345.363	1.423	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@@H]([C@@H]3CCOC3)C2)c(-c2nn[n-]n2)c1	ZINC000826500803	594503410	/nfs/dbraw/zinc/50/34/10/594503410.db2.gz	MTTBNCSROUMBNG-GHMZBOCLSA-N	-1	3	345.363	1.423	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)Cn1ccnc1	ZINC000840951006	594831907	/nfs/dbraw/zinc/83/19/07/594831907.db2.gz	RECXSCWEAVKBBK-SECBINFHSA-N	-1	3	330.391	1.467	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CN1C[C@H]2COCC[C@]2(C(=O)[O-])C1	ZINC000846287314	595198732	/nfs/dbraw/zinc/19/87/32/595198732.db2.gz	VWAZFXRQIHADMQ-LRDDRELGSA-N	-1	3	336.344	1.527	20	5		EDBDHM
CC[S@](=O)CC[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848583677	595409513	/nfs/dbraw/zinc/40/95/13/595409513.db2.gz	WAUXSBPUURFPAZ-QFIPXVFZSA-N	-1	3	336.316	1.451	20	5		EDBDHM
COC(=O)N1CC([N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000848584987	595409823	/nfs/dbraw/zinc/40/98/23/595409823.db2.gz	DUUZNTBEYTUNSZ-UHFFFAOYSA-N	-1	3	345.258	1.133	20	5		EDBDHM
CO[C@]1(C[N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)CCOC1	ZINC000848587365	595410800	/nfs/dbraw/zinc/41/08/00/595410800.db2.gz	GEELUQOEMPOGGP-ZDUSSCGKSA-N	-1	3	346.286	1.488	20	5		EDBDHM
CCN(C)C(=O)[C@H](C)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848592584	595412591	/nfs/dbraw/zinc/41/25/91/595412591.db2.gz	KRCVIIJYUHGZGX-VIFPVBQESA-N	-1	3	345.302	1.549	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1COC2(CCC2)C1	ZINC000849450052	595532114	/nfs/dbraw/zinc/53/21/14/595532114.db2.gz	SYTVTJIZJKJGOP-NSHDSACASA-N	-1	3	326.374	1.893	20	5		EDBDHM
C[C@H]1CCCN(CC[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000119572402	596650085	/nfs/dbraw/zinc/65/00/85/596650085.db2.gz	XSDGOFZRDZJLTN-JTQLQIEISA-N	-1	3	333.435	1.667	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@H](CO)Cc2ccccc2)c(-c2nnn[n-]2)c1	ZINC000738369582	598810601	/nfs/dbraw/zinc/81/06/01/598810601.db2.gz	JHBFHUNTPIIROY-LBPRGKRZSA-N	-1	3	340.343	1.790	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@H](CO)Cc2ccccc2)c(-c2nn[n-]n2)c1	ZINC000738369582	598810602	/nfs/dbraw/zinc/81/06/02/598810602.db2.gz	JHBFHUNTPIIROY-LBPRGKRZSA-N	-1	3	340.343	1.790	20	5		EDBDHM
O=C(N[C@@H]1[C@H]2CN(c3cc[n-]c(=O)c3[N+](=O)[O-])C[C@H]21)C1CC2(CC2)C1	ZINC001060474137	695390620	/nfs/dbraw/zinc/39/06/20/695390620.db2.gz	DEOOCELNPZJKAH-PJXYFTJBSA-N	-1	3	344.371	1.436	20	5		EDBDHM
O=C(NCCNC(=O)c1cc(F)ccc1[N+](=O)[O-])c1ccc([O-])cc1	ZINC000153080365	695507507	/nfs/dbraw/zinc/50/75/07/695507507.db2.gz	FMRYECQNXNXXBL-UHFFFAOYSA-N	-1	3	347.302	1.599	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CC2(O)CCCCC2)cc1[N+](=O)[O-]	ZINC000124285682	138325636	/nfs/dbraw/zinc/32/56/36/138325636.db2.gz	JNNKBYFAQVDBOL-UHFFFAOYSA-N	-1	3	334.419	1.938	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCCn2ccnc2)c(Cl)c1	ZINC000125697419	138335688	/nfs/dbraw/zinc/33/56/88/138335688.db2.gz	UIVNRWWLKIOEOE-UHFFFAOYSA-N	-1	3	344.780	1.813	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])[C@H](O)C(F)F	ZINC000451706969	305363557	/nfs/dbraw/zinc/36/35/57/305363557.db2.gz	HJMCBTZWAFAONR-ONGXEEELSA-N	-1	3	338.332	1.419	20	5		EDBDHM
Cc1cc(S(N)(=O)=O)cc([N-]C(=O)c2ccc([N+](=O)[O-])o2)c1C	ZINC000248125518	139158334	/nfs/dbraw/zinc/15/83/34/139158334.db2.gz	WURWCGGHZDPCJS-UHFFFAOYSA-N	-1	3	339.329	1.704	20	5		EDBDHM
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000261754977	139223352	/nfs/dbraw/zinc/22/33/52/139223352.db2.gz	VBLMGYCIWFRMAT-ZXIHIIQKSA-N	-1	3	335.360	1.771	20	5		EDBDHM
CN(C)C(=O)C1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000416604553	251079051	/nfs/dbraw/zinc/07/90/51/251079051.db2.gz	ZNXHQYPYZQINOH-UHFFFAOYSA-N	-1	3	347.780	1.147	20	5		EDBDHM
COCCC1(C[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])CC1	ZINC000152793906	533209983	/nfs/dbraw/zinc/20/99/83/533209983.db2.gz	AQNFILQZONWRIH-UHFFFAOYSA-N	-1	3	328.390	1.998	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](CCO)C(C)C	ZINC000269851766	140006468	/nfs/dbraw/zinc/00/64/68/140006468.db2.gz	QYTNQGJRUPJZBP-NSHDSACASA-N	-1	3	332.378	1.289	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](CCO)C(C)C	ZINC000269851755	140006472	/nfs/dbraw/zinc/00/64/72/140006472.db2.gz	QYTNQGJRUPJZBP-LLVKDONJSA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@]1(O)CCSC1	ZINC000269865969	140009042	/nfs/dbraw/zinc/00/90/42/140009042.db2.gz	STMCCZZQIJTVDU-GFCCVEGCSA-N	-1	3	332.403	1.050	20	5		EDBDHM
C[C@@H](CO)[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000416412648	304316766	/nfs/dbraw/zinc/31/67/66/304316766.db2.gz	NROYMJYPPFZQCB-LURJTMIESA-N	-1	3	328.268	1.273	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H](CO)C(C)C	ZINC000344837708	143018132	/nfs/dbraw/zinc/01/81/32/143018132.db2.gz	VWRZSQFWSGLTNJ-JTQLQIEISA-N	-1	3	332.378	1.146	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC(C)(C)OC	ZINC000345561642	143106002	/nfs/dbraw/zinc/10/60/02/143106002.db2.gz	IAVNJCRJHVVRHW-UHFFFAOYSA-N	-1	3	346.361	1.085	20	5		EDBDHM
C[C@@H]1C[C@@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)[C@H](C)O1	ZINC000416609307	304337466	/nfs/dbraw/zinc/33/74/66/304337466.db2.gz	UQHIOVAHZCHMLN-UTLUCORTSA-N	-1	3	332.353	1.826	20	5		EDBDHM
C[C@@H]1C[C@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)[C@H](C)O1	ZINC000416609305	304337538	/nfs/dbraw/zinc/33/75/38/304337538.db2.gz	UQHIOVAHZCHMLN-KXUCPTDWSA-N	-1	3	332.353	1.826	20	5		EDBDHM
Cc1[nH]nc(C(=O)Nc2ccccc2[N-]S(C)(=O)=O)c1[N+](=O)[O-]	ZINC000352868602	149196786	/nfs/dbraw/zinc/19/67/86/149196786.db2.gz	JOAPPQREULDZQR-UHFFFAOYSA-N	-1	3	339.333	1.250	20	5		EDBDHM
CCO[C@H]1COCC[C@@H]1[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000352987071	149240869	/nfs/dbraw/zinc/24/08/69/149240869.db2.gz	UFVSNHUWGRRDQW-KBPBESRZSA-N	-1	3	344.389	1.208	20	5		EDBDHM
O=C(NCCn1cc([N+](=O)[O-])cn1)c1c[n-]nc1-c1ccccn1	ZINC000355234662	150176878	/nfs/dbraw/zinc/17/68/78/150176878.db2.gz	ULVAUXKPWWNGGJ-UHFFFAOYSA-N	-1	3	327.304	1.006	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCC2CCOCC2)c([N+](=O)[O-])c1	ZINC000358399430	151362831	/nfs/dbraw/zinc/36/28/31/151362831.db2.gz	MXWNMECCTLOXGK-UHFFFAOYSA-N	-1	3	344.389	1.698	20	5		EDBDHM
CCn1ncnc1C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000360351105	152003477	/nfs/dbraw/zinc/00/34/77/152003477.db2.gz	FLLIHKWPJBWHJT-UHFFFAOYSA-N	-1	3	331.379	1.055	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCN(C)[C@H](C)C2)cc1C	ZINC000360651728	152138984	/nfs/dbraw/zinc/13/89/84/152138984.db2.gz	IQQIHIRWTFHABK-CHWSQXEVSA-N	-1	3	341.433	1.973	20	5		EDBDHM
CN1C(=O)COc2ccc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)cc21	ZINC000362364584	152689378	/nfs/dbraw/zinc/68/93/78/152689378.db2.gz	IWFWYPJENMXOOD-UHFFFAOYSA-N	-1	3	344.283	1.303	20	5		EDBDHM
Cc1n[nH]cc1-c1nnc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)s1	ZINC000364033447	153128955	/nfs/dbraw/zinc/12/89/55/153128955.db2.gz	ZCIXNEWUFVBORA-UHFFFAOYSA-N	-1	3	347.316	1.498	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1C[C@@H]2OCCC[C@H]12	ZINC000364842408	153349052	/nfs/dbraw/zinc/34/90/52/153349052.db2.gz	JHSULZJBUPKICK-UTUOFQBUSA-N	-1	3	342.373	1.449	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCC[C@@H](C(N)=O)C1	ZINC000160225770	225365422	/nfs/dbraw/zinc/36/54/22/225365422.db2.gz	PNUXLEFWQXAEFK-GHMZBOCLSA-N	-1	3	341.389	1.226	20	5		EDBDHM
CC(C)[C@H](CCO)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000122551142	222110551	/nfs/dbraw/zinc/11/05/51/222110551.db2.gz	WUCGZLGKRSWHBE-JTQLQIEISA-N	-1	3	336.797	1.934	20	5		EDBDHM
COc1ccc(C(=O)Nc2nc(C(F)(F)F)n[n-]2)cc1[N+](=O)[O-]	ZINC000029388823	267381059	/nfs/dbraw/zinc/38/10/59/267381059.db2.gz	WQIBQJYCIKIJKC-UHFFFAOYSA-N	-1	3	331.210	1.993	20	5		EDBDHM
COc1ccc(C(=O)Nc2nnc(C(F)(F)F)[n-]2)cc1[N+](=O)[O-]	ZINC000029388823	267381062	/nfs/dbraw/zinc/38/10/62/267381062.db2.gz	WQIBQJYCIKIJKC-UHFFFAOYSA-N	-1	3	331.210	1.993	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@](C)(C(N)=O)C(C)C)c1C	ZINC000285288221	274502402	/nfs/dbraw/zinc/50/24/02/274502402.db2.gz	KAVFAUHTKRCZFY-AWEZNQCLSA-N	-1	3	343.405	1.390	20	5		EDBDHM
CC(C)c1ccc(CNCCN2C[C@@H](C(=O)[O-])CC2=O)cc1[N+](=O)[O-]	ZINC000417636439	280605852	/nfs/dbraw/zinc/60/58/52/280605852.db2.gz	XVVJESMHDLGHIM-ZDUSSCGKSA-N	-1	3	349.387	1.741	20	5		EDBDHM
N=c1nc(N2CCOc3ccc([N+](=O)[O-])cc3C2)nc2[nH][n-]cc1-2	ZINC000357830983	295029624	/nfs/dbraw/zinc/02/96/24/295029624.db2.gz	VTCGWTFDLVQUQB-UHFFFAOYSA-N	-1	3	327.304	1.024	20	5		EDBDHM
Cc1ncsc1CC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000295583743	303237953	/nfs/dbraw/zinc/23/79/53/303237953.db2.gz	VXZXQGXSDZRJPA-UHFFFAOYSA-N	-1	3	327.387	1.881	20	5		EDBDHM
COC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCCC1	ZINC000296559593	303324208	/nfs/dbraw/zinc/32/42/08/303324208.db2.gz	CNJGNXRIIADCOH-UHFFFAOYSA-N	-1	3	332.353	1.971	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)Nc2c(C)ccc(C(=O)OC)c2[O-])n1	ZINC000436509318	305159151	/nfs/dbraw/zinc/15/91/51/305159151.db2.gz	FKBIIXJCYNIFNU-UHFFFAOYSA-N	-1	3	348.315	1.864	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2c(C)ccc(C(=O)OC)c2O)n1	ZINC000436509318	305159152	/nfs/dbraw/zinc/15/91/52/305159152.db2.gz	FKBIIXJCYNIFNU-UHFFFAOYSA-N	-1	3	348.315	1.864	20	5		EDBDHM
CSCC[C@@H](CO)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000443505856	305239048	/nfs/dbraw/zinc/23/90/48/305239048.db2.gz	AYVGTYMXVNZHDZ-NSHDSACASA-N	-1	3	348.446	1.604	20	5		EDBDHM
CCO[C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000452064150	305381566	/nfs/dbraw/zinc/38/15/66/305381566.db2.gz	ZDFBUPMZPYMFAV-VXGBXAGGSA-N	-1	3	344.389	1.839	20	5		EDBDHM
O=C(c1cc2c(cc1[N+](=O)[O-])OCO2)N1CCc2nc[n-]c(=O)c2C1	ZINC000526015844	305832543	/nfs/dbraw/zinc/83/25/43/305832543.db2.gz	IFSXZGVZSZIJQT-UHFFFAOYSA-N	-1	3	344.283	1.018	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCN1CCC[C@H](C)C1	ZINC000046035188	441071373	/nfs/dbraw/zinc/07/13/73/441071373.db2.gz	JTPSMUDVCFREJI-LBPRGKRZSA-N	-1	3	341.433	1.913	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1[N-]C(=O)c1nc2nc(C)cc(C)n2n1	ZINC000015628088	441206950	/nfs/dbraw/zinc/20/69/50/441206950.db2.gz	YRLSWWJDBBINBJ-UHFFFAOYSA-N	-1	3	342.315	1.910	20	5		EDBDHM
CC[C@H](C)[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000016083541	441215297	/nfs/dbraw/zinc/21/52/97/441215297.db2.gz	KYILFFWWKQIEEZ-CABZTGNLSA-N	-1	3	330.362	1.461	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)c2nncn2C)cc1C	ZINC000060500147	441247636	/nfs/dbraw/zinc/24/76/36/441247636.db2.gz	UFHIUVSVNSJMPK-SNVBAGLBSA-N	-1	3	339.377	1.380	20	5		EDBDHM
Cc1nc([N-]C(=O)c2ccc([N+](=O)[O-])o2)sc1SCC(N)=O	ZINC000041813707	441675879	/nfs/dbraw/zinc/67/58/79/441675879.db2.gz	TYKGAGZADOFVAT-UHFFFAOYSA-N	-1	3	342.358	1.782	20	5		EDBDHM
Cc1cnc(N2CCN(C(=O)c3ccccc3[O-])CC2)c([N+](=O)[O-])c1	ZINC000078630183	441955686	/nfs/dbraw/zinc/95/56/86/441955686.db2.gz	PPYWSTPHVPXPMQ-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
Cc1ccsc1[C@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000125320009	442009676	/nfs/dbraw/zinc/00/96/76/442009676.db2.gz	KCFCENUAFSRUBQ-LBPRGKRZSA-N	-1	3	342.398	1.977	20	5		EDBDHM
CC(C)N(C)CC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000155620528	442413617	/nfs/dbraw/zinc/41/36/17/442413617.db2.gz	MANNDSQHVSPKQB-UHFFFAOYSA-N	-1	3	335.813	1.867	20	5		EDBDHM
CC(C)[C@@](C)(O)C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000178744536	442472056	/nfs/dbraw/zinc/47/20/56/442472056.db2.gz	DQUZVDQPPWOJBS-LBPRGKRZSA-N	-1	3	336.797	1.934	20	5		EDBDHM
O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)[N-]CCN1CCCC1	ZINC000194431348	442895699	/nfs/dbraw/zinc/89/56/99/442895699.db2.gz	IMLZFBMTQAMKOX-UHFFFAOYSA-N	-1	3	333.797	1.622	20	5		EDBDHM
CC[C@H](C)[C@@H](C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)OC	ZINC000295321851	318642750	/nfs/dbraw/zinc/64/27/50/318642750.db2.gz	PRVVPRXTDOVIOF-GXFFZTMASA-N	-1	3	346.405	1.943	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC[C@@H](C)CCO)c1[N+](=O)[O-]	ZINC000296266636	318679651	/nfs/dbraw/zinc/67/96/51/318679651.db2.gz	QFKWOIYXGQYKBX-SNVBAGLBSA-N	-1	3	330.406	1.899	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@]2(C)CCC(=O)N2)c1C	ZINC000416501211	319435723	/nfs/dbraw/zinc/43/57/23/319435723.db2.gz	KDFIUZHRNOFSLL-AWEZNQCLSA-N	-1	3	341.389	1.159	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H](O)C(C)(C)C)c([N+](=O)[O-])c1	ZINC000269744638	443421293	/nfs/dbraw/zinc/42/12/93/443421293.db2.gz	FZSCGFCLANWOHN-LBPRGKRZSA-N	-1	3	332.378	1.289	20	5		EDBDHM
CCC[C@](C)(O)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000269765911	443431765	/nfs/dbraw/zinc/43/17/65/443431765.db2.gz	LBYRNSHYAMKCOZ-ZDUSSCGKSA-N	-1	3	332.378	1.433	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H](C)C[C@H](C)O	ZINC000269781366	443438435	/nfs/dbraw/zinc/43/84/35/443438435.db2.gz	OVCGMDMMRFXLEX-ZJUUUORDSA-N	-1	3	332.378	1.289	20	5		EDBDHM
COC[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)OC	ZINC000272675411	443405118	/nfs/dbraw/zinc/40/51/18/443405118.db2.gz	LRXMISFUWCPBML-VIFPVBQESA-N	-1	3	338.769	1.188	20	5		EDBDHM
COc1ccc(C[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])nc1	ZINC000443930574	320115401	/nfs/dbraw/zinc/11/54/01/320115401.db2.gz	STEVFLQSACUOLO-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
C[C@@H]1C[C@@H]1N1CCN(C(=O)c2cc([N+](=O)[O-])c[n-]c2=O)C[C@@H](C)C1	ZINC000452121576	320243162	/nfs/dbraw/zinc/24/31/62/320243162.db2.gz	KNHKYAQQTMJNED-WDMOLILDSA-N	-1	3	334.376	1.498	20	5		EDBDHM
CCN(C)C(=O)[C@@H](C)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000276561314	443747450	/nfs/dbraw/zinc/74/74/50/443747450.db2.gz	HNDLZALBYOIQER-SECBINFHSA-N	-1	3	329.303	1.670	20	5		EDBDHM
CCOC[C@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(C)C	ZINC000276669693	443785621	/nfs/dbraw/zinc/78/56/21/443785621.db2.gz	KGTIJXQOBBHINX-LBPRGKRZSA-N	-1	3	346.405	1.943	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H]2CCCN2C)c1[N+](=O)[O-]	ZINC000276802468	443833864	/nfs/dbraw/zinc/83/38/64/443833864.db2.gz	KWJDRFRGIPJMEC-GFCCVEGCSA-N	-1	3	327.406	1.584	20	5		EDBDHM
COCC[C@](C)(O)C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276817077	443838669	/nfs/dbraw/zinc/83/86/69/443838669.db2.gz	MWIVRMARDDKOMX-AWEZNQCLSA-N	-1	3	346.405	1.277	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C2C[C@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000535051909	320710954	/nfs/dbraw/zinc/71/09/54/320710954.db2.gz	GPMNBSMWFZXGJJ-UWVGGRQHSA-N	-1	3	344.389	1.838	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC2(C)OCCCO2)c1[N+](=O)[O-]	ZINC000276925665	443875477	/nfs/dbraw/zinc/87/54/77/443875477.db2.gz	LTJQZMSMDHNTCG-UHFFFAOYSA-N	-1	3	344.389	1.643	20	5		EDBDHM
Cc1nc([C@H](C)[N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])n[nH]1	ZINC000285290157	443928703	/nfs/dbraw/zinc/92/87/03/443928703.db2.gz	GHKKMRDXZSJHCW-VIFPVBQESA-N	-1	3	339.377	1.678	20	5		EDBDHM
Cc1nnc([C@H](C)[N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])[nH]1	ZINC000285290157	443928706	/nfs/dbraw/zinc/92/87/06/443928706.db2.gz	GHKKMRDXZSJHCW-VIFPVBQESA-N	-1	3	339.377	1.678	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CCCCCO)c1	ZINC000289170483	444068305	/nfs/dbraw/zinc/06/83/05/444068305.db2.gz	MNCFAHAIRRNPJQ-UHFFFAOYSA-N	-1	3	336.797	1.998	20	5		EDBDHM
C[C@H](C(=O)N1CCc2c(=O)[n-]cnc2C1)c1ccc([N+](=O)[O-])cc1F	ZINC000558427390	321012614	/nfs/dbraw/zinc/01/26/14/321012614.db2.gz	GPCVHBGZWILEOF-VIFPVBQESA-N	-1	3	346.318	1.918	20	5		EDBDHM
Cn1cc(C(C)(C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)nn1	ZINC000564454706	321133107	/nfs/dbraw/zinc/13/31/07/321133107.db2.gz	XPOATVYHISIANJ-UHFFFAOYSA-N	-1	3	343.340	1.076	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H](C)[C@@H](C)OC)cc1[N+](=O)[O-]	ZINC000289716181	444194165	/nfs/dbraw/zinc/19/41/65/444194165.db2.gz	WXIKBZLMUOSKQJ-HTQZYQBOSA-N	-1	3	336.341	1.444	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCCCC[C@@H]1O	ZINC000322463295	444340051	/nfs/dbraw/zinc/34/00/51/444340051.db2.gz	MHCWNCSXLLEJCV-NEPJUHHUSA-N	-1	3	344.389	1.575	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCC(=O)OC(C)C)c([N+](=O)[O-])c1	ZINC000337806723	444416165	/nfs/dbraw/zinc/41/61/65/444416165.db2.gz	LBUOHQAXYYAMID-UHFFFAOYSA-N	-1	3	330.362	1.523	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCNC(=O)C(C)(C)C)c([N+](=O)[O-])c1	ZINC000337734464	444380798	/nfs/dbraw/zinc/38/07/98/444380798.db2.gz	HKGZBDGZRRYCDC-UHFFFAOYSA-N	-1	3	343.405	1.344	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@@H]2CCOC2)cc1C	ZINC000343991684	444713654	/nfs/dbraw/zinc/71/36/54/444713654.db2.gz	MFGXPFGXNUHSGL-GFCCVEGCSA-N	-1	3	328.390	1.917	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1cc(C)ccn1	ZINC000339041849	445004008	/nfs/dbraw/zinc/00/40/08/445004008.db2.gz	BFGDPSACFFSHGT-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-][C@@H]1CCC[C@@H]1F)OCCO2	ZINC000339118040	445039887	/nfs/dbraw/zinc/03/98/87/445039887.db2.gz	DLGCNEXSEJKQLV-DTWKUNHWSA-N	-1	3	346.336	1.535	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H](CO)C(C)C)c1[N+](=O)[O-]	ZINC000344805823	445143280	/nfs/dbraw/zinc/14/32/80/445143280.db2.gz	GRCMSRHORDOWHL-LBPRGKRZSA-N	-1	3	330.406	1.754	20	5		EDBDHM
Cc1ncc(CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c(=O)[n-]1	ZINC000343601318	445258474	/nfs/dbraw/zinc/25/84/74/445258474.db2.gz	LHSUVQWZLZUGMO-UHFFFAOYSA-N	-1	3	329.316	1.896	20	5		EDBDHM
Cc1nnc(CC[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])s1	ZINC000349773286	445672714	/nfs/dbraw/zinc/67/27/14/445672714.db2.gz	FPRCEYFJBWLKQO-UHFFFAOYSA-N	-1	3	342.402	1.584	20	5		EDBDHM
CC[C@@]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])(C(N)=O)C(C)C	ZINC000359203876	446031857	/nfs/dbraw/zinc/03/18/57/446031857.db2.gz	VFLBDKWSYJOTBA-AWEZNQCLSA-N	-1	3	343.405	1.472	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H](CCO)C1CCOCC1	ZINC000359218502	446048387	/nfs/dbraw/zinc/04/83/87/446048387.db2.gz	SNYRDMVYLIRTDZ-LBPRGKRZSA-N	-1	3	344.389	1.051	20	5		EDBDHM
Cc1cc(C(=O)N[C@@H]2[C@H]3CCO[C@H]3C23CCC3)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375103446	446582539	/nfs/dbraw/zinc/58/25/39/446582539.db2.gz	WLBSPXZRZQLTHL-OASPWFOLSA-N	-1	3	333.344	1.691	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C1(C2CC2)CCOCC1	ZINC000375175187	446624673	/nfs/dbraw/zinc/62/46/73/446624673.db2.gz	JKLHMCNTVQDPGJ-UHFFFAOYSA-N	-1	3	326.374	1.832	20	5		EDBDHM
COc1ccc(OCCn2cc(Cl)c(=O)[n-]c2=O)c([N+](=O)[O-])c1	ZINC000443397294	447048263	/nfs/dbraw/zinc/04/82/63/447048263.db2.gz	DNIYJASCDMIKKH-UHFFFAOYSA-N	-1	3	341.707	1.598	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@@H](C)N2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)on1	ZINC000369012118	447262381	/nfs/dbraw/zinc/26/23/81/447262381.db2.gz	WQBWEMOYGOUANX-NEPJUHHUSA-N	-1	3	348.363	1.752	20	5		EDBDHM
CCO[C@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000416528978	447636053	/nfs/dbraw/zinc/63/60/53/447636053.db2.gz	OPRRVVCPGUDXMF-JGZJWPJOSA-N	-1	3	330.362	1.449	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C)c1csnn1	ZINC000416634516	447662637	/nfs/dbraw/zinc/66/26/37/447662637.db2.gz	OBIUKANAYVWDAJ-MRVPVSSYSA-N	-1	3	328.375	1.794	20	5		EDBDHM
COC(=O)Cc1n[n-]c(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)n1	ZINC000582643190	448297104	/nfs/dbraw/zinc/29/71/04/448297104.db2.gz	QOHHKLPNCVHJNO-MRVPVSSYSA-N	-1	3	333.304	1.171	20	5		EDBDHM
COC(=O)Cc1nnc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)[n-]1	ZINC000582643190	448297107	/nfs/dbraw/zinc/29/71/07/448297107.db2.gz	QOHHKLPNCVHJNO-MRVPVSSYSA-N	-1	3	333.304	1.171	20	5		EDBDHM
COC(=O)Cc1nc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)n[n-]1	ZINC000582643190	448297111	/nfs/dbraw/zinc/29/71/11/448297111.db2.gz	QOHHKLPNCVHJNO-MRVPVSSYSA-N	-1	3	333.304	1.171	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2cc(C)on2)c([N+](=O)[O-])c1	ZINC000516346071	448414032	/nfs/dbraw/zinc/41/40/32/448414032.db2.gz	JCNNYWPIWLZKCZ-UHFFFAOYSA-N	-1	3	327.318	1.378	20	5		EDBDHM
CS[C@H]1CN(c2cc(C(=O)[O-])ccc2[N+](=O)[O-])C[C@H]1N(C)C	ZINC000578196032	448483125	/nfs/dbraw/zinc/48/31/25/448483125.db2.gz	WFLOSOIYPGCYIL-OLZOCXBDSA-N	-1	3	325.390	1.775	20	5		EDBDHM
O=C([O-])CCN(CCOc1ccccc1[N+](=O)[O-])C[C@@H]1CCCO1	ZINC000566920351	448586430	/nfs/dbraw/zinc/58/64/30/448586430.db2.gz	LVUQKMAKCZWYEI-ZDUSSCGKSA-N	-1	3	338.360	1.929	20	5		EDBDHM
CC[C@H](C)C[C@@H](CO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000592081473	448667775	/nfs/dbraw/zinc/66/77/75/448667775.db2.gz	BQYDUCHCXCLOPM-QWRGUYRKSA-N	-1	3	346.405	1.679	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)c1nccs1	ZINC000593574996	449083424	/nfs/dbraw/zinc/08/34/24/449083424.db2.gz	BXTOACNYTBHZSH-MRVPVSSYSA-N	-1	3	328.375	1.528	20	5		EDBDHM
C[C@]1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCO[C@@H]1C1CC1	ZINC000593577613	449085311	/nfs/dbraw/zinc/08/53/11/449085311.db2.gz	DCDIMSLVKYZTMX-ZIAGYGMSSA-N	-1	3	341.389	1.473	20	5		EDBDHM
CC(C)[C@H]1C[C@@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCO1	ZINC000593602496	449102644	/nfs/dbraw/zinc/10/26/44/449102644.db2.gz	VALNFEREKCPDQB-WCQYABFASA-N	-1	3	343.405	1.719	20	5		EDBDHM
CC[C@H](C)C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(=O)OC	ZINC000593612302	449108353	/nfs/dbraw/zinc/10/83/53/449108353.db2.gz	JWAMHIZWJHKKJP-GXSJLCMTSA-N	-1	3	345.377	1.246	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1cc(C)ncn1	ZINC000611134029	449181470	/nfs/dbraw/zinc/18/14/70/449181470.db2.gz	NBKQVDXJIZBGRK-UHFFFAOYSA-N	-1	3	338.345	1.180	20	5		EDBDHM
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCc1nc(CN)cc(=O)[n-]1	ZINC000595992977	449301964	/nfs/dbraw/zinc/30/19/64/449301964.db2.gz	ZBQDUVDECKXWES-UHFFFAOYSA-N	-1	3	345.359	1.404	20	5		EDBDHM
CC(C)(C(=O)NCc1nc(CN)cc(=O)[n-]1)c1ccc([N+](=O)[O-])cc1	ZINC000595949641	449275392	/nfs/dbraw/zinc/27/53/92/449275392.db2.gz	XVYYKMMGYQFDDD-UHFFFAOYSA-N	-1	3	345.359	1.143	20	5		EDBDHM
CCn1ccnc1C[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000590760497	449279812	/nfs/dbraw/zinc/27/98/12/449279812.db2.gz	GDXFLHFTIHMLKM-UHFFFAOYSA-N	-1	3	340.361	1.298	20	5		EDBDHM
Cc1noc(C)c1CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593543606	449336937	/nfs/dbraw/zinc/33/69/37/449336937.db2.gz	NJGFKFJNDRYQJS-UHFFFAOYSA-N	-1	3	326.334	1.116	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCCN3CCCC[C@@H]23)nc1	ZINC000594484590	449548685	/nfs/dbraw/zinc/54/86/85/449548685.db2.gz	VHYLLRPHRPWSNT-OLZOCXBDSA-N	-1	3	340.405	1.285	20	5		EDBDHM
CN(CC[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])C1CCCCC1	ZINC000594751865	449667261	/nfs/dbraw/zinc/66/72/61/449667261.db2.gz	FHBXOXQCSUGFNF-UHFFFAOYSA-N	-1	3	342.421	1.533	20	5		EDBDHM
CC[C@H]1CCCCN1CC[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594753790	449668003	/nfs/dbraw/zinc/66/80/03/449668003.db2.gz	NLJRQGZRTHUUSS-LBPRGKRZSA-N	-1	3	342.421	1.533	20	5		EDBDHM
CC[C@@](C)(O)C[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594762974	449676529	/nfs/dbraw/zinc/67/65/29/449676529.db2.gz	RMVBOCCDBHAPQE-CQSZACIVSA-N	-1	3	339.373	1.582	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C1(CO)CC1	ZINC000594827258	449733401	/nfs/dbraw/zinc/73/34/01/449733401.db2.gz	NDKBBZVLCNHBSF-QMMMGPOBSA-N	-1	3	334.781	1.688	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2C[C@@H](O)C23CCC3)cc1[N+](=O)[O-]	ZINC000594865538	449779088	/nfs/dbraw/zinc/77/90/88/449779088.db2.gz	UUSKESAIKKMABG-VHSXEESVSA-N	-1	3	332.403	1.547	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2C[C@@H](O)C23CCC3)c([N+](=O)[O-])c1	ZINC000594866879	449782735	/nfs/dbraw/zinc/78/27/35/449782735.db2.gz	YUOUVZNFQYVKPS-QWHCGFSZSA-N	-1	3	342.373	1.185	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCCN2CCCC2)c([N+](=O)[O-])s1	ZINC000601292205	449803120	/nfs/dbraw/zinc/80/31/20/449803120.db2.gz	LTNNCEVRXWTSEV-UHFFFAOYSA-N	-1	3	333.435	1.729	20	5		EDBDHM
CCN(CC[N-]S(=O)(=O)c1cc(C)sc1[N+](=O)[O-])C1CC1	ZINC000601334194	449842388	/nfs/dbraw/zinc/84/23/88/449842388.db2.gz	YQCVHWJGHUXBAP-UHFFFAOYSA-N	-1	3	333.435	1.727	20	5		EDBDHM
CC1CCC(O)(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CC1	ZINC000595410438	450122616	/nfs/dbraw/zinc/12/26/16/450122616.db2.gz	MDAIWNCEKQFLIK-UHFFFAOYSA-N	-1	3	329.378	1.209	20	5		EDBDHM
O=[N+]([O-])c1ncccc1S(=O)(=O)[N-][C@H]1CCN(C2CCCC2)C1	ZINC000610212372	450153797	/nfs/dbraw/zinc/15/37/97/450153797.db2.gz	YQMVTPVVJFAZKH-NSHDSACASA-N	-1	3	340.405	1.285	20	5		EDBDHM
CC1(C)[C@H](O)C[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000130143609	527887549	/nfs/dbraw/zinc/88/75/49/527887549.db2.gz	PRDZEPFMNSPICO-WDEREUQCSA-N	-1	3	334.781	1.686	20	5		EDBDHM
CC(C)COC[C@H](O)C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000352930099	535200151	/nfs/dbraw/zinc/20/01/51/535200151.db2.gz	DAVRCEFQPKGYOD-CYBMUJFWSA-N	-1	3	346.405	1.048	20	5		EDBDHM
CCCOC(=O)CC[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000268834739	535215572	/nfs/dbraw/zinc/21/55/72/535215572.db2.gz	GGOWYFOACJZTHN-UHFFFAOYSA-N	-1	3	344.389	1.833	20	5		EDBDHM
C[C@@](O)(CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)c1cccs1	ZINC000736143193	578957105	/nfs/dbraw/zinc/95/71/05/578957105.db2.gz	SCECYZMOSMQNCZ-CYBMUJFWSA-N	-1	3	347.360	1.551	20	5		EDBDHM
C[C@@](O)(CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)c1cccs1	ZINC000736143193	578957106	/nfs/dbraw/zinc/95/71/06/578957106.db2.gz	SCECYZMOSMQNCZ-CYBMUJFWSA-N	-1	3	347.360	1.551	20	5		EDBDHM
C[C@@H]1[C@H](C)[S@](=O)CCN1c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000736225249	578964754	/nfs/dbraw/zinc/96/47/54/578964754.db2.gz	PGSIRCIVFIQAMT-HKPSDFMSSA-N	-1	3	336.377	1.121	20	5		EDBDHM
C[C@@H]1[C@H](C)[S@](=O)CCN1c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000736225249	578964755	/nfs/dbraw/zinc/96/47/55/578964755.db2.gz	PGSIRCIVFIQAMT-HKPSDFMSSA-N	-1	3	336.377	1.121	20	5		EDBDHM
C[C@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000736807041	579022613	/nfs/dbraw/zinc/02/26/13/579022613.db2.gz	KGLLZSJAZDGJGU-IINYFYTJSA-N	-1	3	335.360	1.705	20	5		EDBDHM
Cn1cc([C@H]2CCCN2c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])cn1	ZINC000737605990	579119033	/nfs/dbraw/zinc/11/90/33/579119033.db2.gz	PGMXEJJPNVNQBH-GFCCVEGCSA-N	-1	3	340.347	1.850	20	5		EDBDHM
Cn1cc([C@H]2CCCN2c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])cn1	ZINC000737605990	579119034	/nfs/dbraw/zinc/11/90/34/579119034.db2.gz	PGMXEJJPNVNQBH-GFCCVEGCSA-N	-1	3	340.347	1.850	20	5		EDBDHM
Cc1c(CN(CCN2CCOCC2)CC(=O)[O-])cccc1[N+](=O)[O-]	ZINC000738288032	579181709	/nfs/dbraw/zinc/18/17/09/579181709.db2.gz	AWICYNJQTOMCPB-UHFFFAOYSA-N	-1	3	337.376	1.122	20	5		EDBDHM
CCNC(=O)C1(C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CCC1	ZINC000752836044	579866777	/nfs/dbraw/zinc/86/67/77/579866777.db2.gz	UNJFDTSYNRZSQD-UHFFFAOYSA-N	-1	3	347.418	1.241	20	5		EDBDHM
O=[N+]([O-])c1cccc(CS(=O)(=O)[N-]C[C@H](O)c2ccccn2)c1	ZINC000758517554	579984701	/nfs/dbraw/zinc/98/47/01/579984701.db2.gz	POUWOSDTGVHAMR-AWEZNQCLSA-N	-1	3	337.357	1.143	20	5		EDBDHM
Cc1ncc(CC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])s1	ZINC000771970410	580299807	/nfs/dbraw/zinc/29/98/07/580299807.db2.gz	PPYXVUKHXHLGFX-UHFFFAOYSA-N	-1	3	327.387	1.881	20	5		EDBDHM
NC(=O)Cc1csc([N-]C(=O)c2cc(Cl)ccc2[N+](=O)[O-])n1	ZINC000772299445	580307109	/nfs/dbraw/zinc/30/71/09/580307109.db2.gz	WCLQFTYJJYAUET-UHFFFAOYSA-N	-1	3	340.748	1.985	20	5		EDBDHM
CCOc1cc(C(=O)[N-]OC2CCOCC2)c([N+](=O)[O-])cc1OC	ZINC000772704251	580318174	/nfs/dbraw/zinc/31/81/74/580318174.db2.gz	BQMTVFTUXBLQNK-UHFFFAOYSA-N	-1	3	340.332	1.843	20	5		EDBDHM
O=C([N-]OC1CCOCC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21	ZINC000775242897	580386639	/nfs/dbraw/zinc/38/66/39/580386639.db2.gz	DWAVRMGGAWQPKE-UHFFFAOYSA-N	-1	3	333.300	1.689	20	5		EDBDHM
CC(C)OC(=O)C[N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1	ZINC000779892501	580501363	/nfs/dbraw/zinc/50/13/63/580501363.db2.gz	ZNTNXPGVYSSHBO-UHFFFAOYSA-N	-1	3	330.362	1.008	20	5		EDBDHM
COc1cc(C(=O)OCc2cc(=O)c([O-])co2)cc([N+](=O)[O-])c1C	ZINC000791690773	580799547	/nfs/dbraw/zinc/79/95/47/580799547.db2.gz	WDZSZLPTQCTEBL-UHFFFAOYSA-N	-1	3	335.268	1.928	20	5		EDBDHM
CC(C)N1CCCN(C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC1	ZINC000736474721	593011216	/nfs/dbraw/zinc/01/12/16/593011216.db2.gz	PSVHGUHHBOSKTM-UHFFFAOYSA-N	-1	3	335.360	1.849	20	5		EDBDHM
CCn1nc(C)c(C[N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)n1	ZINC000819599085	593760534	/nfs/dbraw/zinc/76/05/34/593760534.db2.gz	ZYJRVGAIXGZWIY-UHFFFAOYSA-N	-1	3	339.302	1.923	20	5		EDBDHM
C[C@@H](NC(=O)c1cc(-c2nnn[n-]2)cn1C)c1cccc([N+](=O)[O-])c1	ZINC000820385483	593815102	/nfs/dbraw/zinc/81/51/02/593815102.db2.gz	SJXZHOKLFXFVTD-SECBINFHSA-N	-1	3	341.331	1.604	20	5		EDBDHM
C[C@@H](NC(=O)c1cc(-c2nn[n-]n2)cn1C)c1cccc([N+](=O)[O-])c1	ZINC000820385483	593815103	/nfs/dbraw/zinc/81/51/03/593815103.db2.gz	SJXZHOKLFXFVTD-SECBINFHSA-N	-1	3	341.331	1.604	20	5		EDBDHM
COCCOC[C@H]1CCN(c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C1	ZINC000821691696	593916353	/nfs/dbraw/zinc/91/63/53/593916353.db2.gz	AQVSLWJSRQOPIG-NSHDSACASA-N	-1	3	348.363	1.264	20	5		EDBDHM
COCCOC[C@H]1CCN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C1	ZINC000821691696	593916355	/nfs/dbraw/zinc/91/63/55/593916355.db2.gz	AQVSLWJSRQOPIG-NSHDSACASA-N	-1	3	348.363	1.264	20	5		EDBDHM
Cc1nc2n(n1)CCC[C@@H]2Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000822461801	594052177	/nfs/dbraw/zinc/05/21/77/594052177.db2.gz	AJVKQEDDAXLYHQ-LBPRGKRZSA-N	-1	3	341.335	1.622	20	5		EDBDHM
Cc1nc2n(n1)CCC[C@@H]2Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000822461801	594052178	/nfs/dbraw/zinc/05/21/78/594052178.db2.gz	AJVKQEDDAXLYHQ-LBPRGKRZSA-N	-1	3	341.335	1.622	20	5		EDBDHM
NC(=O)c1ccc(CNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)o1	ZINC000822884890	594116817	/nfs/dbraw/zinc/11/68/17/594116817.db2.gz	CYGHNFIBNBWOLQ-UHFFFAOYSA-N	-1	3	329.276	1.079	20	5		EDBDHM
NC(=O)c1ccc(CNc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)o1	ZINC000822884890	594116818	/nfs/dbraw/zinc/11/68/18/594116818.db2.gz	CYGHNFIBNBWOLQ-UHFFFAOYSA-N	-1	3	329.276	1.079	20	5		EDBDHM
CC[C@@H](C)CS(=O)(=O)Oc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000825068106	594125094	/nfs/dbraw/zinc/12/50/94/594125094.db2.gz	PVHPVZMZRHLNPL-MRVPVSSYSA-N	-1	3	341.349	1.530	20	5		EDBDHM
CC[C@@H](C)CS(=O)(=O)Oc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000825068106	594125095	/nfs/dbraw/zinc/12/50/95/594125095.db2.gz	PVHPVZMZRHLNPL-MRVPVSSYSA-N	-1	3	341.349	1.530	20	5		EDBDHM
O=C(Oc1cc(F)cc([N+](=O)[O-])c1)c1ccc(-c2nnn[n-]2)cn1	ZINC000823445467	594202732	/nfs/dbraw/zinc/20/27/32/594202732.db2.gz	XBNGIJNLVHJFMJ-UHFFFAOYSA-N	-1	3	330.235	1.528	20	5		EDBDHM
O=C(Oc1cc(F)cc([N+](=O)[O-])c1)c1ccc(-c2nn[n-]n2)cn1	ZINC000823445467	594202734	/nfs/dbraw/zinc/20/27/34/594202734.db2.gz	XBNGIJNLVHJFMJ-UHFFFAOYSA-N	-1	3	330.235	1.528	20	5		EDBDHM
O=[N+]([O-])c1c(-c2nnn[n-]2)ccnc1NCCCNc1ccccn1	ZINC000823624771	594222545	/nfs/dbraw/zinc/22/25/45/594222545.db2.gz	IYEIFHXRVPZTTM-UHFFFAOYSA-N	-1	3	341.335	1.479	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NCCCOC[C@@H]1CCCO1	ZINC000823630519	594223083	/nfs/dbraw/zinc/22/30/83/594223083.db2.gz	ZIZBFJMPFYEBTJ-LBPRGKRZSA-N	-1	3	348.363	1.773	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NCCCOC[C@@H]1CCCO1	ZINC000823630519	594223084	/nfs/dbraw/zinc/22/30/84/594223084.db2.gz	ZIZBFJMPFYEBTJ-LBPRGKRZSA-N	-1	3	348.363	1.773	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CC[C@H](N2CC=CC2)C1	ZINC000823630467	594223133	/nfs/dbraw/zinc/22/31/33/594223133.db2.gz	XCMFSUZQBOJUAL-LBPRGKRZSA-N	-1	3	327.348	1.225	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC[C@@]3(O)CCCC[C@H]3C2)c(-c2nnn[n-]2)c1	ZINC000823647153	594224525	/nfs/dbraw/zinc/22/45/25/594224525.db2.gz	HDTSGQDMHFTAJZ-BONVTDFDSA-N	-1	3	345.363	1.301	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC[C@@]3(O)CCCC[C@H]3C2)c(-c2nn[n-]n2)c1	ZINC000823647153	594224526	/nfs/dbraw/zinc/22/45/26/594224526.db2.gz	HDTSGQDMHFTAJZ-BONVTDFDSA-N	-1	3	345.363	1.301	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCOC2CCOCC2)c(-c2nnn[n-]2)c1	ZINC000823651506	594224735	/nfs/dbraw/zinc/22/47/35/594224735.db2.gz	MOVGBTFUPFUZOR-UHFFFAOYSA-N	-1	3	349.351	1.168	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCOC2CCOCC2)c(-c2nn[n-]n2)c1	ZINC000823651506	594224736	/nfs/dbraw/zinc/22/47/36/594224736.db2.gz	MOVGBTFUPFUZOR-UHFFFAOYSA-N	-1	3	349.351	1.168	20	5		EDBDHM
CN(C(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1-c1nnn[n-]1	ZINC000825820428	594254884	/nfs/dbraw/zinc/25/48/84/594254884.db2.gz	DYYKEVZTUNPXKZ-UHFFFAOYSA-N	-1	3	338.327	1.980	20	5		EDBDHM
CN(C(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1-c1nn[n-]n1	ZINC000825820428	594254885	/nfs/dbraw/zinc/25/48/85/594254885.db2.gz	DYYKEVZTUNPXKZ-UHFFFAOYSA-N	-1	3	338.327	1.980	20	5		EDBDHM
COCCCOCCN(C)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000826157199	594352610	/nfs/dbraw/zinc/35/26/10/594352610.db2.gz	LEVDSWALXCEPTP-UHFFFAOYSA-N	-1	3	336.352	1.264	20	5		EDBDHM
COCCCOCCN(C)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000826157199	594352613	/nfs/dbraw/zinc/35/26/13/594352613.db2.gz	LEVDSWALXCEPTP-UHFFFAOYSA-N	-1	3	336.352	1.264	20	5		EDBDHM
C[C@@H]1C[C@H](NC(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CN1C1CC1	ZINC000828177379	594359221	/nfs/dbraw/zinc/35/92/21/594359221.db2.gz	PGTSFOCQLYNZSZ-SKDRFNHKSA-N	-1	3	333.344	1.648	20	5		EDBDHM
Cc1cc(-c2nnn[n-]2)ccc1COC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000826254100	594400524	/nfs/dbraw/zinc/40/05/24/594400524.db2.gz	ULUIIPWTMCCCRQ-UHFFFAOYSA-N	-1	3	343.303	1.174	20	5		EDBDHM
Cc1cc(-c2nn[n-]n2)ccc1COC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000826254100	594400525	/nfs/dbraw/zinc/40/05/25/594400525.db2.gz	ULUIIPWTMCCCRQ-UHFFFAOYSA-N	-1	3	343.303	1.174	20	5		EDBDHM
C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000828433771	594419141	/nfs/dbraw/zinc/41/91/41/594419141.db2.gz	ZXUKPLQJVWGAHN-XPTSAGLGSA-N	-1	3	333.344	1.506	20	5		EDBDHM
O=[N+]([O-])c1ccc([C@@H](O)COc2ccc(-c3nnn[n-]3)cc2)cc1	ZINC000826498182	594502609	/nfs/dbraw/zinc/50/26/09/594502609.db2.gz	KIUAPBQQOUXGCM-AWEZNQCLSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1ccc([C@@H](O)COc2ccc(-c3nn[n-]n3)cc2)cc1	ZINC000826498182	594502611	/nfs/dbraw/zinc/50/26/11/594502611.db2.gz	KIUAPBQQOUXGCM-AWEZNQCLSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=c1[n-]nc([C@@H]2CCCN(C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)o1	ZINC000829438059	594613178	/nfs/dbraw/zinc/61/31/78/594613178.db2.gz	ACEHIPBMFZYYHD-DGCLKSJQSA-N	-1	3	334.332	1.596	20	5		EDBDHM
O=C([O-])N1CCC[C@@H]1[C@H]1CCCN(CCn2ccc([N+](=O)[O-])n2)C1	ZINC000832004298	594718553	/nfs/dbraw/zinc/71/85/53/594718553.db2.gz	DVFCQNCVDPEZEC-QWHCGFSZSA-N	-1	3	337.380	1.646	20	5		EDBDHM
CC1(C)CCCN1CC[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000832755973	594774436	/nfs/dbraw/zinc/77/44/36/594774436.db2.gz	HTBUZVVCOVLHCE-UHFFFAOYSA-N	-1	3	345.396	1.887	20	5		EDBDHM
O=C([O-])N1CCC[C@H]1CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000834111253	595017617	/nfs/dbraw/zinc/01/76/17/595017617.db2.gz	DBHONUSZRLGGIW-AAEUAGOBSA-N	-1	3	335.364	1.618	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H](CO)CCF)c1	ZINC000846014813	595122914	/nfs/dbraw/zinc/12/29/14/595122914.db2.gz	SHONWAINZMWNPH-QMMMGPOBSA-N	-1	3	340.760	1.555	20	5		EDBDHM
CNc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)C[C@@H]1CCCOC1	ZINC000842586927	595133545	/nfs/dbraw/zinc/13/35/45/595133545.db2.gz	RRDZNDZXKCCYOG-SNVBAGLBSA-N	-1	3	329.378	1.805	20	5		EDBDHM
C[C@](O)(C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000848582966	595409083	/nfs/dbraw/zinc/40/90/83/595409083.db2.gz	MEKAUBRFWQWFGR-ZDUSSCGKSA-N	-1	3	330.287	1.844	20	5		EDBDHM
COC(=O)C1(C[N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000848588103	595410719	/nfs/dbraw/zinc/41/07/19/595410719.db2.gz	OWWDQUCISGWKOG-UHFFFAOYSA-N	-1	3	344.270	1.636	20	5		EDBDHM
O=C([N-]C[C@@H]1CCCNC1=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848590495	595411523	/nfs/dbraw/zinc/41/15/23/595411523.db2.gz	DJOFFZSNYXLZGN-VIFPVBQESA-N	-1	3	343.286	1.209	20	5		EDBDHM
CCO[C@H](CS(=O)(=O)[N-]c1ccc(N)c([N+](=O)[O-])c1)C1CC1	ZINC000863399763	596572304	/nfs/dbraw/zinc/57/23/04/596572304.db2.gz	BRKADTWIMRHXHM-CYBMUJFWSA-N	-1	3	329.378	1.734	20	5		EDBDHM
O=[N+]([O-])c1ccc[n-]c1=NNS(=O)(=O)c1ccc2c(c1)CCC2	ZINC000125552868	596951786	/nfs/dbraw/zinc/95/17/86/596951786.db2.gz	SIURBVMFCANOJQ-UHFFFAOYSA-N	-1	3	334.357	1.784	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)o1	ZINC000443975581	695979073	/nfs/dbraw/zinc/97/90/73/695979073.db2.gz	AECZURHDXDBGLV-UHFFFAOYSA-N	-1	3	336.329	1.851	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCCC[C@H]2O)c(Cl)c1	ZINC000052003562	214113371	/nfs/dbraw/zinc/11/33/71/214113371.db2.gz	SACZAQLXUWSDCI-GHMZBOCLSA-N	-1	3	334.781	1.830	20	5		EDBDHM
CC1CCN(C[C@H](O)CNc2ncc(C(=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000563206447	306323470	/nfs/dbraw/zinc/32/34/70/306323470.db2.gz	PXGGKBQBKDNYLZ-GFCCVEGCSA-N	-1	3	338.364	1.193	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nnc(C(F)(F)F)[n-]1	ZINC000126584877	138338307	/nfs/dbraw/zinc/33/83/07/138338307.db2.gz	FCIMNJABTDPLTI-UHFFFAOYSA-N	-1	3	333.230	1.265	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nc(C(F)(F)F)n[n-]1	ZINC000126584877	138338308	/nfs/dbraw/zinc/33/83/08/138338308.db2.gz	FCIMNJABTDPLTI-UHFFFAOYSA-N	-1	3	333.230	1.265	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC2(O)CCCCC2)c([N+](=O)[O-])c1	ZINC000159818558	138638413	/nfs/dbraw/zinc/63/84/13/138638413.db2.gz	JIIIZMZHVUPNMO-UHFFFAOYSA-N	-1	3	328.390	1.877	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]C1CCC(O)CC1	ZINC000035199980	213014814	/nfs/dbraw/zinc/01/48/14/213014814.db2.gz	QJVSDTBNJDSAOO-UHFFFAOYSA-N	-1	3	334.781	1.830	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1CCC[C@@H]2OCC[C@@H]21	ZINC000129228539	223033756	/nfs/dbraw/zinc/03/37/56/223033756.db2.gz	NSVFKVFAOJPAPZ-WZRBSPASSA-N	-1	3	326.374	1.831	20	5		EDBDHM
CCN(C)C(=O)[C@@H](C)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000188441780	284302165	/nfs/dbraw/zinc/30/21/65/284302165.db2.gz	FEXLAPWOIFGCSH-SNVBAGLBSA-N	-1	3	329.378	1.048	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)C=Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000491871359	255153630	/nfs/dbraw/zinc/15/36/30/255153630.db2.gz	PHFCOQHUHPLABV-OGOUPESXSA-N	-1	3	334.307	1.375	20	5		EDBDHM
O=C(C=Cc1ccccc1[N+](=O)[O-])N1CCc2c(=O)[n-]cnc2C1	ZINC000493332878	255204696	/nfs/dbraw/zinc/20/46/96/255204696.db2.gz	HCQAQSLPFUWQRE-WAYWQWQTSA-N	-1	3	326.312	1.689	20	5		EDBDHM
C/C=C\C[C@@H](CO)[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	ZINC000493910139	255225862	/nfs/dbraw/zinc/22/58/62/255225862.db2.gz	YZNHNXJBTBMLMN-TYRPZCRBSA-N	-1	3	348.352	1.348	20	5		EDBDHM
COc1cc(C(=O)Nc2cc(-c3nccn3C)[n-]n2)ccc1[N+](=O)[O-]	ZINC000119306221	221289260	/nfs/dbraw/zinc/28/92/60/221289260.db2.gz	JPJGXIHCLZCFLB-UHFFFAOYSA-N	-1	3	342.315	1.979	20	5		EDBDHM
COc1cc(C(=O)Nc2cc(-c3nccn3C)n[n-]2)ccc1[N+](=O)[O-]	ZINC000119306221	221289261	/nfs/dbraw/zinc/28/92/61/221289261.db2.gz	JPJGXIHCLZCFLB-UHFFFAOYSA-N	-1	3	342.315	1.979	20	5		EDBDHM
CCn1cnnc1C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000119687079	221378059	/nfs/dbraw/zinc/37/80/59/221378059.db2.gz	OWCUKWANBYTBBZ-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
Cc1ncc(S(=O)(=O)[N-]CCc2ccc([N+](=O)[O-])cc2)s1	ZINC000269972842	140026825	/nfs/dbraw/zinc/02/68/25/140026825.db2.gz	LKQGVUHCXCKCSX-UHFFFAOYSA-N	-1	3	327.387	1.881	20	5		EDBDHM
CC(C)c1nc([C@H](C)[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])n[nH]1	ZINC000270605512	140132885	/nfs/dbraw/zinc/13/28/85/140132885.db2.gz	WYWYLSJRPONJMN-VIFPVBQESA-N	-1	3	339.377	1.876	20	5		EDBDHM
CC(C)c1nnc([C@H](C)[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])[nH]1	ZINC000270605512	140132886	/nfs/dbraw/zinc/13/28/86/140132886.db2.gz	WYWYLSJRPONJMN-VIFPVBQESA-N	-1	3	339.377	1.876	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)c1ccn(C)n1	ZINC000416562090	304332145	/nfs/dbraw/zinc/33/21/45/304332145.db2.gz	PDJSPUIJBUAKCS-SECBINFHSA-N	-1	3	340.361	1.376	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H](CO)c1cccc(F)c1	ZINC000352880838	149201577	/nfs/dbraw/zinc/20/15/77/149201577.db2.gz	ILMVPJCWYIIJKN-LBPRGKRZSA-N	-1	3	340.332	1.746	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)[C@H]1CCCOC1	ZINC000355718033	150372951	/nfs/dbraw/zinc/37/29/51/150372951.db2.gz	XQKNSSKFEJQHPZ-QWRGUYRKSA-N	-1	3	344.389	1.697	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@]1(C)CCCOC1	ZINC000357419637	151026312	/nfs/dbraw/zinc/02/63/12/151026312.db2.gz	KXFUTAXOUMSFEM-CYBMUJFWSA-N	-1	3	330.362	1.451	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2ncccc2O)c(F)c1	ZINC000360010957	151885438	/nfs/dbraw/zinc/88/54/38/151885438.db2.gz	KNCLZRBZTHTHIN-UHFFFAOYSA-N	-1	3	327.293	1.313	20	5		EDBDHM
Cc1cc([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])c(=O)n(C)c1	ZINC000360629829	152131246	/nfs/dbraw/zinc/13/12/46/152131246.db2.gz	PBKWBUFSZAGLNH-UHFFFAOYSA-N	-1	3	337.357	1.711	20	5		EDBDHM
Cc1c(CC(=O)NCc2nnc(C(F)(F)F)[n-]2)cccc1[N+](=O)[O-]	ZINC000361011128	152278854	/nfs/dbraw/zinc/27/88/54/152278854.db2.gz	CCHDOEYCSUJQIW-UHFFFAOYSA-N	-1	3	343.265	1.899	20	5		EDBDHM
Cc1c(CC(=O)NCc2n[n-]c(C(F)(F)F)n2)cccc1[N+](=O)[O-]	ZINC000361011128	152278858	/nfs/dbraw/zinc/27/88/58/152278858.db2.gz	CCHDOEYCSUJQIW-UHFFFAOYSA-N	-1	3	343.265	1.899	20	5		EDBDHM
Cc1c(CC(=O)NCc2nc(C(F)(F)F)n[n-]2)cccc1[N+](=O)[O-]	ZINC000361011128	152278862	/nfs/dbraw/zinc/27/88/62/152278862.db2.gz	CCHDOEYCSUJQIW-UHFFFAOYSA-N	-1	3	343.265	1.899	20	5		EDBDHM
COc1cc(CN[C@@H]2CC(=O)N3CCCC[C@@H]23)c([N+](=O)[O-])cc1[O-]	ZINC000374590651	157338092	/nfs/dbraw/zinc/33/80/92/157338092.db2.gz	FBUHQKUPXNFGNG-NEPJUHHUSA-N	-1	3	335.360	1.552	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H](CO)C2CC2)c1[N+](=O)[O-]	ZINC000352559298	162253626	/nfs/dbraw/zinc/25/36/26/162253626.db2.gz	HFNUPSBVRFZGGO-LBPRGKRZSA-N	-1	3	328.390	1.508	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@@H](O)C(C)C)c1C	ZINC000121972676	287376501	/nfs/dbraw/zinc/37/65/01/287376501.db2.gz	CCRFQUFOSYWSEA-CYBMUJFWSA-N	-1	3	330.406	1.897	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)c2ncn(C)n2)c1C	ZINC000275687465	273119870	/nfs/dbraw/zinc/11/98/70/273119870.db2.gz	QFJKWSXHVYDQGH-JTQLQIEISA-N	-1	3	339.377	1.380	20	5		EDBDHM
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1cccc([O-])c1F	ZINC000155530732	287661119	/nfs/dbraw/zinc/66/11/19/287661119.db2.gz	SXPKTRRYJSHADY-UHFFFAOYSA-N	-1	3	333.275	1.808	20	5		EDBDHM
C[C@]1(C[C@@H]2CCCN2c2ncc([N+](=O)[O-])s2)NC(=O)[N-]C1=O	ZINC000286460052	288011281	/nfs/dbraw/zinc/01/12/81/288011281.db2.gz	SQCQTDYYTPMIMH-JVXZTZIISA-N	-1	3	325.350	1.008	20	5		EDBDHM
Cc1nc(S(=O)(=O)[N-]C(C)(C)c2ccccc2[N+](=O)[O-])cn1C	ZINC000291616995	289126359	/nfs/dbraw/zinc/12/63/59/289126359.db2.gz	BVQIUVOGRGBYOG-UHFFFAOYSA-N	-1	3	338.389	1.850	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl)C(N)=O	ZINC000292190934	289284504	/nfs/dbraw/zinc/28/45/04/289284504.db2.gz	QVEVTCUGDPKSMV-MRVPVSSYSA-N	-1	3	335.769	1.099	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C)[C@@H]1CCCOC1	ZINC000355754585	302049283	/nfs/dbraw/zinc/04/92/83/302049283.db2.gz	IUHUZFPSXGGLHW-VXGBXAGGSA-N	-1	3	328.390	1.997	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@]1(O)CCC[C@H]1C	ZINC000294563267	303124337	/nfs/dbraw/zinc/12/43/37/303124337.db2.gz	LPUCMZFAEBKECN-YGRLFVJLSA-N	-1	3	344.389	1.433	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](C)CCCO)cc1C	ZINC000295349711	303208354	/nfs/dbraw/zinc/20/83/54/303208354.db2.gz	RFWQVASXJCFMAJ-SNVBAGLBSA-N	-1	3	330.406	1.899	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2CC[C@@H](CO)C2)cc1[N+](=O)[O-]	ZINC000295845322	303274592	/nfs/dbraw/zinc/27/45/92/303274592.db2.gz	WRKKFBHQJXBSRR-BDAKNGLRSA-N	-1	3	348.352	1.182	20	5		EDBDHM
Cc1n[nH]cc1CCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000296090700	303294829	/nfs/dbraw/zinc/29/48/29/303294829.db2.gz	QNFMZXUFNOSAOM-UHFFFAOYSA-N	-1	3	342.352	1.677	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)[C@H]1CCCO1	ZINC000433453457	305109283	/nfs/dbraw/zinc/10/92/83/305109283.db2.gz	ZITFYKRVZAKNMA-ZIAGYGMSSA-N	-1	3	344.389	1.208	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)ccc1O	ZINC000436807690	305167603	/nfs/dbraw/zinc/16/76/03/305167603.db2.gz	FWCKWPPFXNNYJK-UHFFFAOYSA-N	-1	3	347.283	1.830	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1C[C@H](OC)C1(C)C	ZINC000440407342	305205799	/nfs/dbraw/zinc/20/57/99/305205799.db2.gz	ZCOZRAOPNARTQO-STQMWFEESA-N	-1	3	344.389	1.695	20	5		EDBDHM
COC[C@](C)(O)CC[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000451645564	305358766	/nfs/dbraw/zinc/35/87/66/305358766.db2.gz	AVSOPBGWVGJTRR-CQSZACIVSA-N	-1	3	346.405	1.277	20	5		EDBDHM
CN1CCC[C@@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000108406058	441451553	/nfs/dbraw/zinc/45/15/53/441451553.db2.gz	KQVAFFUBYJBSSE-JTQLQIEISA-N	-1	3	331.369	1.354	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@@H]2CCC[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000121828726	441790028	/nfs/dbraw/zinc/79/00/28/441790028.db2.gz	GKRYEQNYCRZOPK-NEPJUHHUSA-N	-1	3	328.390	1.733	20	5		EDBDHM
O=C(c1ccc([O-])c([N+](=O)[O-])c1)N1CCN(c2ccncc2)CC1	ZINC000164033882	442188181	/nfs/dbraw/zinc/18/81/81/442188181.db2.gz	SRJUWSJDRAKGDW-UHFFFAOYSA-N	-1	3	328.328	1.658	20	5		EDBDHM
Cc1cccc2c(=O)c(C(=O)NCCn3cc([N+](=O)[O-])cn3)c[n-]c12	ZINC000165113678	442206340	/nfs/dbraw/zinc/20/63/40/442206340.db2.gz	IJSNAQZZPUBVAR-UHFFFAOYSA-N	-1	3	341.327	1.784	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]C[C@H]2CC[C@H](O)C2)cc1[N+](=O)[O-]	ZINC000188352313	442742354	/nfs/dbraw/zinc/74/23/54/442742354.db2.gz	RZJXDCCRNOOZAS-UWVGGRQHSA-N	-1	3	332.353	1.482	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1[C@@H]2CCO[C@H]2C1(C)C	ZINC000246689577	442803460	/nfs/dbraw/zinc/80/34/60/442803460.db2.gz	BNNHGNQDAVBRHE-ZLKJLUDKSA-N	-1	3	340.401	1.995	20	5		EDBDHM
C[C@@H](CO[C@@H]1CCOC1)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000267888280	442778306	/nfs/dbraw/zinc/77/83/06/442778306.db2.gz	QVVDQXUERNQDHW-WDEREUQCSA-N	-1	3	330.362	1.067	20	5		EDBDHM
COCc1nc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)n[n-]1	ZINC000268481641	443004948	/nfs/dbraw/zinc/00/49/48/443004948.db2.gz	LCHPDKSGEYTUIB-MRVPVSSYSA-N	-1	3	337.361	1.979	20	5		EDBDHM
C[C@@]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1)(C(N)=O)c1ccccc1	ZINC000185742622	443248550	/nfs/dbraw/zinc/24/85/50/443248550.db2.gz	YTCRJYWMIGUCKQ-HNNXBMFYSA-N	-1	3	349.368	1.274	20	5		EDBDHM
O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)[N-]CCCCO	ZINC000416475057	319430087	/nfs/dbraw/zinc/43/00/87/319430087.db2.gz	IIOIDLXZROIPHO-UHFFFAOYSA-N	-1	3	342.295	1.664	20	5		EDBDHM
COC[C@@H](C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])OC	ZINC000272641165	443392586	/nfs/dbraw/zinc/39/25/86/443392586.db2.gz	CPYHGPDITHKJDO-LLVKDONJSA-N	-1	3	332.378	1.151	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2CCC(=O)N[C@H]2C)c1[N+](=O)[O-]	ZINC000282727792	443417843	/nfs/dbraw/zinc/41/78/43/443417843.db2.gz	ZOZZMMAQZIFOJU-QWRGUYRKSA-N	-1	3	341.389	1.157	20	5		EDBDHM
Cn1nc([C@H]2CCCOC2)cc1NC(=O)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000279261348	443543687	/nfs/dbraw/zinc/54/36/87/443543687.db2.gz	IQVGMDGNMDPWRM-VIFPVBQESA-N	-1	3	347.331	1.575	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H](C)c2ncn(C)n2)cc1[N+](=O)[O-]	ZINC000444223923	320121062	/nfs/dbraw/zinc/12/10/62/320121062.db2.gz	NYNLYYGLKRIMOQ-LURJTMIESA-N	-1	3	331.379	1.133	20	5		EDBDHM
CCN1CCN(CC(C)(C)NCc2cc([O-])ccc2[N+](=O)[O-])CC1	ZINC000449744980	320204053	/nfs/dbraw/zinc/20/40/53/320204053.db2.gz	KNFUQLIIWMGWOZ-UHFFFAOYSA-N	-1	3	336.436	1.806	20	5		EDBDHM
C[C@H]1C[C@H]1N1CCN(C(=O)c2cc([N+](=O)[O-])c[n-]c2=O)C[C@@H](C)C1	ZINC000452121567	320243123	/nfs/dbraw/zinc/24/31/23/320243123.db2.gz	KNHKYAQQTMJNED-COPLHBTASA-N	-1	3	334.376	1.498	20	5		EDBDHM
Cc1ocnc1C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276810288	443835793	/nfs/dbraw/zinc/83/57/93/443835793.db2.gz	MBBSWRLSXUIWFU-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])on1	ZINC000544714694	320792405	/nfs/dbraw/zinc/79/24/05/320792405.db2.gz	MUBGMYOJPFBTBI-UHFFFAOYSA-N	-1	3	325.346	1.765	20	5		EDBDHM
CN(C)[C@@H](CNC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)c1ccsc1	ZINC000278006591	444081933	/nfs/dbraw/zinc/08/19/33/444081933.db2.gz	YBMFEDVHLDTIHM-LBPRGKRZSA-N	-1	3	336.373	1.790	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)[C@H](C)OC	ZINC000289481354	444154700	/nfs/dbraw/zinc/15/47/00/444154700.db2.gz	IHKCAQKDNGBYPX-BDAKNGLRSA-N	-1	3	346.361	1.083	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCNc1cccc(F)n1	ZINC000301313521	444163400	/nfs/dbraw/zinc/16/34/00/444163400.db2.gz	KFWSAZXYLALAGP-UHFFFAOYSA-N	-1	3	340.336	1.519	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H](C)[C@H](C)OC)cc1[N+](=O)[O-]	ZINC000289716184	444194404	/nfs/dbraw/zinc/19/44/04/444194404.db2.gz	WXIKBZLMUOSKQJ-SFYZADRCSA-N	-1	3	336.341	1.444	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCCC[C@@H]2CO)c(F)c1	ZINC000318925772	444321895	/nfs/dbraw/zinc/32/18/95/444321895.db2.gz	ORHDQTPGDKOHPG-SKDRFNHKSA-N	-1	3	332.353	1.563	20	5		EDBDHM
Cc1nccn1CCC[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000337936276	444464888	/nfs/dbraw/zinc/46/48/88/444464888.db2.gz	OAVRRAMXRURLDH-UHFFFAOYSA-N	-1	3	338.389	1.777	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CNC(=O)Cc1c(C)nc(C)[n-]c1=O	ZINC000342149331	444534727	/nfs/dbraw/zinc/53/47/27/444534727.db2.gz	MGWBDLBOYMIOFI-UHFFFAOYSA-N	-1	3	346.343	1.575	20	5		EDBDHM
COc1cccc(C(=O)[N-]c2ncnn2-c2ccccc2)c1[N+](=O)[O-]	ZINC000342474641	444706700	/nfs/dbraw/zinc/70/67/00/444706700.db2.gz	FTECIUKTSBQPMS-UHFFFAOYSA-N	-1	3	339.311	1.858	20	5		EDBDHM
COCC[C@@](C)(O)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000342497583	444717195	/nfs/dbraw/zinc/71/71/95/444717195.db2.gz	AMQGJQHDJQAZFE-LLVKDONJSA-N	-1	3	338.407	1.031	20	5		EDBDHM
Cc1noc([C@H](C)[N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)n1	ZINC000338900697	444920999	/nfs/dbraw/zinc/92/09/99/444920999.db2.gz	KPTBYNVZEPGXEB-QMMMGPOBSA-N	-1	3	326.334	1.467	20	5		EDBDHM
COc1cc(CNC[C@H]2CCCCS2(=O)=O)c([N+](=O)[O-])cc1[O-]	ZINC000344371556	444925181	/nfs/dbraw/zinc/92/51/81/444925181.db2.gz	YZXASSOEPXJNQK-LLVKDONJSA-N	-1	3	344.389	1.366	20	5		EDBDHM
CC(C)OC(=O)C[C@H](NC(=O)c1c[n-]nn1)c1ccccc1[N+](=O)[O-]	ZINC000341798488	445006503	/nfs/dbraw/zinc/00/65/03/445006503.db2.gz	XCUGEMFOZKORFI-NSHDSACASA-N	-1	3	347.331	1.526	20	5		EDBDHM
CC(C)OC(=O)C[C@H](NC(=O)c1cnn[n-]1)c1ccccc1[N+](=O)[O-]	ZINC000341798488	445006505	/nfs/dbraw/zinc/00/65/05/445006505.db2.gz	XCUGEMFOZKORFI-NSHDSACASA-N	-1	3	347.331	1.526	20	5		EDBDHM
CC(C)OC(=O)C[C@H](NC(=O)c1cn[n-]n1)c1ccccc1[N+](=O)[O-]	ZINC000341798488	445006508	/nfs/dbraw/zinc/00/65/08/445006508.db2.gz	XCUGEMFOZKORFI-NSHDSACASA-N	-1	3	347.331	1.526	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCc2nccnc2C)c([N+](=O)[O-])c1	ZINC000339059740	445013133	/nfs/dbraw/zinc/01/31/33/445013133.db2.gz	ORUAWGUZQFTYKI-UHFFFAOYSA-N	-1	3	336.373	1.523	20	5		EDBDHM
CS(=O)(=O)[N-]c1ccc(C(=O)NCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000341868351	445042564	/nfs/dbraw/zinc/04/25/64/445042564.db2.gz	OGKWKDAKIGSMJA-UHFFFAOYSA-N	-1	3	349.368	1.896	20	5		EDBDHM
CN(C)C(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)c1	ZINC000344624291	445091792	/nfs/dbraw/zinc/09/17/92/445091792.db2.gz	IJHJJOPEXZIHQN-UHFFFAOYSA-N	-1	3	330.300	1.650	20	5		EDBDHM
O=[N+]([O-])c1ccc(-c2noc([N-][C@@H](CO)CC(F)(F)F)n2)cc1	ZINC000339698858	445161880	/nfs/dbraw/zinc/16/18/80/445161880.db2.gz	ZHCATYDUHYJPOZ-MRVPVSSYSA-N	-1	3	332.238	2.370	20	5		EDBDHM
O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1c[n-]nc1-c1ccncc1	ZINC000354492437	445261006	/nfs/dbraw/zinc/26/10/06/445261006.db2.gz	BTRDHMJRWUJHFA-UHFFFAOYSA-N	-1	3	349.310	2.509	20	5		EDBDHM
O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1cn[n-]c1-c1ccncc1	ZINC000354492437	445261009	/nfs/dbraw/zinc/26/10/09/445261009.db2.gz	BTRDHMJRWUJHFA-UHFFFAOYSA-N	-1	3	349.310	2.509	20	5		EDBDHM
COc1cc(CCO)ccc1NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000349147144	445522645	/nfs/dbraw/zinc/52/26/45/445522645.db2.gz	ZWBXWNHFIASJEC-UHFFFAOYSA-N	-1	3	333.300	1.491	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]Cc1ncnn1C(C)C	ZINC000357232379	445495808	/nfs/dbraw/zinc/49/58/08/445495808.db2.gz	ADQPNVFMGVQXKD-UHFFFAOYSA-N	-1	3	339.377	1.554	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCN2CC=CCC2)cc1[N+](=O)[O-]	ZINC000360065241	445551332	/nfs/dbraw/zinc/55/13/32/445551332.db2.gz	ZOQGWZJVIIAPPS-UHFFFAOYSA-N	-1	3	331.419	1.505	20	5		EDBDHM
CCSc1nnc([N-]C(=O)c2cc([N+](=O)[O-])cnc2N)s1	ZINC000350106337	445770392	/nfs/dbraw/zinc/77/03/92/445770392.db2.gz	RMSNHYYGQGPBTI-UHFFFAOYSA-N	-1	3	326.363	1.788	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CCN(C2CC2)C1	ZINC000354282846	446078854	/nfs/dbraw/zinc/07/88/54/446078854.db2.gz	PQVGNAGFTJNCKH-NSHDSACASA-N	-1	3	325.390	1.418	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H]2CCCC(=O)N2)c1C	ZINC000433444926	446573553	/nfs/dbraw/zinc/57/35/53/446573553.db2.gz	WXXSBIMPEMGKKQ-NSHDSACASA-N	-1	3	341.389	1.159	20	5		EDBDHM
Cc1cc(C(=O)Nc2cccnc2-n2cccn2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375092135	446574618	/nfs/dbraw/zinc/57/46/18/446574618.db2.gz	XFHZHJCFIUUXEB-UHFFFAOYSA-N	-1	3	340.299	1.837	20	5		EDBDHM
COC1([C@H](C)[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCOCC1	ZINC000420767724	446805787	/nfs/dbraw/zinc/80/57/87/446805787.db2.gz	VJPBGCFHPNNGRS-NSHDSACASA-N	-1	3	344.389	1.457	20	5		EDBDHM
O=[N+]([O-])c1ccc(-c2noc([N-][C@@H](CO)[C@@H]3CCCOC3)n2)cc1	ZINC000413535202	447209171	/nfs/dbraw/zinc/20/91/71/447209171.db2.gz	DMYJYPWQXMOAMS-YPMHNXCESA-N	-1	3	334.332	1.844	20	5		EDBDHM
O=C([N-]c1nc2n(n1)CCCC2)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000457116983	447522411	/nfs/dbraw/zinc/52/24/11/447522411.db2.gz	FNEDRCBSZCABJR-UHFFFAOYSA-N	-1	3	331.288	1.504	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)Nc2cccc(-c3nnn[n-]3)c2)n1	ZINC000427508096	447611182	/nfs/dbraw/zinc/61/11/82/447611182.db2.gz	XMYZURRRQJNQCY-UHFFFAOYSA-N	-1	3	328.292	1.244	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)Nc2cccc(-c3nn[n-]n3)c2)n1	ZINC000427508096	447611184	/nfs/dbraw/zinc/61/11/84/447611184.db2.gz	XMYZURRRQJNQCY-UHFFFAOYSA-N	-1	3	328.292	1.244	20	5		EDBDHM
O=c1cc(CN2CCc3ncc([N+](=O)[O-])cc3C2)nc(C2CC2)[n-]1	ZINC000459401987	447653081	/nfs/dbraw/zinc/65/30/81/447653081.db2.gz	OFODTBKKHIXCND-UHFFFAOYSA-N	-1	3	327.344	1.921	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CC23CCOCC3)cc1[N+](=O)[O-]	ZINC000451895568	447776473	/nfs/dbraw/zinc/77/64/73/447776473.db2.gz	YHTKVTDLDSTCFO-JTQLQIEISA-N	-1	3	332.403	1.812	20	5		EDBDHM
CCO[C@@H]1COC[C@H]1[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000452038503	447807770	/nfs/dbraw/zinc/80/77/70/447807770.db2.gz	MMUSDGKSDDJOCK-VXGBXAGGSA-N	-1	3	344.389	1.294	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2	ZINC000523695371	447901430	/nfs/dbraw/zinc/90/14/30/447901430.db2.gz	YOGUKHLSLBPVTR-SNVBAGLBSA-N	-1	3	331.332	1.403	20	5		EDBDHM
O=C([O-])CCN(CCOc1ccccc1[N+](=O)[O-])C[C@H]1CCCO1	ZINC000566920350	448587032	/nfs/dbraw/zinc/58/70/32/448587032.db2.gz	LVUQKMAKCZWYEI-CYBMUJFWSA-N	-1	3	338.360	1.929	20	5		EDBDHM
O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCCCc1cc(=O)[nH][n-]1	ZINC000588876153	448944147	/nfs/dbraw/zinc/94/41/47/448944147.db2.gz	YEUHYLDNVXRJPM-UHFFFAOYSA-N	-1	3	343.343	1.391	20	5		EDBDHM
CC(C)[C@@H](O)C(C)(C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593568116	449077438	/nfs/dbraw/zinc/07/74/38/449077438.db2.gz	TTYHZKMYRURDDX-GFCCVEGCSA-N	-1	3	331.394	1.311	20	5		EDBDHM
CCC[N@@H+](CC)C[C@H](C)[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000522037781	449045949	/nfs/dbraw/zinc/04/59/49/449045949.db2.gz	PVCLPAFUKJFTHC-NSHDSACASA-N	-1	3	330.410	1.389	20	5		EDBDHM
CCCN(CC)C[C@H](C)[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000522037781	449045954	/nfs/dbraw/zinc/04/59/54/449045954.db2.gz	PVCLPAFUKJFTHC-NSHDSACASA-N	-1	3	330.410	1.389	20	5		EDBDHM
CC1(C)CCC[C@](O)(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000593589605	449092719	/nfs/dbraw/zinc/09/27/19/449092719.db2.gz	WFPNPYNVLFRSQC-CQSZACIVSA-N	-1	3	343.405	1.599	20	5		EDBDHM
CO[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C12CCC2	ZINC000593605789	449103488	/nfs/dbraw/zinc/10/34/88/449103488.db2.gz	KQUWOCSVGFIVFB-QWRGUYRKSA-N	-1	3	327.362	1.226	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC[C@]2(O)CCOC2)c1[N+](=O)[O-]	ZINC000593638191	449123207	/nfs/dbraw/zinc/12/32/07/449123207.db2.gz	ZEXSERHRYNWXQB-AWEZNQCLSA-N	-1	3	344.389	1.031	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H](C)c2nncn2C)c(F)cc1[N+](=O)[O-]	ZINC000590591449	449207259	/nfs/dbraw/zinc/20/72/59/449207259.db2.gz	OQUKSLKKSKMEFH-MRVPVSSYSA-N	-1	3	343.340	1.210	20	5		EDBDHM
Cc1nc(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)cs1	ZINC000593527674	449325351	/nfs/dbraw/zinc/32/53/51/449325351.db2.gz	SFYAUUIQEVUUGN-UHFFFAOYSA-N	-1	3	328.375	1.276	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]C1(CF)CCOCC1	ZINC000590760293	449278368	/nfs/dbraw/zinc/27/83/68/449278368.db2.gz	GDRNVFDRVZLHBY-UHFFFAOYSA-N	-1	3	348.352	1.400	20	5		EDBDHM
CC(C)[C@@H]1OCCC[C@@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593558746	449348681	/nfs/dbraw/zinc/34/86/81/449348681.db2.gz	JZDFXRYOLVIEJK-RISCZKNCSA-N	-1	3	343.405	1.719	20	5		EDBDHM
CC(C)[C@H]1OCCC[C@@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593558739	449349026	/nfs/dbraw/zinc/34/90/26/449349026.db2.gz	JZDFXRYOLVIEJK-BXUZGUMPSA-N	-1	3	343.405	1.719	20	5		EDBDHM
Cc1cnc([C@@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)s1	ZINC000593559479	449349843	/nfs/dbraw/zinc/34/98/43/449349843.db2.gz	PKZYEFBKVHMLGS-MRVPVSSYSA-N	-1	3	328.375	1.794	20	5		EDBDHM
CCS(=O)(=O)N1CCC(CNc2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596197476	449409529	/nfs/dbraw/zinc/40/95/29/449409529.db2.gz	DMXHZIVBDYULRY-UHFFFAOYSA-N	-1	3	344.393	1.169	20	5		EDBDHM
CCn1ccc(C[N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)n1	ZINC000598622191	449500462	/nfs/dbraw/zinc/50/04/62/449500462.db2.gz	YRFWQUKORAVAJM-UHFFFAOYSA-N	-1	3	338.389	1.907	20	5		EDBDHM
CCN1CCCC[C@H]1C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594756194	449670710	/nfs/dbraw/zinc/67/07/10/449670710.db2.gz	ZQJPGQZTYWSOGF-NSHDSACASA-N	-1	3	328.394	1.143	20	5		EDBDHM
COC[C@H](CC[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])OC	ZINC000594805632	449717765	/nfs/dbraw/zinc/71/77/65/449717765.db2.gz	UBFJRDVBTVSSPT-LBPRGKRZSA-N	-1	3	346.405	1.541	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2C[C@H](O)C23CCC3)c(F)c1	ZINC000594865273	449778770	/nfs/dbraw/zinc/77/87/70/449778770.db2.gz	NWFRLTNBCQELEZ-NEPJUHHUSA-N	-1	3	330.337	1.316	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H](CO)CC2CC2)c1[N+](=O)[O-]	ZINC000594866694	449781409	/nfs/dbraw/zinc/78/14/09/449781409.db2.gz	YLMKBAAYCMQBGK-CYBMUJFWSA-N	-1	3	342.417	1.899	20	5		EDBDHM
C[C@H]1CCC[C@H](C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])O1	ZINC000594851262	449759459	/nfs/dbraw/zinc/75/94/59/449759459.db2.gz	INLRITIVMANTJN-WCQYABFASA-N	-1	3	328.390	1.972	20	5		EDBDHM
Cn1ncc2c1nc(CN1CCc3c1cccc3[N+](=O)[O-])[n-]c2=O	ZINC000612740594	449860078	/nfs/dbraw/zinc/86/00/78/449860078.db2.gz	ZSHMDGQOQRLHLD-UHFFFAOYSA-N	-1	3	326.316	1.540	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H](O)[C@@H]2CCCO2)c1[N+](=O)[O-]	ZINC000599390692	449937724	/nfs/dbraw/zinc/93/77/24/449937724.db2.gz	DSHUUGQDKLGSOC-RYUDHWBXSA-N	-1	3	344.389	1.030	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@H]2CC[C@H](C)O2)c(F)cc1[N+](=O)[O-]	ZINC000601434972	449956455	/nfs/dbraw/zinc/95/64/55/449956455.db2.gz	MBRHJNIXEZFWTF-VHSXEESVSA-N	-1	3	332.353	1.888	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@]23C[C@@H]2COC3(C)C)c([N+](=O)[O-])s1	ZINC000601473593	449996693	/nfs/dbraw/zinc/99/66/93/449996693.db2.gz	HVXBOWLFCRROML-PELKAZGASA-N	-1	3	332.403	1.811	20	5		EDBDHM
NC(=O)c1csc([N-]C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)n1	ZINC000609882880	450110945	/nfs/dbraw/zinc/11/09/45/450110945.db2.gz	CDXGPPVTJLUWKZ-UHFFFAOYSA-N	-1	3	336.285	1.131	20	5		EDBDHM
COCCC1([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2OC)CCC1	ZINC000619504607	450494172	/nfs/dbraw/zinc/49/41/72/450494172.db2.gz	VNRJDNXLXONJAO-UHFFFAOYSA-N	-1	3	344.389	1.841	20	5		EDBDHM
Cc1csc(C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])n1	ZINC000130051705	534817003	/nfs/dbraw/zinc/81/70/03/534817003.db2.gz	FXHRAHOXHNIUKX-UHFFFAOYSA-N	-1	3	327.387	1.979	20	5		EDBDHM
C/C=C/C[C@@H](CO)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000190162037	526271122	/nfs/dbraw/zinc/27/11/22/526271122.db2.gz	YAYKWQGMZDZYRD-ITKZLYELSA-N	-1	3	328.390	1.817	20	5		EDBDHM
CCO[C@@H]1COCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000352979668	535759464	/nfs/dbraw/zinc/75/94/64/535759464.db2.gz	FKXQUZAELURZCW-VXGBXAGGSA-N	-1	3	348.352	1.206	20	5		EDBDHM
O=C(OCc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)C(=O)[N-]C2=O	ZINC000729295303	578563210	/nfs/dbraw/zinc/56/32/10/578563210.db2.gz	ZUCLDLGGWYMKBF-UHFFFAOYSA-N	-1	3	326.264	1.835	20	5		EDBDHM
CCn1cc(CN(C)c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])cn1	ZINC000736721425	579015163	/nfs/dbraw/zinc/01/51/63/579015163.db2.gz	HFKXGWYPBKXYOW-UHFFFAOYSA-N	-1	3	328.336	1.628	20	5		EDBDHM
CCn1cc(CN(C)c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])cn1	ZINC000736721425	579015164	/nfs/dbraw/zinc/01/51/64/579015164.db2.gz	HFKXGWYPBKXYOW-UHFFFAOYSA-N	-1	3	328.336	1.628	20	5		EDBDHM
Cc1ccc([C@H](O)CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])o1	ZINC000737319285	579071406	/nfs/dbraw/zinc/07/14/06/579071406.db2.gz	GYHPQTADIMSOEY-GFCCVEGCSA-N	-1	3	330.304	1.822	20	5		EDBDHM
Cc1ccc([C@H](O)CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])o1	ZINC000737319285	579071407	/nfs/dbraw/zinc/07/14/07/579071407.db2.gz	GYHPQTADIMSOEY-GFCCVEGCSA-N	-1	3	330.304	1.822	20	5		EDBDHM
Cc1noc(CCCNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])n1	ZINC000737535629	579106849	/nfs/dbraw/zinc/10/68/49/579106849.db2.gz	ULWAONRHKJCUOU-UHFFFAOYSA-N	-1	3	330.308	1.511	20	5		EDBDHM
Cc1noc(CCCNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])n1	ZINC000737535629	579106850	/nfs/dbraw/zinc/10/68/50/579106850.db2.gz	ULWAONRHKJCUOU-UHFFFAOYSA-N	-1	3	330.308	1.511	20	5		EDBDHM
Cn1cc([C@@H]2CCCN2c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])cn1	ZINC000737605993	579119021	/nfs/dbraw/zinc/11/90/21/579119021.db2.gz	PGMXEJJPNVNQBH-LBPRGKRZSA-N	-1	3	340.347	1.850	20	5		EDBDHM
Cn1cc([C@@H]2CCCN2c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])cn1	ZINC000737605993	579119022	/nfs/dbraw/zinc/11/90/22/579119022.db2.gz	PGMXEJJPNVNQBH-LBPRGKRZSA-N	-1	3	340.347	1.850	20	5		EDBDHM
COc1cc(C)[nH]c(=N[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])n1	ZINC000747616991	579650888	/nfs/dbraw/zinc/65/08/88/579650888.db2.gz	KRGHLHVXEQYXNM-UHFFFAOYSA-N	-1	3	339.333	1.007	20	5		EDBDHM
O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCc2c(=O)[n-]cnc2C1	ZINC000752774096	579865506	/nfs/dbraw/zinc/86/55/06/579865506.db2.gz	XTIHVBHWHPHQJK-UHFFFAOYSA-N	-1	3	334.719	1.942	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCC1(C)OCCO1	ZINC000759115958	579998917	/nfs/dbraw/zinc/99/89/17/579998917.db2.gz	OXZDTOYGSLPNSY-UHFFFAOYSA-N	-1	3	346.361	1.035	20	5		EDBDHM
CC(C)(C)[C@H]([N-]S(C)(=O)=O)C(=O)OCc1ccc([N+](=O)[O-])cc1	ZINC000770098786	580252784	/nfs/dbraw/zinc/25/27/84/580252784.db2.gz	LWDQENFQOWXNIS-GFCCVEGCSA-N	-1	3	344.389	1.602	20	5		EDBDHM
CCOC(=O)N1CC[C@@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000770282925	580257280	/nfs/dbraw/zinc/25/72/80/580257280.db2.gz	KCHMJPKIJNRYBE-MRVPVSSYSA-N	-1	3	349.390	1.165	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CC[S@](C)=O)c1	ZINC000779892076	580501260	/nfs/dbraw/zinc/50/12/60/580501260.db2.gz	CAINSYIGYORECO-IBGZPJMESA-N	-1	3	340.810	1.213	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCN2CCC[C@@H]2C)c1C	ZINC000780868258	580536165	/nfs/dbraw/zinc/53/61/65/580536165.db2.gz	RSARVJGQUBLOEI-LBPRGKRZSA-N	-1	3	341.433	1.974	20	5		EDBDHM
O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cc2n[n-]nc2cc1F	ZINC000781890219	580559483	/nfs/dbraw/zinc/55/94/83/580559483.db2.gz	NTCQKJJPUVBTCY-UHFFFAOYSA-N	-1	3	344.306	1.847	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H](O)c2ccco2)c1[N+](=O)[O-]	ZINC000790853627	580780045	/nfs/dbraw/zinc/78/00/45/580780045.db2.gz	VHXWFTSWBJENEH-NSHDSACASA-N	-1	3	340.357	1.817	20	5		EDBDHM
CCOc1cc(OS(=O)(=O)c2cn[n-]c2C)ccc1[N+](=O)[O-]	ZINC000790925554	580781413	/nfs/dbraw/zinc/78/14/13/580781413.db2.gz	TXWABVPCZWWSPO-UHFFFAOYSA-N	-1	3	327.318	1.793	20	5		EDBDHM
COc1cc(OS(=O)(=O)c2c(C)n[n-]c2C)ccc1[N+](=O)[O-]	ZINC000795215115	580916110	/nfs/dbraw/zinc/91/61/10/580916110.db2.gz	OVWTYWXNQXSSRX-UHFFFAOYSA-N	-1	3	327.318	1.711	20	5		EDBDHM
O=[N+]([O-])c1ccc[n-]c1=NNS(=O)(=O)c1cccc2c1OCO2	ZINC000800838212	581059255	/nfs/dbraw/zinc/05/92/55/581059255.db2.gz	XQPRNSCDZVFCQN-UHFFFAOYSA-N	-1	3	338.301	1.024	20	5		EDBDHM
COc1c([O-])ccc(CN2CC[C@H]3CC[C@@H](C2)[S@]3=O)c1[N+](=O)[O-]	ZINC000895627944	591235689	/nfs/dbraw/zinc/23/56/89/591235689.db2.gz	IXGYDCMOTMBXDL-WCBZVUCDSA-N	-1	3	340.401	1.794	20	5		EDBDHM
COc1c([O-])ccc(CN2[C@H](C)C(=O)N(C)[C@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000896074759	591337651	/nfs/dbraw/zinc/33/76/51/591337651.db2.gz	WHUSWOZIDCYOGL-GMTAPVOTSA-N	-1	3	337.376	1.749	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2COC[C@H]2C2CC2)c1[N+](=O)[O-]	ZINC000908412222	592485951	/nfs/dbraw/zinc/48/59/51/592485951.db2.gz	VAHXQWXZMDUXDC-STQMWFEESA-N	-1	3	340.401	1.915	20	5		EDBDHM
COC(=O)[C@H]1CCCN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000736910641	593044010	/nfs/dbraw/zinc/04/40/10/593044010.db2.gz	QAZZBSINNYWPAF-JTQLQIEISA-N	-1	3	332.320	1.164	20	5		EDBDHM
COC(=O)[C@H]1CCCN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1	ZINC000736910641	593044012	/nfs/dbraw/zinc/04/40/12/593044012.db2.gz	QAZZBSINNYWPAF-JTQLQIEISA-N	-1	3	332.320	1.164	20	5		EDBDHM
O=[N+]([O-])c1cc(F)c(S(=O)(=O)[N-]CCc2nc[nH]n2)cc1Cl	ZINC000809824668	593362526	/nfs/dbraw/zinc/36/25/26/593362526.db2.gz	FLMLBTDFQGOARM-UHFFFAOYSA-N	-1	3	349.731	1.026	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@@H](CO)Cc2ccco2)cs1	ZINC000768847516	593442672	/nfs/dbraw/zinc/44/26/72/593442672.db2.gz	NARLALXELAOFRL-VIFPVBQESA-N	-1	3	346.386	1.379	20	5		EDBDHM
Cn1nc(Br)cc1NC(=O)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000816712441	593543013	/nfs/dbraw/zinc/54/30/13/593543013.db2.gz	ZOHSPAGQWLGWTJ-UHFFFAOYSA-N	-1	3	342.109	1.444	20	5		EDBDHM
CC(C)(O)CNc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000819991232	593781810	/nfs/dbraw/zinc/78/18/10/593781810.db2.gz	CLYKGQFMLDLNOY-UHFFFAOYSA-N	-1	3	329.320	1.506	20	5		EDBDHM
CC(C)(O)CNc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000819991232	593781811	/nfs/dbraw/zinc/78/18/11/593781811.db2.gz	CLYKGQFMLDLNOY-UHFFFAOYSA-N	-1	3	329.320	1.506	20	5		EDBDHM
CC(C)OC(=O)[C@H](C)N(C)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820141813	593794733	/nfs/dbraw/zinc/79/47/33/593794733.db2.gz	AQCQHANJRYAWQW-VIFPVBQESA-N	-1	3	334.336	1.551	20	5		EDBDHM
CC(C)OC(=O)[C@H](C)N(C)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820141813	593794734	/nfs/dbraw/zinc/79/47/34/593794734.db2.gz	AQCQHANJRYAWQW-VIFPVBQESA-N	-1	3	334.336	1.551	20	5		EDBDHM
CO[C@]1(C)C[C@H](Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)C1(C)C	ZINC000821679197	593909145	/nfs/dbraw/zinc/90/91/45/593909145.db2.gz	YIVRGHUNDOZXSZ-IINYFYTJSA-N	-1	3	333.352	1.785	20	5		EDBDHM
CO[C@]1(C)C[C@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)C1(C)C	ZINC000821679197	593909147	/nfs/dbraw/zinc/90/91/47/593909147.db2.gz	YIVRGHUNDOZXSZ-IINYFYTJSA-N	-1	3	333.352	1.785	20	5		EDBDHM
O=[N+]([O-])c1c(-c2nnn[n-]2)ccnc1N1CCC[C@H](n2ccnc2)C1	ZINC000823620833	594222072	/nfs/dbraw/zinc/22/20/72/594222072.db2.gz	QSSRJRLEQYISKK-JTQLQIEISA-N	-1	3	341.335	1.208	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCO[C@@H](c2ccco2)C1	ZINC000823630059	594222884	/nfs/dbraw/zinc/22/28/84/594222884.db2.gz	QJSIMQUACDAPRA-CQSZACIVSA-N	-1	3	342.315	1.946	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCO[C@@H](c2ccco2)C1	ZINC000823630059	594222885	/nfs/dbraw/zinc/22/28/85/594222885.db2.gz	QJSIMQUACDAPRA-CQSZACIVSA-N	-1	3	342.315	1.946	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCC2(CCO)CCCC2)c(-c2nnn[n-]2)c1	ZINC000823652008	594224910	/nfs/dbraw/zinc/22/49/10/594224910.db2.gz	VUFXQKVWMAJUOU-UHFFFAOYSA-N	-1	3	333.352	1.525	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCC2(CCO)CCCC2)c(-c2nn[n-]n2)c1	ZINC000823652008	594224911	/nfs/dbraw/zinc/22/49/11/594224911.db2.gz	VUFXQKVWMAJUOU-UHFFFAOYSA-N	-1	3	333.352	1.525	20	5		EDBDHM
CN(C(=O)c1ccc([N+](=O)[O-])n1C)c1ccccc1-c1nnn[n-]1	ZINC000825829206	594257107	/nfs/dbraw/zinc/25/71/07/594257107.db2.gz	AFJUWMHBFQUYAF-UHFFFAOYSA-N	-1	3	327.304	1.390	20	5		EDBDHM
CN(C(=O)c1ccc([N+](=O)[O-])n1C)c1ccccc1-c1nn[n-]n1	ZINC000825829206	594257108	/nfs/dbraw/zinc/25/71/08/594257108.db2.gz	AFJUWMHBFQUYAF-UHFFFAOYSA-N	-1	3	327.304	1.390	20	5		EDBDHM
CN(C(=O)c1ccc([N+](=O)[O-])cn1)c1ccc(-c2nnn[n-]2)cc1	ZINC000825830559	594257428	/nfs/dbraw/zinc/25/74/28/594257428.db2.gz	VXTWNQHHOIBGJU-UHFFFAOYSA-N	-1	3	325.288	1.447	20	5		EDBDHM
CN(C(=O)c1ccc([N+](=O)[O-])cn1)c1ccc(-c2nn[n-]n2)cc1	ZINC000825830559	594257431	/nfs/dbraw/zinc/25/74/31/594257431.db2.gz	VXTWNQHHOIBGJU-UHFFFAOYSA-N	-1	3	325.288	1.447	20	5		EDBDHM
CN(C)c1cccc(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)n1	ZINC000825883883	594268551	/nfs/dbraw/zinc/26/85/51/594268551.db2.gz	OSSIRISWNMOLDE-UHFFFAOYSA-N	-1	3	341.335	1.243	20	5		EDBDHM
CN(C)c1cccc(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)n1	ZINC000825883883	594268553	/nfs/dbraw/zinc/26/85/53/594268553.db2.gz	OSSIRISWNMOLDE-UHFFFAOYSA-N	-1	3	341.335	1.243	20	5		EDBDHM
CC(C)(C)N1CC[C@@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1=O	ZINC000827815256	594282781	/nfs/dbraw/zinc/28/27/81/594282781.db2.gz	QFMKCMXRYKTPEE-SECBINFHSA-N	-1	3	347.418	1.334	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2C(=O)OCC2(C)C)c1[N+](=O)[O-]	ZINC000841534816	594917211	/nfs/dbraw/zinc/91/72/11/594917211.db2.gz	LTWBNEOBIAAZRZ-GFCCVEGCSA-N	-1	3	342.373	1.442	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2C(=O)c2cc(F)ccc2[N+](=O)[O-])nc1=N	ZINC000846068780	595135928	/nfs/dbraw/zinc/13/59/28/595135928.db2.gz	SFZFDMTXIMYDFY-NSHDSACASA-N	-1	3	334.311	1.252	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@H]2CCCN3CCCC[C@@H]23)cs1	ZINC000848507951	595399326	/nfs/dbraw/zinc/39/93/26/595399326.db2.gz	BMQVKWKMAUQPDQ-RYUDHWBXSA-N	-1	3	345.446	1.952	20	5		EDBDHM
COc1cc(CNC[C@@H]2CN(C3CC3)C(=O)O2)c([N+](=O)[O-])cc1[O-]	ZINC000848577172	595407376	/nfs/dbraw/zinc/40/73/76/595407376.db2.gz	BCYXKUYPXMOIMH-LLVKDONJSA-N	-1	3	337.332	1.382	20	5		EDBDHM
Cc1nnc(C[N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)n1C	ZINC000848580779	595408163	/nfs/dbraw/zinc/40/81/63/595408163.db2.gz	DPXSFQISNOCZHP-UHFFFAOYSA-N	-1	3	341.274	1.320	20	5		EDBDHM
C[C@@H]1CO[C@@H](C)CN1CC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000849429387	595524988	/nfs/dbraw/zinc/52/49/88/595524988.db2.gz	PCVKAPONPDUYDO-ZJUUUORDSA-N	-1	3	349.434	1.044	20	5		EDBDHM
COC(=O)C[C@H](C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C1CC1	ZINC000849468141	595542180	/nfs/dbraw/zinc/54/21/80/595542180.db2.gz	GZWRZKSFZMCWQN-SECBINFHSA-N	-1	3	348.402	1.524	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@H](CO)c2ccccc2)c(-c2nnn[n-]2)c1	ZINC000738370407	599170078	/nfs/dbraw/zinc/17/00/78/599170078.db2.gz	PWUDSIVBUZXWDS-CQSZACIVSA-N	-1	3	326.316	1.920	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@H](CO)c2ccccc2)c(-c2nn[n-]n2)c1	ZINC000738370407	599170081	/nfs/dbraw/zinc/17/00/81/599170081.db2.gz	PWUDSIVBUZXWDS-CQSZACIVSA-N	-1	3	326.316	1.920	20	5		EDBDHM
O=C(Cc1cccc([N+](=O)[O-])c1)NCc1cccc(-c2nnn[n-]2)c1	ZINC000737968662	599181145	/nfs/dbraw/zinc/18/11/45/599181145.db2.gz	LEPIJZCWPOVYSE-UHFFFAOYSA-N	-1	3	338.327	1.634	20	5		EDBDHM
O=C(Cc1cccc([N+](=O)[O-])c1)NCc1cccc(-c2nn[n-]n2)c1	ZINC000737968662	599181148	/nfs/dbraw/zinc/18/11/48/599181148.db2.gz	LEPIJZCWPOVYSE-UHFFFAOYSA-N	-1	3	338.327	1.634	20	5		EDBDHM
O=C(c1cc(F)c[n-]c1=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000856725038	596061176	/nfs/dbraw/zinc/06/11/76/596061176.db2.gz	CZKYVBVHYMEFKO-UHFFFAOYSA-N	-1	3	346.318	1.797	20	5		EDBDHM
Cc1cc(Cl)c(C(=O)NCCCc2cc(=O)[nH][n-]2)cc1[N+](=O)[O-]	ZINC000854484318	596094725	/nfs/dbraw/zinc/09/47/25/596094725.db2.gz	ODEKKNYZTKXFDW-UHFFFAOYSA-N	-1	3	338.751	1.943	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H]2CCCN(C)C2)cc1F	ZINC000866753882	596322843	/nfs/dbraw/zinc/32/28/43/596322843.db2.gz	GVVOQGSTTBALQE-LLVKDONJSA-N	-1	3	345.396	1.662	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@]23CCC[C@H]2OCC3)c([N+](=O)[O-])s1	ZINC000867882117	596599448	/nfs/dbraw/zinc/59/94/48/596599448.db2.gz	BERYFEDWMKMYMV-PWSUYJOCSA-N	-1	3	332.403	1.955	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@H]2Cc3ccccc3O2)cs1	ZINC000119498244	596605722	/nfs/dbraw/zinc/60/57/22/596605722.db2.gz	BBHVDCFCRNBLSF-SNVBAGLBSA-N	-1	3	340.382	1.938	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)Nc1ccccc1	ZINC000119687731	596709117	/nfs/dbraw/zinc/70/91/17/596709117.db2.gz	PCRALFVHFXCTLA-UHFFFAOYSA-N	-1	3	341.370	1.573	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H]1C[C@H]2CCC[C@@H]2O1	ZINC000872555895	596962997	/nfs/dbraw/zinc/96/29/97/596962997.db2.gz	JHPNRGXJOVTGCZ-MDZLAQPJSA-N	-1	3	326.374	1.831	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@H](C3OCCO3)C2)c(-c2nnn[n-]2)c1	ZINC000738368192	598313850	/nfs/dbraw/zinc/31/38/50/598313850.db2.gz	ANVPAVVTNMWKEU-JTQLQIEISA-N	-1	3	346.347	1.364	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@H](C3OCCO3)C2)c(-c2nn[n-]n2)c1	ZINC000738368192	598313852	/nfs/dbraw/zinc/31/38/52/598313852.db2.gz	ANVPAVVTNMWKEU-JTQLQIEISA-N	-1	3	346.347	1.364	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCCN2CCCC2=O)c([N+](=O)[O-])c1	ZINC000101569928	219140548	/nfs/dbraw/zinc/14/05/48/219140548.db2.gz	XGKJDTJGLRTPCE-UHFFFAOYSA-N	-1	3	341.389	1.194	20	5		EDBDHM
O=C(C[C@](O)(c1nccn1Cc1ccccc1)C(F)(F)F)N[O-]	ZINC000380887638	540176011	/nfs/dbraw/zinc/17/60/11/540176011.db2.gz	SQDODACEVOAHSI-ZDUSSCGKSA-N	-1	3	329.278	1.577	20	5		EDBDHM
CC(C)NC(=O)[C@H](C)[N-]c1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000413578772	304067572	/nfs/dbraw/zinc/06/75/72/304067572.db2.gz	YGQIPDNLVRDSFB-ZETCQYMHSA-N	-1	3	335.407	1.385	20	5		EDBDHM
CCN1CCN([C@H](C)CNc2nc(C(=O)[O-])ccc2[N+](=O)[O-])CC1	ZINC000566293781	306407551	/nfs/dbraw/zinc/40/75/51/306407551.db2.gz	DVSZOKOKCJNKSA-LLVKDONJSA-N	-1	3	337.380	1.126	20	5		EDBDHM
CN[C@@H](C)C[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-]	ZINC000261786065	139225825	/nfs/dbraw/zinc/22/58/25/139225825.db2.gz	QKSJEPLQCNTSFM-LURJTMIESA-N	-1	3	342.204	1.788	20	5		EDBDHM
CC[C@@H](C[C@H](C)CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000443313903	254576323	/nfs/dbraw/zinc/57/63/23/254576323.db2.gz	ADHLMYYIPNXFAB-UWVGGRQHSA-N	-1	3	334.369	1.809	20	5		EDBDHM
CC[C@H](C)[C@@H](O)C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000119359032	221303946	/nfs/dbraw/zinc/30/39/46/221303946.db2.gz	VBXJVJYZLJHFGE-ZANVPECISA-N	-1	3	330.406	1.897	20	5		EDBDHM
Cn1cnc(S(=O)(=O)[N-]CCCCc2ccc([N+](=O)[O-])cc2)c1	ZINC000265734795	139501328	/nfs/dbraw/zinc/50/13/28/139501328.db2.gz	ATLVVFUXFSIESX-UHFFFAOYSA-N	-1	3	338.389	1.630	20	5		EDBDHM
C[C@H]1C[C@@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCO1	ZINC000271297714	140273111	/nfs/dbraw/zinc/27/31/11/140273111.db2.gz	VEINAGHDXOHGFU-UWVGGRQHSA-N	-1	3	332.353	1.827	20	5		EDBDHM
CS[C@H](CO)[C@@H](C)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000271742591	140342687	/nfs/dbraw/zinc/34/26/87/140342687.db2.gz	WQGSPXBQSHJIJW-ZYHUDNBSSA-N	-1	3	348.446	1.602	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)[C@@H]2CCCCO2)c([N+](=O)[O-])c1	ZINC000272089143	140398786	/nfs/dbraw/zinc/39/87/86/140398786.db2.gz	UVIDIGFQELWSLT-MFKMUULPSA-N	-1	3	344.389	1.839	20	5		EDBDHM
C[C@]1(CO)CCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000340079493	142259544	/nfs/dbraw/zinc/25/95/44/142259544.db2.gz	ZVBTVMMHJOPHIP-QWHCGFSZSA-N	-1	3	332.353	1.563	20	5		EDBDHM
CC[C@@H](C)[C@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)OC	ZINC000340389452	142372702	/nfs/dbraw/zinc/37/27/02/142372702.db2.gz	NKGYAFQSKKLCKN-SKDRFNHKSA-N	-1	3	344.389	1.769	20	5		EDBDHM
CS(=O)(=O)[N-]c1cncc(C(=O)Nc2cccc([N+](=O)[O-])c2)c1	ZINC000347808667	143365852	/nfs/dbraw/zinc/36/58/52/143365852.db2.gz	BCLLNJBCRWVXJY-UHFFFAOYSA-N	-1	3	336.329	1.614	20	5		EDBDHM
CCn1ccc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)n1	ZINC000416589164	304334632	/nfs/dbraw/zinc/33/46/32/304334632.db2.gz	RSIMQWJUNUBOMK-UHFFFAOYSA-N	-1	3	344.780	1.943	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCOc1ncccc1F	ZINC000352881262	149201354	/nfs/dbraw/zinc/20/13/54/149201354.db2.gz	IWXLDEWICCCWQS-UHFFFAOYSA-N	-1	3	341.320	1.486	20	5		EDBDHM
CCO[C@H]1COCC[C@@H]1[N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000353001264	149247315	/nfs/dbraw/zinc/24/73/15/149247315.db2.gz	HIRNRFSBXBAFBJ-KBPBESRZSA-N	-1	3	344.389	1.208	20	5		EDBDHM
CCO[C@@H]1COCC[C@@H]1[N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000353001266	149247386	/nfs/dbraw/zinc/24/73/86/149247386.db2.gz	HIRNRFSBXBAFBJ-UONOGXRCSA-N	-1	3	344.389	1.208	20	5		EDBDHM
CCn1cnc(S(=O)(=O)[N-]Cc2ccc(OC)c([N+](=O)[O-])c2)c1	ZINC000353270035	149347442	/nfs/dbraw/zinc/34/74/42/149347442.db2.gz	ADJVSZIJSPFIPJ-UHFFFAOYSA-N	-1	3	340.361	1.298	20	5		EDBDHM
COC(=O)c1cnc(C(=O)[N-]c2ccc(OC)cc2[N+](=O)[O-])cn1	ZINC000355297328	150204551	/nfs/dbraw/zinc/20/45/51/150204551.db2.gz	HIUIEPXTXIXQGO-UHFFFAOYSA-N	-1	3	332.272	1.432	20	5		EDBDHM
Cc1nc(C)c(Cc2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)c(=O)[n-]1	ZINC000355442755	150269437	/nfs/dbraw/zinc/26/94/37/150269437.db2.gz	PEMYGTQLHJFZGH-UHFFFAOYSA-N	-1	3	342.315	1.930	20	5		EDBDHM
O=C(COc1ccccc1[N+](=O)[O-])NCc1nnc(C(F)(F)F)[n-]1	ZINC000361022595	152282109	/nfs/dbraw/zinc/28/21/09/152282109.db2.gz	HLLOBHHFQHSUNV-UHFFFAOYSA-N	-1	3	345.237	1.427	20	5		EDBDHM
O=C(COc1ccccc1[N+](=O)[O-])NCc1n[n-]c(C(F)(F)F)n1	ZINC000361022595	152282111	/nfs/dbraw/zinc/28/21/11/152282111.db2.gz	HLLOBHHFQHSUNV-UHFFFAOYSA-N	-1	3	345.237	1.427	20	5		EDBDHM
O=C(COc1ccccc1[N+](=O)[O-])NCc1nc(C(F)(F)F)n[n-]1	ZINC000361022595	152282114	/nfs/dbraw/zinc/28/21/14/152282114.db2.gz	HLLOBHHFQHSUNV-UHFFFAOYSA-N	-1	3	345.237	1.427	20	5		EDBDHM
COc1cc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc(OC)c1OC	ZINC000361861989	152527287	/nfs/dbraw/zinc/52/72/87/152527287.db2.gz	JWULBYRZDBZJRM-UHFFFAOYSA-N	-1	3	349.299	1.974	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCCNC(=O)C(C)C	ZINC000158672140	225064044	/nfs/dbraw/zinc/06/40/44/225064044.db2.gz	BPODKGFYHGRZCT-UHFFFAOYSA-N	-1	3	343.405	1.344	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCCC(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000123303082	222252629	/nfs/dbraw/zinc/25/26/29/222252629.db2.gz	GAYHSEIBHIVWIT-UHFFFAOYSA-N	-1	3	335.407	1.111	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCc2ccccc2O)c(F)c1	ZINC000178619736	267573890	/nfs/dbraw/zinc/57/38/90/267573890.db2.gz	QJTYLXZNUCQWGQ-UHFFFAOYSA-N	-1	3	340.332	1.961	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CC=CCC1	ZINC000273529044	268058466	/nfs/dbraw/zinc/05/84/66/268058466.db2.gz	KGALVXIAZHQFRI-JTQLQIEISA-N	-1	3	340.357	1.768	20	5		EDBDHM
C/C=C/C[C@@H](CO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000274684105	268182814	/nfs/dbraw/zinc/18/28/14/268182814.db2.gz	SVTKVUBLKQARCG-FSIBCCDJSA-N	-1	3	330.362	1.209	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCC[C@H]1C	ZINC000273440563	273040023	/nfs/dbraw/zinc/04/00/23/273040023.db2.gz	BTIUJXFQVXGRNQ-BXKDBHETSA-N	-1	3	342.373	1.848	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl)C(N)=O	ZINC000292045461	289247769	/nfs/dbraw/zinc/24/77/69/289247769.db2.gz	GBUQHTPXWFHCTG-ZETCQYMHSA-N	-1	3	335.769	1.099	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCC(=O)NC1(C)C	ZINC000338426963	302048090	/nfs/dbraw/zinc/04/80/90/302048090.db2.gz	RHNOWXGGJOVUMI-LLVKDONJSA-N	-1	3	341.389	1.239	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C)CO[C@@H]1CCOC1	ZINC000267895343	302049066	/nfs/dbraw/zinc/04/90/66/302049066.db2.gz	UGTCWBLLIZTSNM-VXGBXAGGSA-N	-1	3	344.389	1.376	20	5		EDBDHM
C[C@@H]1CN(C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)CCN(C2CCC2)C1	ZINC000293778044	303017578	/nfs/dbraw/zinc/01/75/78/303017578.db2.gz	VUZNYTGRMZNVEI-NSHDSACASA-N	-1	3	334.376	1.642	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1(C(C)C)CC1	ZINC000293887032	303033968	/nfs/dbraw/zinc/03/39/68/303033968.db2.gz	USXSKCKGZYOCAM-UHFFFAOYSA-N	-1	3	342.373	1.848	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H](C)CCCO	ZINC000295201227	303188032	/nfs/dbraw/zinc/18/80/32/303188032.db2.gz	FGRWAQFQBORQOF-SNVBAGLBSA-N	-1	3	332.378	1.290	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCC2CC(O)C2)c([N+](=O)[O-])c1	ZINC000432314782	305091182	/nfs/dbraw/zinc/09/11/82/305091182.db2.gz	RUHUHNKBNUVTHP-UHFFFAOYSA-N	-1	3	330.362	1.043	20	5		EDBDHM
O=[N+]([O-])c1cccc(CS(=O)(=O)[N-]C2(c3nc[nH]n3)CCC2)c1	ZINC000439217540	305195448	/nfs/dbraw/zinc/19/54/48/305195448.db2.gz	SBKBTBMKGKGHMI-UHFFFAOYSA-N	-1	3	337.361	1.212	20	5		EDBDHM
Cc1cc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)ccc1OCCO	ZINC000445163407	305257490	/nfs/dbraw/zinc/25/74/90/305257490.db2.gz	UUUMSIWCURHZRR-UHFFFAOYSA-N	-1	3	333.300	1.627	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C2CC(C)(F)C2)cc1[N+](=O)[O-]	ZINC000451629390	305357338	/nfs/dbraw/zinc/35/73/38/305357338.db2.gz	HBDKINDBACXNAP-UHFFFAOYSA-N	-1	3	336.316	1.911	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1C[C@H]1C1CC1	ZINC000452043362	305379555	/nfs/dbraw/zinc/37/95/55/305379555.db2.gz	FAUNPQGCKILZBC-JQWIXIFHSA-N	-1	3	326.374	1.928	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000523688598	305811810	/nfs/dbraw/zinc/81/18/10/305811810.db2.gz	VLJICYZRUVSNRF-LLVKDONJSA-N	-1	3	333.348	1.025	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)on1	ZINC000524636946	305817222	/nfs/dbraw/zinc/81/72/22/305817222.db2.gz	ZLBODISKJKMGER-UHFFFAOYSA-N	-1	3	325.346	1.932	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000535394261	306013397	/nfs/dbraw/zinc/01/33/97/306013397.db2.gz	SXWDUBGWRCSXOX-LBPRGKRZSA-N	-1	3	343.343	1.247	20	5		EDBDHM
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ncccc1[O-]	ZINC000022262071	441278696	/nfs/dbraw/zinc/27/86/96/441278696.db2.gz	JCZQXVUQFBEKDS-UHFFFAOYSA-N	-1	3	330.300	1.454	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C)C(=O)N1CCCC1	ZINC000063309487	441325055	/nfs/dbraw/zinc/32/50/55/441325055.db2.gz	RPWDGDPEKOIXRV-LLVKDONJSA-N	-1	3	341.389	1.192	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC2(O)CCCC2)c(Cl)c1	ZINC000087041541	441477519	/nfs/dbraw/zinc/47/75/19/441477519.db2.gz	KFHWNCSSHRNOOD-UHFFFAOYSA-N	-1	3	334.781	1.832	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C)c1nncn1C	ZINC000056069115	441685430	/nfs/dbraw/zinc/68/54/30/441685430.db2.gz	PWFTXAGDDXGEFJ-SECBINFHSA-N	-1	3	325.350	1.071	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)NC(C)(C)C	ZINC000067717705	441672310	/nfs/dbraw/zinc/67/23/10/441672310.db2.gz	SNPBODRZLYEWIN-VIFPVBQESA-N	-1	3	329.378	1.176	20	5		EDBDHM
O=[N+]([O-])c1ccc(OCC[N-]S(=O)(=O)c2cncc(F)c2)cc1	ZINC000068940114	441872422	/nfs/dbraw/zinc/87/24/22/441872422.db2.gz	LZYZFNOJRZUZKO-UHFFFAOYSA-N	-1	3	341.320	1.486	20	5		EDBDHM
CC[C@]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)(C(N)=O)C(C)C	ZINC000181539379	442702510	/nfs/dbraw/zinc/70/25/10/442702510.db2.gz	YSVGUWYILZMPRD-CYBMUJFWSA-N	-1	3	347.368	1.302	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC2(CO)CCC2)c(Cl)c1	ZINC000183302760	442919877	/nfs/dbraw/zinc/91/98/77/442919877.db2.gz	HIPGYXFVPHJCLL-UHFFFAOYSA-N	-1	3	334.781	1.689	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC(=O)N2CCCC2)c1[N+](=O)[O-]	ZINC000189819531	443016411	/nfs/dbraw/zinc/01/64/11/443016411.db2.gz	GIUVPNPTJKCLFQ-UHFFFAOYSA-N	-1	3	341.389	1.112	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)[C@@H]2CCOC2)cc1C	ZINC000266217147	443061383	/nfs/dbraw/zinc/06/13/83/443061383.db2.gz	RKAYWFANJYBXOY-VXGBXAGGSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)Cn2cncn2)cc1C	ZINC000299106050	318878869	/nfs/dbraw/zinc/87/88/69/318878869.db2.gz	ZRAGNENDFCYAPX-LLVKDONJSA-N	-1	3	339.377	1.170	20	5		EDBDHM
CN(CC(=O)[O-])C[C@H]1CN(c2ccc(Cl)cc2[N+](=O)[O-])CCO1	ZINC000262181319	443185451	/nfs/dbraw/zinc/18/54/51/443185451.db2.gz	WTLGVZMAHYGDID-NSHDSACASA-N	-1	3	343.767	1.470	20	5		EDBDHM
COCCCn1ccc([N-]c2nc3ccccn3c(=O)c2[N+](=O)[O-])n1	ZINC000301412373	318913140	/nfs/dbraw/zinc/91/31/40/318913140.db2.gz	KSVXURQCHCEEKH-UHFFFAOYSA-N	-1	3	344.331	1.579	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCCC[C@H]2CO)c([N+](=O)[O-])c1	ZINC000269308619	443276520	/nfs/dbraw/zinc/27/65/20/443276520.db2.gz	VCVGIOKARBDPNV-JQWIXIFHSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CCOC(=O)[C@H](C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000269288348	443267493	/nfs/dbraw/zinc/26/74/93/443267493.db2.gz	NICYXSUZLAJADM-MRVPVSSYSA-N	-1	3	334.325	1.211	20	5		EDBDHM
CS(=O)(=O)c1cc([N+](=O)[O-])c([N-]CC(=O)N2CCCCC2)s1	ZINC000271271843	443499034	/nfs/dbraw/zinc/49/90/34/443499034.db2.gz	MNPDZBKAZALUHH-UHFFFAOYSA-N	-1	3	347.418	1.484	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CO)CC(F)F)c1C	ZINC000428419914	319911754	/nfs/dbraw/zinc/91/17/54/319911754.db2.gz	HGYDYTCJVWLSMM-SECBINFHSA-N	-1	3	338.332	1.506	20	5		EDBDHM
C[C@@]1(C[C@@H]2CCCN2C(=O)c2ccccc2[N+](=O)[O-])NC(=O)[N-]C1=O	ZINC000286154333	443657911	/nfs/dbraw/zinc/65/79/11/443657911.db2.gz	IYUMSTOMOFLFNN-QFYYESIMSA-N	-1	3	346.343	1.188	20	5		EDBDHM
COC(=O)[C@H](CC(C)C)[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000443718221	320110626	/nfs/dbraw/zinc/11/06/26/320110626.db2.gz	OISHRTOULBQJON-ZDUSSCGKSA-N	-1	3	344.389	1.602	20	5		EDBDHM
Cc1cc(N2C[C@H](C)N(CCO)C[C@@H]2C)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000571566340	321392654	/nfs/dbraw/zinc/39/26/54/321392654.db2.gz	QTGSWEUTSSSYLR-RYUDHWBXSA-N	-1	3	337.376	1.493	20	5		EDBDHM
COC(=O)CCCO[N-]C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000290694594	444311598	/nfs/dbraw/zinc/31/15/98/444311598.db2.gz	QBSZJMWNJAISJX-UHFFFAOYSA-N	-1	3	335.316	1.620	20	5		EDBDHM
CC(C)N(C)C[C@H](C)[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000319622385	444324961	/nfs/dbraw/zinc/32/49/61/444324961.db2.gz	IYDKSMYMTMZPGV-JTQLQIEISA-N	-1	3	333.385	1.741	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1CCC(CO)CC1	ZINC000323813389	444347053	/nfs/dbraw/zinc/34/70/53/444347053.db2.gz	MBCIUMDQIJLQPG-UHFFFAOYSA-N	-1	3	344.389	1.433	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCC[C@H](CO)C1	ZINC000319996597	444327258	/nfs/dbraw/zinc/32/72/58/444327258.db2.gz	QCVIKDJUAQPMGH-NWDGAFQWSA-N	-1	3	328.390	1.733	20	5		EDBDHM
Cc1c([C@H](C)[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])cnn1C	ZINC000337824873	444425582	/nfs/dbraw/zinc/42/55/82/444425582.db2.gz	WRTWDPUWDXRVIX-JTQLQIEISA-N	-1	3	338.389	1.985	20	5		EDBDHM
O=C([O-])c1cn([C@@H]2CCCN(CCc3ccc([N+](=O)[O-])cc3)C2)nn1	ZINC000580897491	322110061	/nfs/dbraw/zinc/11/00/61/322110061.db2.gz	FTOYWMKBOGAQJU-CQSZACIVSA-N	-1	3	345.359	1.764	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CCc3c[nH]nc3C2)c([N+](=O)[O-])c1	ZINC000343843820	444622891	/nfs/dbraw/zinc/62/28/91/444622891.db2.gz	REHRDMBNBVWLHD-NSHDSACASA-N	-1	3	336.373	1.462	20	5		EDBDHM
CO[C@H]1CCC[C@H]1C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000341213763	444733028	/nfs/dbraw/zinc/73/30/28/444733028.db2.gz	JRCVMFYPUHWZQX-AAEUAGOBSA-N	-1	3	328.390	1.997	20	5		EDBDHM
CCOc1ccc([N+](=O)[O-])c(C(=O)[N-]c2nc(C(N)=O)cs2)c1	ZINC000338523970	444732607	/nfs/dbraw/zinc/73/26/07/444732607.db2.gz	KUHVWOLONDNODW-UHFFFAOYSA-N	-1	3	336.329	1.801	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(=O)OC	ZINC000336862587	444808970	/nfs/dbraw/zinc/80/89/70/444808970.db2.gz	GILPLRPUPRIMQX-SNVBAGLBSA-N	-1	3	330.362	1.442	20	5		EDBDHM
O=C(NCCCNC(=O)c1cccc([O-])c1)c1csc([N+](=O)[O-])c1	ZINC000338764074	444842650	/nfs/dbraw/zinc/84/26/50/444842650.db2.gz	SRAZETSRNSPPOP-UHFFFAOYSA-N	-1	3	349.368	1.912	20	5		EDBDHM
COc1cc(CNC[C@@H]2CCCCS2(=O)=O)c([N+](=O)[O-])cc1[O-]	ZINC000344371560	444925111	/nfs/dbraw/zinc/92/51/11/444925111.db2.gz	YZXASSOEPXJNQK-NSHDSACASA-N	-1	3	344.389	1.366	20	5		EDBDHM
CO[C@H](CC[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1)C(F)(F)F	ZINC000345357680	445183102	/nfs/dbraw/zinc/18/31/02/445183102.db2.gz	SMAPEOZGMYVKKX-SNVBAGLBSA-N	-1	3	342.295	1.841	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC1(C(F)F)CC1	ZINC000359809756	445439203	/nfs/dbraw/zinc/43/92/03/445439203.db2.gz	UCDVTCHVBOFCCG-UHFFFAOYSA-N	-1	3	336.316	1.927	20	5		EDBDHM
CCN(CC)C[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000360007321	445524799	/nfs/dbraw/zinc/52/47/99/445524799.db2.gz	OYLHGUVMJQDXAM-JTQLQIEISA-N	-1	3	333.385	1.743	20	5		EDBDHM
O=[N+]([O-])c1ccc(-c2noc([N-]Cc3ccnc4ccnn43)n2)cc1	ZINC000349897453	445715403	/nfs/dbraw/zinc/71/54/03/445715403.db2.gz	YOHCXSFJSWBPKP-UHFFFAOYSA-N	-1	3	337.299	2.300	20	5		EDBDHM
COc1cc(CN[C@@H]2CC(=O)N([C@H]3C[C@@H]3C)C2)c([N+](=O)[O-])cc1[O-]	ZINC000363414619	445794456	/nfs/dbraw/zinc/79/44/56/445794456.db2.gz	PMNUEGNZQREDMO-WCQGTBRESA-N	-1	3	335.360	1.408	20	5		EDBDHM
NC(=O)[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000420717746	446768630	/nfs/dbraw/zinc/76/86/30/446768630.db2.gz	MJFGKHHPZJYRRH-SCZZXKLOSA-N	-1	3	347.780	1.181	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H](O)COCC(C)C	ZINC000443386768	447046838	/nfs/dbraw/zinc/04/68/38/447046838.db2.gz	NDIWBDFISWLIMC-GFCCVEGCSA-N	-1	3	346.405	1.215	20	5		EDBDHM
CCc1cc(=O)[n-]c(CN2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)n1	ZINC000372473663	447072213	/nfs/dbraw/zinc/07/22/13/447072213.db2.gz	QQPCLXFUZMORGD-LBPRGKRZSA-N	-1	3	332.364	1.686	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)[C@H](OC)C1CC1	ZINC000451983110	447796130	/nfs/dbraw/zinc/79/61/30/447796130.db2.gz	GFKMWCRLYDXFAU-OTYXRUKQSA-N	-1	3	344.389	1.695	20	5		EDBDHM
C[C@H](CN1CCC[C@@H](C)C1)[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000530491839	447898886	/nfs/dbraw/zinc/89/88/86/447898886.db2.gz	CIZZEKFMOKCGGE-VXGBXAGGSA-N	-1	3	342.421	1.389	20	5		EDBDHM
CCC[C@@H](C)[C@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000582126633	449019447	/nfs/dbraw/zinc/01/94/47/449019447.db2.gz	MZXAFLVAIHQPGS-PWSUYJOCSA-N	-1	3	346.405	1.679	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2[C@@H]3CCO[C@H]3C23CCC3)nc1	ZINC000593565815	449074611	/nfs/dbraw/zinc/07/46/11/449074611.db2.gz	JSCVPYIHFJZVJV-CYZMBNFOSA-N	-1	3	339.373	1.226	20	5		EDBDHM
CC(C)[C@@H](O)C1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CC1	ZINC000593572886	449080794	/nfs/dbraw/zinc/08/07/94/449080794.db2.gz	MZIMKHGMTKSLLY-GFCCVEGCSA-N	-1	3	329.378	1.065	20	5		EDBDHM
CN1CCC2(CC1)CN(C(=O)c1cccc([N+](=O)[O-])c1[O-])CCO2	ZINC000592898300	449042052	/nfs/dbraw/zinc/04/20/52/449042052.db2.gz	FESVMJBHRVCNQR-UHFFFAOYSA-N	-1	3	335.360	1.237	20	5		EDBDHM
Cc1cccc2c1OC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C2	ZINC000593599184	449099842	/nfs/dbraw/zinc/09/98/42/449099842.db2.gz	UAECTGYYVXLOPG-LBPRGKRZSA-N	-1	3	349.368	1.580	20	5		EDBDHM
COC(=O)[C@@H](C)C[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F	ZINC000590591252	449206591	/nfs/dbraw/zinc/20/65/91/449206591.db2.gz	RAYKGWRUWJURNH-QMMMGPOBSA-N	-1	3	334.325	1.130	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCCCC1	ZINC000593526031	449324579	/nfs/dbraw/zinc/32/45/79/449324579.db2.gz	BQADWMMDQZVTRB-UHFFFAOYSA-N	-1	3	343.361	1.144	20	5		EDBDHM
Cc1occc1C(=O)NC1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596106586	449364241	/nfs/dbraw/zinc/36/42/41/449364241.db2.gz	CZELTQJEANQPHY-UHFFFAOYSA-N	-1	3	346.343	1.996	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)[N-]c2cccnc2C(=O)OC(C)(C)C)n1	ZINC000598861808	449623296	/nfs/dbraw/zinc/62/32/96/449623296.db2.gz	ZUFMFYQBDMDZNA-UHFFFAOYSA-N	-1	3	347.331	1.931	20	5		EDBDHM
O=[N+]([O-])c1cc(F)cnc1[N-]c1cnn(CCN2CCOCC2)c1	ZINC000601114265	449697061	/nfs/dbraw/zinc/69/70/61/449697061.db2.gz	ONFFECXJYHWPQA-UHFFFAOYSA-N	-1	3	336.327	1.401	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2C[C@@H](O)C23CCC3)c1C	ZINC000594865368	449779073	/nfs/dbraw/zinc/77/90/73/449779073.db2.gz	RMEDXMMPPPHOHX-QWHCGFSZSA-N	-1	3	340.401	1.793	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@H](C)N(C)C2CC2)c([N+](=O)[O-])s1	ZINC000601335272	449843682	/nfs/dbraw/zinc/84/36/82/449843682.db2.gz	JUMCZMFJKHXKOU-QMMMGPOBSA-N	-1	3	333.435	1.726	20	5		EDBDHM
COCC[C@H](C)C[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F	ZINC000601438773	449959466	/nfs/dbraw/zinc/95/94/66/449959466.db2.gz	BFALWJZTGSAMHG-VIFPVBQESA-N	-1	3	334.369	1.993	20	5		EDBDHM
CCCN1CC[C@@H]([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)C1	ZINC000601468913	449992033	/nfs/dbraw/zinc/99/20/33/449992033.db2.gz	VYHNDABJHHALBN-LLVKDONJSA-N	-1	3	345.396	1.805	20	5		EDBDHM
CCCN(C)CC(C)(C)[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000595381409	450095564	/nfs/dbraw/zinc/09/55/64/450095564.db2.gz	KFJAYCFVHVLRTK-UHFFFAOYSA-N	-1	3	330.410	1.389	20	5		EDBDHM
CC(=O)c1sc2[n-]c(Cn3c(C)ncc3[N+](=O)[O-])nc(=O)c2c1C	ZINC000346602643	534959421	/nfs/dbraw/zinc/95/94/21/534959421.db2.gz	AWPFPLPFOPKEPB-UHFFFAOYSA-N	-1	3	347.356	1.957	20	5		EDBDHM
CCc1nc([C@H](C)[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])n[nH]1	ZINC000270553133	536153536	/nfs/dbraw/zinc/15/35/36/536153536.db2.gz	GRTGUOQEXHKLJE-VIFPVBQESA-N	-1	3	339.377	1.623	20	5		EDBDHM
CCc1nnc([C@H](C)[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])[nH]1	ZINC000270553133	536153538	/nfs/dbraw/zinc/15/35/38/536153538.db2.gz	GRTGUOQEXHKLJE-VIFPVBQESA-N	-1	3	339.377	1.623	20	5		EDBDHM
COC(=O)CC(C)(C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000741258009	579405737	/nfs/dbraw/zinc/40/57/37/579405737.db2.gz	NONZGWPEIZUJPP-UHFFFAOYSA-N	-1	3	346.361	1.223	20	5		EDBDHM
C[C@@H]1CN2CCCC[C@H]2CN1c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000736292183	578974650	/nfs/dbraw/zinc/97/46/50/578974650.db2.gz	IOBMGJIVYABFOU-YPMHNXCESA-N	-1	3	343.391	1.838	20	5		EDBDHM
COCCOC1CCN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1	ZINC000737005748	579039726	/nfs/dbraw/zinc/03/97/26/579039726.db2.gz	JIEZJGKMMJHMDD-UHFFFAOYSA-N	-1	3	348.363	1.407	20	5		EDBDHM
COCCOC1CCN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1	ZINC000737005748	579039727	/nfs/dbraw/zinc/03/97/27/579039727.db2.gz	JIEZJGKMMJHMDD-UHFFFAOYSA-N	-1	3	348.363	1.407	20	5		EDBDHM
CN(C)C[C@H]1CN(c2ccc(/C=C/C(=O)[O-])cc2[N+](=O)[O-])CCO1	ZINC000737364254	579079154	/nfs/dbraw/zinc/07/91/54/579079154.db2.gz	AJSORONVOZOMPY-BPJJOFIESA-N	-1	3	335.360	1.459	20	5		EDBDHM
O=C(NCCc1ccccc1[N+](=O)[O-])c1cccc(-c2nnn[n-]2)c1	ZINC000738087520	579158516	/nfs/dbraw/zinc/15/85/16/579158516.db2.gz	HWAADXGWVPOTRW-UHFFFAOYSA-N	-1	3	338.327	1.747	20	5		EDBDHM
O=C(NCCc1ccccc1[N+](=O)[O-])c1cccc(-c2nn[n-]n2)c1	ZINC000738087520	579158517	/nfs/dbraw/zinc/15/85/17/579158517.db2.gz	HWAADXGWVPOTRW-UHFFFAOYSA-N	-1	3	338.327	1.747	20	5		EDBDHM
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@H](NC(=O)[O-])C1	ZINC000740099611	579289768	/nfs/dbraw/zinc/28/97/68/579289768.db2.gz	OSRUIYRZCCRLAN-NSHDSACASA-N	-1	3	336.348	1.574	20	5		EDBDHM
CC[C@@](C)(CC(=O)OC)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000748660226	579696760	/nfs/dbraw/zinc/69/67/60/579696760.db2.gz	YJOPALJUEQZXCY-ZDUSSCGKSA-N	-1	3	330.362	1.605	20	5		EDBDHM
O=C([N-]Cc1nnnn1C1CC1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000778020440	580455019	/nfs/dbraw/zinc/45/50/19/580455019.db2.gz	RCPQLYKFTBEGKO-UHFFFAOYSA-N	-1	3	338.274	1.324	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@H]2Cc3cccc(O)c3C2)cs1	ZINC000758175906	579976228	/nfs/dbraw/zinc/97/62/28/579976228.db2.gz	UVFROAZTWLWMPF-VIFPVBQESA-N	-1	3	340.382	1.808	20	5		EDBDHM
Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](CO)CC(F)F	ZINC000758233650	579977929	/nfs/dbraw/zinc/97/79/29/579977929.db2.gz	LFDKQTRYVRLKAQ-ZETCQYMHSA-N	-1	3	342.295	1.337	20	5		EDBDHM
COc1ccc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])cc1F	ZINC000759169603	580000105	/nfs/dbraw/zinc/00/01/05/580000105.db2.gz	QDUGGCLOEBSMJO-UHFFFAOYSA-N	-1	3	342.308	1.443	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H]2CCO[C@@]3(CCOC3)C2)cs1	ZINC000768882562	580223419	/nfs/dbraw/zinc/22/34/19/580223419.db2.gz	PIBCSCKGXUYSIN-SKDRFNHKSA-N	-1	3	348.402	1.273	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)COc1ccc([N+](=O)[O-])c(F)c1	ZINC000778965921	580477184	/nfs/dbraw/zinc/47/71/84/580477184.db2.gz	VEFXUVGSZOJIGE-UHFFFAOYSA-N	-1	3	338.251	1.261	20	5		EDBDHM
O=C(NC1CCN(C[C@H]2CCCO2)CC1)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000780516243	580525490	/nfs/dbraw/zinc/52/54/90/580525490.db2.gz	KYOHOTVUSNTWQK-MRXNPFEDSA-N	-1	3	349.387	1.674	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CCn2ccnn2)c1	ZINC000782488616	580575899	/nfs/dbraw/zinc/57/58/99/580575899.db2.gz	YWNNOYRFRFFBDY-UHFFFAOYSA-N	-1	3	345.768	1.127	20	5		EDBDHM
C[C@@]1(c2ccccc2)NC(=O)N([N-]C(=O)c2cc([N+](=O)[O-])c[nH]2)C1=O	ZINC000785642602	580648504	/nfs/dbraw/zinc/64/85/04/580648504.db2.gz	HIPAFGUURVYORY-HNNXBMFYSA-N	-1	3	343.299	1.035	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]CC1OCCCO1	ZINC000788416068	580721041	/nfs/dbraw/zinc/72/10/41/580721041.db2.gz	JSRONUYLBDHNBZ-UHFFFAOYSA-N	-1	3	336.753	1.290	20	5		EDBDHM
COc1c([O-])ccc(CN2CCO[C@H]([C@@H]3CCCO3)C2)c1[N+](=O)[O-]	ZINC000892222131	590871693	/nfs/dbraw/zinc/87/16/93/590871693.db2.gz	ORKOXQNLUVSQMQ-KBPBESRZSA-N	-1	3	338.360	1.689	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2COC[C@H]2C2CC2)c1C	ZINC000908409587	592484255	/nfs/dbraw/zinc/48/42/55/592484255.db2.gz	LIMQMUMJOWBBRQ-QWHCGFSZSA-N	-1	3	340.401	1.915	20	5		EDBDHM
CC(C)COC[C@@H](O)CNc1ccc(-c2nnn[n-]2)c([N+](=O)[O-])c1	ZINC000820103195	593791405	/nfs/dbraw/zinc/79/14/05/593791405.db2.gz	PDCQRUAUQOOBRB-NSHDSACASA-N	-1	3	336.352	1.220	20	5		EDBDHM
C[C@@H](CO[C@@H]1CCOC1)Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820286812	593806248	/nfs/dbraw/zinc/80/62/48/593806248.db2.gz	FYMJYPVYMKATLD-GXSJLCMTSA-N	-1	3	334.336	1.381	20	5		EDBDHM
C[C@@H](CO[C@@H]1CCOC1)Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820286812	593806249	/nfs/dbraw/zinc/80/62/49/593806249.db2.gz	FYMJYPVYMKATLD-GXSJLCMTSA-N	-1	3	334.336	1.381	20	5		EDBDHM
C[C@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccc(-c2nnn[n-]2)cc1	ZINC000820502222	593824462	/nfs/dbraw/zinc/82/44/62/593824462.db2.gz	OIIYPIMVOASWEB-VIFPVBQESA-N	-1	3	343.303	1.276	20	5		EDBDHM
C[C@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccc(-c2nn[n-]n2)cc1	ZINC000820502222	593824463	/nfs/dbraw/zinc/82/44/63/593824463.db2.gz	OIIYPIMVOASWEB-VIFPVBQESA-N	-1	3	343.303	1.276	20	5		EDBDHM
CCOC(=O)[C@@H](CC)Sc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000821321114	594015471	/nfs/dbraw/zinc/01/54/71/594015471.db2.gz	TVYLNZDAVPRQRT-SECBINFHSA-N	-1	3	338.349	1.604	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(NCCNc2ncccc2-c2nnn[n-]2)n1	ZINC000822270973	594022039	/nfs/dbraw/zinc/02/20/39/594022039.db2.gz	GOMNYNBXBGZSSV-UHFFFAOYSA-N	-1	3	341.335	1.397	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(NCCNc2ncccc2-c2nn[n-]n2)n1	ZINC000822270973	594022043	/nfs/dbraw/zinc/02/20/43/594022043.db2.gz	GOMNYNBXBGZSSV-UHFFFAOYSA-N	-1	3	341.335	1.397	20	5		EDBDHM
Cc1cccc(OCCNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)c1	ZINC000822329142	594032905	/nfs/dbraw/zinc/03/29/05/594032905.db2.gz	ZIHZUEGCEDENOU-UHFFFAOYSA-N	-1	3	341.331	1.969	20	5		EDBDHM
Cc1cccc(OCCNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)c1	ZINC000822329142	594032907	/nfs/dbraw/zinc/03/29/07/594032907.db2.gz	ZIHZUEGCEDENOU-UHFFFAOYSA-N	-1	3	341.331	1.969	20	5		EDBDHM
C[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)c1nnc2n1CCC2	ZINC000824657232	594051477	/nfs/dbraw/zinc/05/14/77/594051477.db2.gz	PZMKVSFRLXQUCM-MRVPVSSYSA-N	-1	3	341.335	1.486	20	5		EDBDHM
C[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)c1nnc2n1CCC2	ZINC000824657232	594051479	/nfs/dbraw/zinc/05/14/79/594051479.db2.gz	PZMKVSFRLXQUCM-MRVPVSSYSA-N	-1	3	341.335	1.486	20	5		EDBDHM
O=C(Nc1ccncc1-c1nnn[n-]1)c1cccc(Cl)c1[N+](=O)[O-]	ZINC000823375750	594194318	/nfs/dbraw/zinc/19/43/18/594194318.db2.gz	IKRAVTDCESPLNG-UHFFFAOYSA-N	-1	3	345.706	1.498	20	5		EDBDHM
O=C(Nc1ccncc1-c1nn[n-]n1)c1cccc(Cl)c1[N+](=O)[O-]	ZINC000823375750	594194319	/nfs/dbraw/zinc/19/43/19/594194319.db2.gz	IKRAVTDCESPLNG-UHFFFAOYSA-N	-1	3	345.706	1.498	20	5		EDBDHM
O=[N+]([O-])c1c(-c2nnn[n-]2)ccnc1N1CCC(c2c[nH]cn2)CC1	ZINC000823619792	594221967	/nfs/dbraw/zinc/22/19/67/594221967.db2.gz	BCAZBDPUJDWDJP-UHFFFAOYSA-N	-1	3	341.335	1.277	20	5		EDBDHM
O=[N+]([O-])c1c(-c2nn[n-]n2)ccnc1N1CCC(c2c[nH]cn2)CC1	ZINC000823619792	594221968	/nfs/dbraw/zinc/22/19/68/594221968.db2.gz	BCAZBDPUJDWDJP-UHFFFAOYSA-N	-1	3	341.335	1.277	20	5		EDBDHM
CN(C(=O)[O-])[C@H]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000827889029	594298298	/nfs/dbraw/zinc/29/82/98/594298298.db2.gz	AYWNECNEKZLBTJ-NSHDSACASA-N	-1	3	336.348	1.608	20	5		EDBDHM
O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000826470568	594489000	/nfs/dbraw/zinc/48/90/00/594489000.db2.gz	VAQBKSNQDVNIRH-UHFFFAOYSA-N	-1	3	339.315	1.302	20	5		EDBDHM
O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000826470568	594489001	/nfs/dbraw/zinc/48/90/01/594489001.db2.gz	VAQBKSNQDVNIRH-UHFFFAOYSA-N	-1	3	339.315	1.302	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@@H]2CCO[C@@]3(CCOC3)C2)c(-c2nnn[n-]2)c1	ZINC000826498731	594503004	/nfs/dbraw/zinc/50/30/04/594503004.db2.gz	HJJSUKLTGKZFDG-BMIGLBTASA-N	-1	3	346.347	1.525	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@@H]2CCO[C@@]3(CCOC3)C2)c(-c2nn[n-]n2)c1	ZINC000826498731	594503005	/nfs/dbraw/zinc/50/30/05/594503005.db2.gz	HJJSUKLTGKZFDG-BMIGLBTASA-N	-1	3	346.347	1.525	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])co1	ZINC000832477734	594753182	/nfs/dbraw/zinc/75/31/82/594753182.db2.gz	BKCGEZMCFBJLKX-UHFFFAOYSA-N	-1	3	325.346	1.765	20	5		EDBDHM
C[C@@H]1CN(CCC(=O)[O-])CCN1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000833628448	594892029	/nfs/dbraw/zinc/89/20/29/594892029.db2.gz	IKPZKTYOVMEQKX-DOMZBBRYSA-N	-1	3	337.376	1.109	20	5		EDBDHM
O=C([N-][C@H]1CCN(C2CC2)C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848582017	595408656	/nfs/dbraw/zinc/40/86/56/595408656.db2.gz	DRRXGGNHMRBHRG-JTQLQIEISA-N	-1	3	341.314	1.919	20	5		EDBDHM
O=C([N-][C@@H](CCO)C1CC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848583600	595409638	/nfs/dbraw/zinc/40/96/38/595409638.db2.gz	DNQCSIMQGSMNEE-LBPRGKRZSA-N	-1	3	330.287	1.844	20	5		EDBDHM
COC(=O)C1=CC[C@@H]([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C1	ZINC000859287628	596034298	/nfs/dbraw/zinc/03/42/98/596034298.db2.gz	YUQYBWLLDNGGJI-SECBINFHSA-N	-1	3	346.386	1.505	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@H]2c3ccccc3C[C@@H]2O)cs1	ZINC000120045891	596239591	/nfs/dbraw/zinc/23/95/91/596239591.db2.gz	UELYMLAEHVLCAR-AAEUAGOBSA-N	-1	3	340.382	1.593	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@@H](O)Cc2ccccc2)cs1	ZINC000119816463	596743635	/nfs/dbraw/zinc/74/36/35/596743635.db2.gz	IYUWQCANPDIBRU-NSHDSACASA-N	-1	3	342.398	1.538	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2cnc(C)s2)c([N+](=O)[O-])c1	ZINC000098039047	219073337	/nfs/dbraw/zinc/07/33/37/219073337.db2.gz	SNUDVWZRKBLJJS-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
Cn1cc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c(C(F)(F)F)n1	ZINC000445221062	282665843	/nfs/dbraw/zinc/66/58/43/282665843.db2.gz	NURWLUIFXSPUBO-UHFFFAOYSA-N	-1	3	331.210	1.700	20	5		EDBDHM
COc1cc(C(=O)NCCc2c(C)[n-][nH]c2=O)cc([N+](=O)[O-])c1C	ZINC000562310525	306294631	/nfs/dbraw/zinc/29/46/31/306294631.db2.gz	HVINVBLQWWTZCO-LLVKDONJSA-N	-1	3	334.332	1.154	20	5		EDBDHM
CCOc1ncccc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000064245233	138170197	/nfs/dbraw/zinc/17/01/97/138170197.db2.gz	QKXVSBDPPGGFDS-UHFFFAOYSA-N	-1	3	343.386	1.929	20	5		EDBDHM
CC1(C)[C@H](O)C[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000130222646	138340425	/nfs/dbraw/zinc/34/04/25/138340425.db2.gz	JCWRHKBDNSDPFQ-WDEREUQCSA-N	-1	3	334.781	1.686	20	5		EDBDHM
Cc1occc1CNCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000414390038	304114050	/nfs/dbraw/zinc/11/40/50/304114050.db2.gz	HTUBEVMSKSQNCX-UHFFFAOYSA-N	-1	3	339.373	1.564	20	5		EDBDHM
CCOC(=O)[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000049499088	214012736	/nfs/dbraw/zinc/01/27/36/214012736.db2.gz	JPTBOKUHWGFIBZ-ZETCQYMHSA-N	-1	3	336.753	1.478	20	5		EDBDHM
Cc1nnsc1C[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000490416731	255087546	/nfs/dbraw/zinc/08/75/46/255087546.db2.gz	CHQIUZHZPJULHD-UHFFFAOYSA-N	-1	3	328.375	1.374	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@]2(C)CCOC2)cc1[N+](=O)[O-]	ZINC000491611051	255132161	/nfs/dbraw/zinc/13/21/61/255132161.db2.gz	WWSQMPLZMXNCDR-ZDUSSCGKSA-N	-1	3	348.352	1.447	20	5		EDBDHM
C[C@@H]1C[C@@H]1C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000263989142	139374189	/nfs/dbraw/zinc/37/41/89/139374189.db2.gz	JAALPMUSORCKDG-RKDXNWHRSA-N	-1	3	328.346	1.300	20	5		EDBDHM
Cn1ccnc1-c1cc(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)n[n-]1	ZINC000119776047	221397945	/nfs/dbraw/zinc/39/79/45/221397945.db2.gz	HIVCHSPMPAUXGA-UHFFFAOYSA-N	-1	3	327.304	1.553	20	5		EDBDHM
Cn1ccnc1-c1cc(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)[n-]n1	ZINC000119776047	221397947	/nfs/dbraw/zinc/39/79/47/221397947.db2.gz	HIVCHSPMPAUXGA-UHFFFAOYSA-N	-1	3	327.304	1.553	20	5		EDBDHM
CCc1nc([N-]C(=O)c2nn(C)cc2[N+](=O)[O-])sc1C(=O)OC	ZINC000271377680	140287736	/nfs/dbraw/zinc/28/77/36/140287736.db2.gz	IWQAPNMVUDEKGG-UHFFFAOYSA-N	-1	3	339.333	1.386	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC2([C@@H](O)C(C)C)CC2)c([N+](=O)[O-])c1	ZINC000332122057	141126850	/nfs/dbraw/zinc/12/68/50/141126850.db2.gz	HSYJPCKDHBPVML-AWEZNQCLSA-N	-1	3	342.417	1.979	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1cn(C)nc1C	ZINC000416453772	304320434	/nfs/dbraw/zinc/32/04/34/304320434.db2.gz	GQBJZAAJYRHOON-UHFFFAOYSA-N	-1	3	340.361	1.124	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H](C)C(C)C	ZINC000345480738	143096289	/nfs/dbraw/zinc/09/62/89/143096289.db2.gz	QRNRBTCBQLXPTG-JTQLQIEISA-N	-1	3	344.389	1.952	20	5		EDBDHM
CNC(=O)[C@H]1CCC[C@H]1[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000345510816	143100075	/nfs/dbraw/zinc/10/00/75/143100075.db2.gz	NUPKZNSSTSLXNF-WDEREUQCSA-N	-1	3	341.389	1.096	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CC[C@@H](C)O1	ZINC000416526907	304328785	/nfs/dbraw/zinc/32/87/85/304328785.db2.gz	BVGIWPLMLANQPA-MWLCHTKSSA-N	-1	3	330.362	1.449	20	5		EDBDHM
CN1CCC[C@H](CC[N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000416559829	304331502	/nfs/dbraw/zinc/33/15/02/304331502.db2.gz	KLQJEMPUYGHJGK-LLVKDONJSA-N	-1	3	345.396	1.744	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H](O)C(C)C	ZINC000416628926	304338457	/nfs/dbraw/zinc/33/84/57/304338457.db2.gz	SAAZEOLOLOZSDF-AAEUAGOBSA-N	-1	3	334.369	1.808	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)c1csnn1	ZINC000416641944	304340725	/nfs/dbraw/zinc/34/07/25/304340725.db2.gz	ZMPDIXCYIXZHRS-ZETCQYMHSA-N	-1	3	344.374	1.494	20	5		EDBDHM
CC[C@H](C)[C@](C)(O)C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000352869577	149196683	/nfs/dbraw/zinc/19/66/83/149196683.db2.gz	HSUUAJUMAOLLPG-SMDDNHRTSA-N	-1	3	330.406	1.811	20	5		EDBDHM
Cc1ncc(CNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])c(=O)[n-]1	ZINC000352936655	149221344	/nfs/dbraw/zinc/22/13/44/149221344.db2.gz	AUILKNRDFFMFNC-UHFFFAOYSA-N	-1	3	338.345	1.018	20	5		EDBDHM
CCO[C@H]1COCC[C@H]1[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000352987072	149241538	/nfs/dbraw/zinc/24/15/38/149241538.db2.gz	UFVSNHUWGRRDQW-KGLIPLIRSA-N	-1	3	344.389	1.208	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H]2[C@H]3COC[C@H]32)c1[N+](=O)[O-]	ZINC000367522354	154159171	/nfs/dbraw/zinc/15/91/71/154159171.db2.gz	DZJHUXSFWMWGHS-CNDDSTCGSA-N	-1	3	326.374	1.382	20	5		EDBDHM
COc1cc(CN[C@H]2CCN(c3ccn(C)n3)C2)c([N+](=O)[O-])cc1[O-]	ZINC000367701828	154234882	/nfs/dbraw/zinc/23/48/82/154234882.db2.gz	UEHSQHSFVNSYCW-LBPRGKRZSA-N	-1	3	347.375	1.411	20	5		EDBDHM
COc1cc(CN[C@H]2CC(=O)N3CCCC[C@H]23)c([N+](=O)[O-])cc1[O-]	ZINC000374590654	157337629	/nfs/dbraw/zinc/33/76/29/157337629.db2.gz	FBUHQKUPXNFGNG-NWDGAFQWSA-N	-1	3	335.360	1.552	20	5		EDBDHM
Cn1ccnc1[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C1CC1	ZINC000352281482	162091887	/nfs/dbraw/zinc/09/18/87/162091887.db2.gz	MPNFXFHQKDQTCI-CYBMUJFWSA-N	-1	3	336.373	1.758	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]Cc1nnc2ccccn21	ZINC000078334835	287292493	/nfs/dbraw/zinc/29/24/93/287292493.db2.gz	OOVZLHQWZFHKHW-UHFFFAOYSA-N	-1	3	333.329	1.116	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H](C)[C@H](C)CO)cc1[N+](=O)[O-]	ZINC000120494643	221594048	/nfs/dbraw/zinc/59/40/48/221594048.db2.gz	IJJXYHQDBXWZDG-RKDXNWHRSA-N	-1	3	336.797	1.852	20	5		EDBDHM
O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)[N-]CCCF)c1	ZINC000134512466	287556160	/nfs/dbraw/zinc/55/61/60/287556160.db2.gz	QHFVEQGQAXIXMI-UHFFFAOYSA-N	-1	3	341.158	1.995	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@]2(C)CCOC2)cc1[N+](=O)[O-]	ZINC000275477780	268349152	/nfs/dbraw/zinc/34/91/52/268349152.db2.gz	WQNZECLWTGKGPO-LBPRGKRZSA-N	-1	3	334.325	1.200	20	5		EDBDHM
CC(C)N1CCC[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000274731655	273098312	/nfs/dbraw/zinc/09/83/12/273098312.db2.gz	ULMCTLIYKFZKCO-GFCCVEGCSA-N	-1	3	327.406	1.746	20	5		EDBDHM
O=C(Nc1cc([C@@H]2CCCOC2)[nH]n1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000279997471	273338584	/nfs/dbraw/zinc/33/85/84/273338584.db2.gz	MEBNURUBMDEVTO-MRVPVSSYSA-N	-1	3	333.304	1.565	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2([S@](C)=O)CC2)cc1C	ZINC000282642280	273693159	/nfs/dbraw/zinc/69/31/59/273693159.db2.gz	UEZSSGLBNTZCIS-NRFANRHFSA-N	-1	3	346.430	1.401	20	5		EDBDHM
O=c1[n-]nc([C@H]2CCCN(CCOc3cccc([N+](=O)[O-])c3)C2)o1	ZINC000284433708	274200518	/nfs/dbraw/zinc/20/05/18/274200518.db2.gz	YTDYWPIPSKJWRP-NSHDSACASA-N	-1	3	334.332	1.530	20	5		EDBDHM
COc1cc(OCC(=O)[N-]c2nncn2C2CC2)ccc1[N+](=O)[O-]	ZINC000285808929	274655978	/nfs/dbraw/zinc/65/59/78/274655978.db2.gz	NEFHQVAWDOCICN-UHFFFAOYSA-N	-1	3	333.304	1.547	20	5		EDBDHM
Cc1cc(N2CCC[C@@H]2C[C@]2(C)NC(=O)[N-]C2=O)ncc1[N+](=O)[O-]	ZINC000286239508	287965302	/nfs/dbraw/zinc/96/53/02/287965302.db2.gz	DDGHZBQJRIELGY-BMIGLBTASA-N	-1	3	333.348	1.255	20	5		EDBDHM
CC(C)(C)[C@@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000190128831	278485920	/nfs/dbraw/zinc/48/59/20/278485920.db2.gz	PUGILTOPEJWFPD-LLVKDONJSA-N	-1	3	336.797	1.934	20	5		EDBDHM
Cc1cc(C(=O)N[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375103457	301142206	/nfs/dbraw/zinc/14/22/06/301142206.db2.gz	WLBSPXZRZQLTHL-ZWKOPEQDSA-N	-1	3	333.344	1.691	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2C[C@H]3CC[C@@H]2O3)c1[N+](=O)[O-]	ZINC000189973133	301556609	/nfs/dbraw/zinc/55/66/09/301556609.db2.gz	RMUPSUBUALKDPZ-UTUOFQBUSA-N	-1	3	326.374	1.810	20	5		EDBDHM
Cc1ccn(C)c(=O)c1[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000176933415	302252071	/nfs/dbraw/zinc/25/20/71/302252071.db2.gz	UNQMFVGIODBZOO-UHFFFAOYSA-N	-1	3	337.357	1.711	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H](OC)C1CC1	ZINC000293915455	303037865	/nfs/dbraw/zinc/03/78/65/303037865.db2.gz	XJKUGCMPBLEJKC-LBPRGKRZSA-N	-1	3	330.362	1.307	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)CC(C)(C)O	ZINC000295552500	303234202	/nfs/dbraw/zinc/23/42/02/303234202.db2.gz	SJIODXLFVUPNAJ-VIFPVBQESA-N	-1	3	332.378	1.431	20	5		EDBDHM
Cc1c(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)cnn1C1CCOCC1	ZINC000295614616	303242171	/nfs/dbraw/zinc/24/21/71/303242171.db2.gz	RBVWSWSOKWZBKP-UHFFFAOYSA-N	-1	3	347.331	1.804	20	5		EDBDHM
CO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C1(C)C	ZINC000440406420	305205814	/nfs/dbraw/zinc/20/58/14/305205814.db2.gz	XRAMKFCPJJENAY-CHWSQXEVSA-N	-1	3	328.390	1.995	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2C)n[nH]1	ZINC000451592491	305355264	/nfs/dbraw/zinc/35/52/64/305355264.db2.gz	FVDXIWRXCUWLBQ-UHFFFAOYSA-N	-1	3	325.350	1.062	20	5		EDBDHM
COC[C@@](C)(O)CC[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000451645563	305358754	/nfs/dbraw/zinc/35/87/54/305358754.db2.gz	AVSOPBGWVGJTRR-AWEZNQCLSA-N	-1	3	346.405	1.277	20	5		EDBDHM
COc1cccnc1C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000452041474	305379676	/nfs/dbraw/zinc/37/96/76/305379676.db2.gz	AGVDTEVOWASLQJ-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H](O)C2CCC2)c1[N+](=O)[O-]	ZINC000452054529	305380795	/nfs/dbraw/zinc/38/07/95/305380795.db2.gz	RIFHXAMITFGRTC-GFCCVEGCSA-N	-1	3	328.390	1.651	20	5		EDBDHM
Cc1cc(CS(=O)(=O)[N-]CCOc2ccc([N+](=O)[O-])cc2)on1	ZINC000531382729	305958117	/nfs/dbraw/zinc/95/81/17/305958117.db2.gz	DNGUZCJPFDAHJP-UHFFFAOYSA-N	-1	3	341.345	1.390	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCCCn2ccnc2)c([N+](=O)[O-])c1	ZINC000538275545	306030408	/nfs/dbraw/zinc/03/04/08/306030408.db2.gz	IKNVUEUMTNSHKS-UHFFFAOYSA-N	-1	3	338.389	1.858	20	5		EDBDHM
C[C@]1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCO[C@@H]1C1CC1	ZINC000542318476	306053001	/nfs/dbraw/zinc/05/30/01/306053001.db2.gz	SUOLGBNFNNGEOQ-KGLIPLIRSA-N	-1	3	344.364	1.970	20	5		EDBDHM
C[N-]S(=O)(=O)c1ccc(CNc2ccc([N+](=O)[O-])cn2)s1	ZINC000058537433	441201227	/nfs/dbraw/zinc/20/12/27/441201227.db2.gz	YEMGBRQVQAWNRI-UHFFFAOYSA-N	-1	3	328.375	1.572	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCC(=O)OC(C)C)cc1C	ZINC000060498076	441247101	/nfs/dbraw/zinc/24/71/01/441247101.db2.gz	YSVXMUWLBDQFOW-UHFFFAOYSA-N	-1	3	344.389	1.832	20	5		EDBDHM
Cn1ncc2c1CCC[C@@H]2[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000026850598	441386227	/nfs/dbraw/zinc/38/62/27/441386227.db2.gz	QGHKJEBBNRIVLA-NSHDSACASA-N	-1	3	336.373	1.684	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@H]1CCN(C2CC2)C1	ZINC000073842147	441359267	/nfs/dbraw/zinc/35/92/67/441359267.db2.gz	ZERPHXSZEJOJDE-LLVKDONJSA-N	-1	3	325.390	1.357	20	5		EDBDHM
CN(C)Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)cc1	ZINC000028813818	441438410	/nfs/dbraw/zinc/43/84/10/441438410.db2.gz	AHOLCBNCIBOEKP-UHFFFAOYSA-N	-1	3	330.344	1.275	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCN3CCCC[C@H]23)s1	ZINC000066333495	441520989	/nfs/dbraw/zinc/52/09/89/441520989.db2.gz	VGZTVVINNMRGQY-NXEZZACHSA-N	-1	3	331.419	1.561	20	5		EDBDHM
Cc1noc(CCC[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])n1	ZINC000066935118	441590275	/nfs/dbraw/zinc/59/02/75/441590275.db2.gz	GKLJGOYZKDUJRS-UHFFFAOYSA-N	-1	3	340.361	1.506	20	5		EDBDHM
Cc1nc(C)c(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(=O)[n-]1	ZINC000041615054	441663377	/nfs/dbraw/zinc/66/33/77/441663377.db2.gz	DBMCYLDXNNGTSB-UHFFFAOYSA-N	-1	3	328.328	1.427	20	5		EDBDHM
O=C(c1cccc([N+](=O)[O-])c1[O-])N1CCN(c2ccncc2)CC1	ZINC000159702408	441830313	/nfs/dbraw/zinc/83/03/13/441830313.db2.gz	CIJULFVIJOESBD-UHFFFAOYSA-N	-1	3	328.328	1.658	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCOCC(F)(F)F	ZINC000119912089	441974803	/nfs/dbraw/zinc/97/48/03/441974803.db2.gz	PEZBBZRORLAJJS-UHFFFAOYSA-N	-1	3	328.268	1.452	20	5		EDBDHM
CC[C@H](C)[C@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000119400053	441932492	/nfs/dbraw/zinc/93/24/92/441932492.db2.gz	HAOIKCXDAQGJAE-GZMMTYOYSA-N	-1	3	336.797	1.934	20	5		EDBDHM
Cc1noc(CC[N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])n1	ZINC000120061255	442001948	/nfs/dbraw/zinc/00/19/48/442001948.db2.gz	DILWZVBBYUQKQV-UHFFFAOYSA-N	-1	3	340.361	1.424	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C[C@H]2CCC[C@@H]2O)cc1[N+](=O)[O-]	ZINC000162798001	442123803	/nfs/dbraw/zinc/12/38/03/442123803.db2.gz	CYYQRGJTKAKWET-SKDRFNHKSA-N	-1	3	348.808	1.996	20	5		EDBDHM
C[N-]S(=O)(=O)c1ccc(CNc2nc(C)ccc2[N+](=O)[O-])s1	ZINC000120766638	442129398	/nfs/dbraw/zinc/12/93/98/442129398.db2.gz	NWIHYFIGZNRWQK-UHFFFAOYSA-N	-1	3	342.402	1.880	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2c3ccccc3C[C@H]2O)c([N+](=O)[O-])c1	ZINC000151934193	442142881	/nfs/dbraw/zinc/14/28/81/442142881.db2.gz	NZTQIHSIPUMCRR-ZBFHGGJFSA-N	-1	3	348.380	1.840	20	5		EDBDHM
O=C([N-]c1cnns1)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1	ZINC000192027654	442572905	/nfs/dbraw/zinc/57/29/05/442572905.db2.gz	AGXCIVNSSKPXMN-UHFFFAOYSA-N	-1	3	349.372	1.524	20	5		EDBDHM
CN(CCNC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)Cc1ccc(F)cc1	ZINC000193672542	442766203	/nfs/dbraw/zinc/76/62/03/442766203.db2.gz	KFTPXZSODVRJAQ-UHFFFAOYSA-N	-1	3	348.334	1.696	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCCOC1CCOCC1	ZINC000266158720	443039399	/nfs/dbraw/zinc/03/93/99/443039399.db2.gz	GZWHRENGPLPVSP-UHFFFAOYSA-N	-1	3	344.389	1.459	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-]CCC1CC1)OCCO2	ZINC000266296040	443089277	/nfs/dbraw/zinc/08/92/77/443089277.db2.gz	MUEGBTZWNWXSJJ-UHFFFAOYSA-N	-1	3	328.346	1.444	20	5		EDBDHM
CC[C@@H](CCO)C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000190066094	443052533	/nfs/dbraw/zinc/05/25/33/443052533.db2.gz	XBIJKIOMSMBXNU-LBPRGKRZSA-N	-1	3	330.406	1.899	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](O)C2CCC2)cc1C	ZINC000316354726	318934493	/nfs/dbraw/zinc/93/44/93/318934493.db2.gz	RRNXDUURQRWKKL-CYBMUJFWSA-N	-1	3	328.390	1.651	20	5		EDBDHM
Cn1cc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c(=O)[n-]c1=O	ZINC000269116232	443202811	/nfs/dbraw/zinc/20/28/11/443202811.db2.gz	DKNSZZGKQAUUPA-UHFFFAOYSA-N	-1	3	344.327	1.199	20	5		EDBDHM
Cc1nc([N+](=O)[O-])c(-c2noc(Cc3c(C)nc(C)[n-]c3=O)n2)n1C	ZINC000350922880	319079639	/nfs/dbraw/zinc/07/96/39/319079639.db2.gz	IUPXDFPXXBRCRE-UHFFFAOYSA-N	-1	3	345.319	1.390	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CS[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000416583587	319447793	/nfs/dbraw/zinc/44/77/93/319447793.db2.gz	FRFGUWREUSLIPC-BDAKNGLRSA-N	-1	3	332.403	1.776	20	5		EDBDHM
COC(=O)[C@H]([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000272156602	443542646	/nfs/dbraw/zinc/54/26/46/443542646.db2.gz	DNNDADRSWIBAJX-LLVKDONJSA-N	-1	3	328.271	1.754	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1NC(=O)CNC(=O)c1cccc([O-])c1	ZINC000426585378	319885751	/nfs/dbraw/zinc/88/57/51/319885751.db2.gz	XEDPBCJPHBIDNT-UHFFFAOYSA-N	-1	3	329.312	1.977	20	5		EDBDHM
COC(=O)[C@@H](C)[N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl	ZINC000272413831	443617724	/nfs/dbraw/zinc/61/77/24/443617724.db2.gz	CQEXGHGWMJKERC-SSDOTTSWSA-N	-1	3	336.753	1.396	20	5		EDBDHM
O=C([N-]OC[C@@H]1CCOC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21	ZINC000276443863	443707126	/nfs/dbraw/zinc/70/71/26/443707126.db2.gz	LQJZDUXZGCCARF-SECBINFHSA-N	-1	3	333.300	1.547	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](C)c2ncn(C)n2)c1[N+](=O)[O-]	ZINC000276789363	443827808	/nfs/dbraw/zinc/82/78/08/443827808.db2.gz	JFORPJWODLQZTO-JTQLQIEISA-N	-1	3	339.377	1.380	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](CO)C(C)(C)C	ZINC000276804030	443833800	/nfs/dbraw/zinc/83/38/00/443833800.db2.gz	LBBLGCUXHMVDMS-GFCCVEGCSA-N	-1	3	332.378	1.289	20	5		EDBDHM
CC1(C)CCC[C@]1(O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000292935791	443882550	/nfs/dbraw/zinc/88/25/50/443882550.db2.gz	ZMIJXWUADCPZJY-AWEZNQCLSA-N	-1	3	328.390	1.814	20	5		EDBDHM
O=[N+]([O-])c1c(F)cccc1S(=O)(=O)[N-]C1(c2nnc[nH]2)CCC1	ZINC000281242091	443857347	/nfs/dbraw/zinc/85/73/47/443857347.db2.gz	TYHLHCDKADJEQD-UHFFFAOYSA-N	-1	3	341.324	1.210	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCOC[C@@H]2C)c1C	ZINC000277728405	444033855	/nfs/dbraw/zinc/03/38/55/444033855.db2.gz	JMRADOSJAFAWGE-JQWIXIFHSA-N	-1	3	328.390	1.915	20	5		EDBDHM
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)[N-]CCCN1CCCC1	ZINC000299363242	444027935	/nfs/dbraw/zinc/02/79/35/444027935.db2.gz	DGEBUIOGPDLGSH-UHFFFAOYSA-N	-1	3	331.369	1.498	20	5		EDBDHM
CCc1nc([N-]C(=O)c2c[nH]nc2[N+](=O)[O-])sc1C(=O)OC	ZINC000573992271	321465458	/nfs/dbraw/zinc/46/54/58/321465458.db2.gz	NTKXUZHUJXNLTI-UHFFFAOYSA-N	-1	3	325.306	1.376	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1C=CCCC1	ZINC000343742719	444559747	/nfs/dbraw/zinc/55/97/47/444559747.db2.gz	IYBQSYWAYCSTHW-JTQLQIEISA-N	-1	3	340.357	1.768	20	5		EDBDHM
COC(=O)c1cc(C(=O)[N-]c2nc3ccccn3n2)cc([N+](=O)[O-])c1	ZINC000342677237	444809047	/nfs/dbraw/zinc/80/90/47/444809047.db2.gz	JIHSUQUZQOZEQA-UHFFFAOYSA-N	-1	3	341.283	1.676	20	5		EDBDHM
CCOC(=O)c1csc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)n1	ZINC000344312936	444895607	/nfs/dbraw/zinc/89/56/07/444895607.db2.gz	COMSEEOEIWGLJJ-UHFFFAOYSA-N	-1	3	338.301	1.581	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C2CCS(=O)CC2)c([N+](=O)[O-])c1	ZINC000330832752	445158846	/nfs/dbraw/zinc/15/88/46/445158846.db2.gz	HKALUIDBKVIHHK-UHFFFAOYSA-N	-1	3	332.403	1.093	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@H]2CC[C@H](O)C2)cc1[N+](=O)[O-]	ZINC000353821132	445771368	/nfs/dbraw/zinc/77/13/68/445771368.db2.gz	BHYDHKGBHZCNIA-IUCAKERBSA-N	-1	3	348.352	1.182	20	5		EDBDHM
CN(C)CCN(Cc1ccccn1)C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000356805833	446038250	/nfs/dbraw/zinc/03/82/50/446038250.db2.gz	RUQLLZYVQWTARR-UHFFFAOYSA-N	-1	3	344.371	1.899	20	5		EDBDHM
C[C@@H]1C[C@@H]1N1CCN(c2nccc(C(=O)[O-])c2[N+](=O)[O-])C[C@@H](C)C1	ZINC000583324594	326050979	/nfs/dbraw/zinc/05/09/79/326050979.db2.gz	AUHOANCECZIHQO-LOWVWBTDSA-N	-1	3	334.376	1.855	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)[N-]c2nc3c(s2)CSCC3)n1	ZINC000376158057	446360294	/nfs/dbraw/zinc/36/02/94/446360294.db2.gz	NITQKVPRJGWUGF-UHFFFAOYSA-N	-1	3	325.375	1.826	20	5		EDBDHM
CCN1CCN([C@H](C)CNC(=O)c2cc([O-])cc([N+](=O)[O-])c2)CC1	ZINC000432496403	446475481	/nfs/dbraw/zinc/47/54/81/446475481.db2.gz	VPMSCXNSJXDKSP-GFCCVEGCSA-N	-1	3	336.392	1.056	20	5		EDBDHM
Cc1nnc2n1CCC[C@@H]2[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000368117694	446650942	/nfs/dbraw/zinc/65/09/42/446650942.db2.gz	DKCOXKLBDFULNE-LBPRGKRZSA-N	-1	3	337.361	1.308	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CNCCC1(F)F	ZINC000420447582	446624234	/nfs/dbraw/zinc/62/42/34/446624234.db2.gz	QHUFKLMCDXJSLR-SNVBAGLBSA-N	-1	3	335.332	1.179	20	5		EDBDHM
COCCC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000427813636	447653023	/nfs/dbraw/zinc/65/30/23/447653023.db2.gz	VRHYVGCNVFDBJF-UHFFFAOYSA-N	-1	3	344.389	1.698	20	5		EDBDHM
CCN1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1=O	ZINC000451864885	447767616	/nfs/dbraw/zinc/76/76/16/447767616.db2.gz	JDOWDQPROTYWLB-QMMMGPOBSA-N	-1	3	347.780	1.147	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H](C)C(=O)OC(C)C)c([N+](=O)[O-])c1	ZINC000452006214	447801148	/nfs/dbraw/zinc/80/11/48/447801148.db2.gz	DQIHXAPSNUYWSO-JTQLQIEISA-N	-1	3	330.362	1.522	20	5		EDBDHM
C[C@@H](C(=O)N1CCc2nc[n-]c(=O)c2C1)c1cccc([N+](=O)[O-])c1	ZINC000526016142	448080159	/nfs/dbraw/zinc/08/01/59/448080159.db2.gz	DADQRFRVEGZLPT-SNVBAGLBSA-N	-1	3	328.328	1.779	20	5		EDBDHM
CC[C@@H]1C[C@H]([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2OC)CCO1	ZINC000591468228	448374226	/nfs/dbraw/zinc/37/42/26/448374226.db2.gz	XEOONSXJHMLAOL-GHMZBOCLSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCn2ccnc2)c(F)cc1[N+](=O)[O-]	ZINC000590589043	449205259	/nfs/dbraw/zinc/20/52/59/449205259.db2.gz	GSNYEHJRYJTEOS-UHFFFAOYSA-N	-1	3	328.325	1.217	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CC[C@@H](CO)CC1	ZINC000611157901	449191051	/nfs/dbraw/zinc/19/10/51/449191051.db2.gz	MBCIUMDQIJLQPG-PHIMTYICSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CCc1ccc(C(=O)NCc2nc(CN)cc(=O)[n-]2)cc1[N+](=O)[O-]	ZINC000595947372	449273399	/nfs/dbraw/zinc/27/33/99/449273399.db2.gz	KPUHZMUCONKYLC-UHFFFAOYSA-N	-1	3	331.332	1.042	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)ncn1	ZINC000598609140	449492156	/nfs/dbraw/zinc/49/21/56/449492156.db2.gz	YZAVIAAISXOTAD-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
Cn1[n-]c([C@H]2CCCN2c2ncnc3ccc([N+](=O)[O-])cc32)nc1=N	ZINC000596253156	449441153	/nfs/dbraw/zinc/44/11/53/449441153.db2.gz	YAFGZYCHTAWEQB-GFCCVEGCSA-N	-1	3	340.347	1.421	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@@H](CO)C1CCC1	ZINC000594802189	449714260	/nfs/dbraw/zinc/71/42/60/449714260.db2.gz	VVSUJWRELYIRMI-JTQLQIEISA-N	-1	3	334.781	1.688	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CCC[C@@H](C)O1	ZINC000594849981	449757019	/nfs/dbraw/zinc/75/70/19/449757019.db2.gz	BJSRVXFSPXDLBJ-PWSUYJOCSA-N	-1	3	344.389	1.839	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H](CO)CC2CC2)c(Cl)c1	ZINC000594863531	449775267	/nfs/dbraw/zinc/77/52/67/449775267.db2.gz	GSWZUABYCUFUQX-SNVBAGLBSA-N	-1	3	348.808	1.935	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1cnn(C)c1C	ZINC000619493811	450490291	/nfs/dbraw/zinc/49/02/91/450490291.db2.gz	YBCVXQAJUPJJAR-UHFFFAOYSA-N	-1	3	340.361	1.124	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]c1ccncc1F	ZINC000619507303	450495406	/nfs/dbraw/zinc/49/54/06/450495406.db2.gz	BRALLNRTULBGPH-UHFFFAOYSA-N	-1	3	327.293	1.360	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(C(=O)NCCNC(=O)c2ccc([O-])cc2)c1	ZINC000175485712	534318429	/nfs/dbraw/zinc/31/84/29/534318429.db2.gz	CIZXIDFKGPWSLA-UHFFFAOYSA-N	-1	3	343.339	1.769	20	5		EDBDHM
CN(CCc1ccccc1F)c1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000736807649	579022686	/nfs/dbraw/zinc/02/26/86/579022686.db2.gz	WYNNBBNWFOOEBB-UHFFFAOYSA-N	-1	3	343.322	1.988	20	5		EDBDHM
CN(CCc1ccccc1F)c1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000736807649	579022687	/nfs/dbraw/zinc/02/26/87/579022687.db2.gz	WYNNBBNWFOOEBB-UHFFFAOYSA-N	-1	3	343.322	1.988	20	5		EDBDHM
Cc1cc(C(=O)Nc2ccncc2-c2nnn[n-]2)cc([N+](=O)[O-])c1	ZINC000737238743	579058766	/nfs/dbraw/zinc/05/87/66/579058766.db2.gz	RRKXGIBNNBYDTA-UHFFFAOYSA-N	-1	3	325.288	1.153	20	5		EDBDHM
Cc1cc(C(=O)Nc2ccncc2-c2nn[n-]n2)cc([N+](=O)[O-])c1	ZINC000737238743	579058767	/nfs/dbraw/zinc/05/87/67/579058767.db2.gz	RRKXGIBNNBYDTA-UHFFFAOYSA-N	-1	3	325.288	1.153	20	5		EDBDHM
Cn1cnc2c1CCN(c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)C2	ZINC000737618725	579121105	/nfs/dbraw/zinc/12/11/05/579121105.db2.gz	KRJCRESECDCIMQ-UHFFFAOYSA-N	-1	3	326.320	1.071	20	5		EDBDHM
Cn1cnc2c1CCN(c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)C2	ZINC000737618725	579121106	/nfs/dbraw/zinc/12/11/06/579121106.db2.gz	KRJCRESECDCIMQ-UHFFFAOYSA-N	-1	3	326.320	1.071	20	5		EDBDHM
CCOc1cc(C(=O)[N-]OC[C@H]2CCOC2)c([N+](=O)[O-])cc1OC	ZINC000788117020	579226478	/nfs/dbraw/zinc/22/64/78/579226478.db2.gz	FTRNZPJJXGQHBJ-JTQLQIEISA-N	-1	3	340.332	1.700	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H]2CCCN(C)C2)cc1[N+](=O)[O-]	ZINC000752235425	579842669	/nfs/dbraw/zinc/84/26/69/579842669.db2.gz	MFSFTTRUGYGXRB-JTQLQIEISA-N	-1	3	347.824	1.929	20	5		EDBDHM
CCOC(=O)CC[C@@H](C)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768866729	580223004	/nfs/dbraw/zinc/22/30/04/580223004.db2.gz	BBXHASBNWHWNPC-MRVPVSSYSA-N	-1	3	336.391	1.666	20	5		EDBDHM
CC(C)(C)[C@H]([N-]S(C)(=O)=O)C(=O)OCc1cccc([N+](=O)[O-])c1	ZINC000770096390	580252716	/nfs/dbraw/zinc/25/27/16/580252716.db2.gz	CGWAYNRTXGBJRX-GFCCVEGCSA-N	-1	3	344.389	1.602	20	5		EDBDHM
O=C(CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[N-]OC1CCOCC1	ZINC000772710939	580318399	/nfs/dbraw/zinc/31/83/99/580318399.db2.gz	ZGCDCMCRORKVKO-UHFFFAOYSA-N	-1	3	339.304	1.662	20	5		EDBDHM
O=C(NCc1nnc(C(F)(F)F)[n-]1)NCc1cccc([N+](=O)[O-])c1	ZINC000776123544	580408699	/nfs/dbraw/zinc/40/86/99/580408699.db2.gz	TWKLFWYQXAAPOQ-UHFFFAOYSA-N	-1	3	344.253	1.731	20	5		EDBDHM
O=C(NCc1n[n-]c(C(F)(F)F)n1)NCc1cccc([N+](=O)[O-])c1	ZINC000776123544	580408700	/nfs/dbraw/zinc/40/87/00/580408700.db2.gz	TWKLFWYQXAAPOQ-UHFFFAOYSA-N	-1	3	344.253	1.731	20	5		EDBDHM
O=C(NCc1nc(C(F)(F)F)n[n-]1)NCc1cccc([N+](=O)[O-])c1	ZINC000776123544	580408701	/nfs/dbraw/zinc/40/87/01/580408701.db2.gz	TWKLFWYQXAAPOQ-UHFFFAOYSA-N	-1	3	344.253	1.731	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C2(C(N)=O)CCC2)c1	ZINC000779916266	580502591	/nfs/dbraw/zinc/50/25/91/580502591.db2.gz	UUVPEHUKZGWEKO-UHFFFAOYSA-N	-1	3	347.780	1.243	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)[N-]c2cnc(Br)cn2)n1	ZINC000779961911	580504750	/nfs/dbraw/zinc/50/47/50/580504750.db2.gz	BLVMUPBDEBHTAA-UHFFFAOYSA-N	-1	3	327.098	1.133	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]CCn2ccnn2)cc1[N+](=O)[O-]	ZINC000782488690	580575863	/nfs/dbraw/zinc/57/58/63/580575863.db2.gz	ZTXFEKMOUAUYET-UHFFFAOYSA-N	-1	3	345.768	1.127	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])cc(Cl)c1F)c1nnc[nH]1	ZINC000798226562	580991461	/nfs/dbraw/zinc/99/14/61/580991461.db2.gz	BKHBKMZMPJQGGJ-YFKPBYRVSA-N	-1	3	349.731	1.545	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NC[C@@H](O)c1ccsc1	ZINC000738358763	598854472	/nfs/dbraw/zinc/85/44/72/598854472.db2.gz	ORJSNUKJWNGHGZ-GFCCVEGCSA-N	-1	3	332.345	1.982	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NC[C@@H](O)c1ccsc1	ZINC000738358763	598854474	/nfs/dbraw/zinc/85/44/74/598854474.db2.gz	ORJSNUKJWNGHGZ-GFCCVEGCSA-N	-1	3	332.345	1.982	20	5		EDBDHM
O=C(OCc1ccc(Br)c([N+](=O)[O-])c1)c1cnn[n-]1	ZINC000805605580	593112226	/nfs/dbraw/zinc/11/22/26/593112226.db2.gz	KVWSAEKFEFCBHV-UHFFFAOYSA-N	-1	3	327.094	1.832	20	5		EDBDHM
O=C(OCc1ccc(Br)c([N+](=O)[O-])c1)c1c[n-]nn1	ZINC000805605580	593112229	/nfs/dbraw/zinc/11/22/29/593112229.db2.gz	KVWSAEKFEFCBHV-UHFFFAOYSA-N	-1	3	327.094	1.832	20	5		EDBDHM
O=C([N-]c1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)c1ccc[n+]([O-])c1	ZINC000103202022	593219139	/nfs/dbraw/zinc/21/91/39/593219139.db2.gz	LCABYLIPGCFEHG-UHFFFAOYSA-N	-1	3	326.272	1.266	20	5		EDBDHM
C/C=C\COC(=O)C[N-]S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000803102694	593302552	/nfs/dbraw/zinc/30/25/52/593302552.db2.gz	KOZIPOBHFPPNTE-IHWYPQMZSA-N	-1	3	348.764	1.646	20	5		EDBDHM
COC(=O)CCCO[N-]C(=O)Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000819932311	593777805	/nfs/dbraw/zinc/77/78/05/593777805.db2.gz	KAFTXQWXPWOPDX-UHFFFAOYSA-N	-1	3	330.724	1.792	20	5		EDBDHM
C[C@H](CO[C@@H]1CCOC1)Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820286814	593806363	/nfs/dbraw/zinc/80/63/63/593806363.db2.gz	FYMJYPVYMKATLD-MWLCHTKSSA-N	-1	3	334.336	1.381	20	5		EDBDHM
C[C@H](CO[C@@H]1CCOC1)Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820286814	593806364	/nfs/dbraw/zinc/80/63/64/593806364.db2.gz	FYMJYPVYMKATLD-MWLCHTKSSA-N	-1	3	334.336	1.381	20	5		EDBDHM
C[C@]1(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CCCC[C@H]1O	ZINC000820623253	593847653	/nfs/dbraw/zinc/84/76/53/593847653.db2.gz	JRGOMYSNUAHRSG-BXUZGUMPSA-N	-1	3	333.352	1.523	20	5		EDBDHM
C[C@]1(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CCCC[C@H]1O	ZINC000820623253	593847655	/nfs/dbraw/zinc/84/76/55/593847655.db2.gz	JRGOMYSNUAHRSG-BXUZGUMPSA-N	-1	3	333.352	1.523	20	5		EDBDHM
O=C([O-])CN1CCC[C@@H]1COC(=O)c1cc(F)cc([N+](=O)[O-])c1	ZINC000821530481	593856166	/nfs/dbraw/zinc/85/61/66/593856166.db2.gz	FNSLXFYZBFIZRR-LLVKDONJSA-N	-1	3	326.280	1.440	20	5		EDBDHM
O=C([O-])c1cccc(CN[C@@H](CO)[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000821551329	593862805	/nfs/dbraw/zinc/86/28/05/593862805.db2.gz	DWYLQIMKHIDDIF-HOTGVXAUSA-N	-1	3	346.339	1.477	20	5		EDBDHM
CCCN(Cc1ccc(-c2nnn[n-]2)cc1)c1c([N+](=O)[O-])ncn1C	ZINC000821104646	593966557	/nfs/dbraw/zinc/96/65/57/593966557.db2.gz	LNGOBXSHOKGOEM-UHFFFAOYSA-N	-1	3	342.363	1.925	20	5		EDBDHM
CCCN(Cc1ccc(-c2nn[n-]n2)cc1)c1c([N+](=O)[O-])ncn1C	ZINC000821104646	593966558	/nfs/dbraw/zinc/96/65/58/593966558.db2.gz	LNGOBXSHOKGOEM-UHFFFAOYSA-N	-1	3	342.363	1.925	20	5		EDBDHM
CC(C)c1nnc(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)n1C	ZINC000824364358	593994373	/nfs/dbraw/zinc/99/43/73/593994373.db2.gz	CIQUZPAOSVWOTD-UHFFFAOYSA-N	-1	3	344.339	1.034	20	5		EDBDHM
CC(C)c1nnc(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)n1C	ZINC000824364358	593994375	/nfs/dbraw/zinc/99/43/75/593994375.db2.gz	CIQUZPAOSVWOTD-UHFFFAOYSA-N	-1	3	344.339	1.034	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(Cc2cc(-c3nnn[n-]3)ccc2F)c1=O	ZINC000822212857	594010860	/nfs/dbraw/zinc/01/08/60/594010860.db2.gz	KGNXEFLBNWIICR-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(Cc2cc(-c3nn[n-]n3)ccc2F)c1=O	ZINC000822212857	594010862	/nfs/dbraw/zinc/01/08/62/594010862.db2.gz	KGNXEFLBNWIICR-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cc1cc(NCCNc2ncccc2-c2nnn[n-]2)ncc1[N+](=O)[O-]	ZINC000822209462	594010902	/nfs/dbraw/zinc/01/09/02/594010902.db2.gz	JVQUIVDQLIEHFE-UHFFFAOYSA-N	-1	3	341.335	1.397	20	5		EDBDHM
Cc1cc(NCCNc2ncccc2-c2nn[n-]n2)ncc1[N+](=O)[O-]	ZINC000822209462	594010904	/nfs/dbraw/zinc/01/09/04/594010904.db2.gz	JVQUIVDQLIEHFE-UHFFFAOYSA-N	-1	3	341.335	1.397	20	5		EDBDHM
C[C@H](NC(=O)c1cc(-c2nnn[n-]2)cn1C)c1ccccc1[N+](=O)[O-]	ZINC000824513304	594027931	/nfs/dbraw/zinc/02/79/31/594027931.db2.gz	AWJDAJHHSCUGMM-VIFPVBQESA-N	-1	3	341.331	1.604	20	5		EDBDHM
C[C@H](NC(=O)c1cc(-c2nn[n-]n2)cn1C)c1ccccc1[N+](=O)[O-]	ZINC000824513304	594027933	/nfs/dbraw/zinc/02/79/33/594027933.db2.gz	AWJDAJHHSCUGMM-VIFPVBQESA-N	-1	3	341.331	1.604	20	5		EDBDHM
C[C@H](NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1ccccc1[N+](=O)[O-]	ZINC000824513829	594028308	/nfs/dbraw/zinc/02/83/08/594028308.db2.gz	JGYXMJMMDCUCFS-QMMMGPOBSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@H](NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1ccccc1[N+](=O)[O-]	ZINC000824513829	594028310	/nfs/dbraw/zinc/02/83/10/594028310.db2.gz	JGYXMJMMDCUCFS-QMMMGPOBSA-N	-1	3	327.304	1.594	20	5		EDBDHM
CN(CC(C)(C)O)c1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000825897983	594272001	/nfs/dbraw/zinc/27/20/01/594272001.db2.gz	TZFYYAHAHCEMFG-UHFFFAOYSA-N	-1	3	343.347	1.530	20	5		EDBDHM
CN(CC(C)(C)O)c1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000825897983	594272002	/nfs/dbraw/zinc/27/20/02/594272002.db2.gz	TZFYYAHAHCEMFG-UHFFFAOYSA-N	-1	3	343.347	1.530	20	5		EDBDHM
Cc1nccn1CCCN(C)c1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000826330768	594428922	/nfs/dbraw/zinc/42/89/22/594428922.db2.gz	HQLRHXXJZOORFO-UHFFFAOYSA-N	-1	3	343.351	1.201	20	5		EDBDHM
Cc1nccn1CCCN(C)c1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000826330768	594428923	/nfs/dbraw/zinc/42/89/23/594428923.db2.gz	HQLRHXXJZOORFO-UHFFFAOYSA-N	-1	3	343.351	1.201	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@H]2c2ncc[nH]2)c(-c2nnn[n-]2)c1	ZINC000826498611	594502762	/nfs/dbraw/zinc/50/27/62/594502762.db2.gz	CQKFRWRMMKMTAM-LBPRGKRZSA-N	-1	3	326.320	1.840	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@H]2c2ncc[nH]2)c(-c2nn[n-]n2)c1	ZINC000826498611	594502763	/nfs/dbraw/zinc/50/27/63/594502763.db2.gz	CQKFRWRMMKMTAM-LBPRGKRZSA-N	-1	3	326.320	1.840	20	5		EDBDHM
COC[C@](C)(CC(=O)[O-])NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000831573771	594684649	/nfs/dbraw/zinc/68/46/49/594684649.db2.gz	VZCVFKIGSXGDMR-HNNXBMFYSA-N	-1	3	339.348	1.027	20	5		EDBDHM
O=C([O-])N1CCC[C@H](CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1	ZINC000831981006	594716298	/nfs/dbraw/zinc/71/62/98/594716298.db2.gz	SGECUDYHLGJNQA-CHWSQXEVSA-N	-1	3	349.391	1.866	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1cc(Cl)c([N+](=O)[O-])cc1F)N(C)C	ZINC000832399914	594747511	/nfs/dbraw/zinc/74/75/11/594747511.db2.gz	HKQJCDFUEQLTJN-ZETCQYMHSA-N	-1	3	339.776	1.616	20	5		EDBDHM
O=C([O-])CCN(Cn1ncc2ccc([N+](=O)[O-])cc21)C1CCOCC1	ZINC000833235873	594811117	/nfs/dbraw/zinc/81/11/17/594811117.db2.gz	JNIGEODLGXAOPK-UHFFFAOYSA-N	-1	3	348.359	1.858	20	5		EDBDHM
CCN(CC[N-]S(=O)(=O)c1cc(C)sc1[N+](=O)[O-])C(C)C	ZINC000867146675	594888691	/nfs/dbraw/zinc/88/86/91/594888691.db2.gz	WYYLXVCEZWATLT-UHFFFAOYSA-N	-1	3	335.451	1.973	20	5		EDBDHM
Cc1nc2sccc2c(=O)n1[N-]C(=O)c1cc([N+](=O)[O-])cn1C	ZINC000841644073	594931089	/nfs/dbraw/zinc/93/10/89/594931089.db2.gz	GFIYAZYKJINQCB-UHFFFAOYSA-N	-1	3	333.329	1.397	20	5		EDBDHM
C[C@H](NC(=O)[O-])[C@@H]1CCCN(CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000833814098	594936137	/nfs/dbraw/zinc/93/61/37/594936137.db2.gz	RHXGADHQBOYWSB-NWDGAFQWSA-N	-1	3	338.364	1.125	20	5		EDBDHM
C[C@H](C(=O)[N-]OC1CCN(C)CC1)c1ccc([N+](=O)[O-])cc1F	ZINC000846650048	595293275	/nfs/dbraw/zinc/29/32/75/595293275.db2.gz	MJVLYLKMSSZZOL-JTQLQIEISA-N	-1	3	325.340	1.979	20	5		EDBDHM
O=C([O-])Cc1ccc(NC[C@@H]2CN3CCC[C@@H]3CO2)c([N+](=O)[O-])c1	ZINC000844207739	595301987	/nfs/dbraw/zinc/30/19/87/595301987.db2.gz	DUMQINLUHPMSFB-CHWSQXEVSA-N	-1	3	335.360	1.497	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H]2CCCN3CCCC[C@@H]23)cs1	ZINC000848507949	595399111	/nfs/dbraw/zinc/39/91/11/595399111.db2.gz	BMQVKWKMAUQPDQ-NEPJUHHUSA-N	-1	3	345.446	1.952	20	5		EDBDHM
O=C([N-]C[C@@H]1COCCO1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848580638	595408372	/nfs/dbraw/zinc/40/83/72/595408372.db2.gz	CLUMROMEKSRAKI-LLVKDONJSA-N	-1	3	332.259	1.098	20	5		EDBDHM
CC(C)(C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)C(N)=O	ZINC000848581055	595408434	/nfs/dbraw/zinc/40/84/34/595408434.db2.gz	KOYOZEURNCLOAL-UHFFFAOYSA-N	-1	3	331.275	1.194	20	5		EDBDHM
COCC[C@H](CO)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848589604	595411167	/nfs/dbraw/zinc/41/11/67/595411167.db2.gz	GFLVQJZYONBFBQ-SECBINFHSA-N	-1	3	334.275	1.080	20	5		EDBDHM
CC1(C[N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)OCCCO1	ZINC000848592771	595412408	/nfs/dbraw/zinc/41/24/08/595412408.db2.gz	MSGXRGNOXFXFQL-UHFFFAOYSA-N	-1	3	346.286	1.836	20	5		EDBDHM
CNc1nccc(C(=O)O[C@H](C)C(=O)[N-]c2cc(C)no2)c1[N+](=O)[O-]	ZINC000848790105	595448599	/nfs/dbraw/zinc/44/85/99/595448599.db2.gz	NECVPVUBYVMFKK-MRVPVSSYSA-N	-1	3	349.303	1.512	20	5		EDBDHM
CC(C)(COC(=O)CC[N-]S(=O)(=O)c1cccs1)[N+](=O)[O-]	ZINC000851126055	595736271	/nfs/dbraw/zinc/73/62/71/595736271.db2.gz	LIHUTJQVLRNOEX-UHFFFAOYSA-N	-1	3	336.391	1.015	20	5		EDBDHM
O=C(Cc1ccc([N+](=O)[O-])cc1Cl)[N-]OCCN1CCCC1=O	ZINC000856039815	595881855	/nfs/dbraw/zinc/88/18/55/595881855.db2.gz	JAHMQHYEVIPKQM-UHFFFAOYSA-N	-1	3	341.751	1.461	20	5		EDBDHM
Cc1cnccc1CC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000120142584	596282493	/nfs/dbraw/zinc/28/24/93/596282493.db2.gz	WEJINYZNUBHSEK-UHFFFAOYSA-N	-1	3	327.387	1.881	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@H]2CCO[C@H](C3CC3)C2)cs1	ZINC000120324504	596439512	/nfs/dbraw/zinc/43/95/12/596439512.db2.gz	KESZRYZVSLDBOG-ONGXEEELSA-N	-1	3	332.403	1.892	20	5		EDBDHM
C[C@@H](CC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)[S@](C)=O	ZINC000120026953	596877345	/nfs/dbraw/zinc/87/73/45/596877345.db2.gz	IZCLKVPCKMVXHB-ULCDLSAGSA-N	-1	3	326.421	1.092	20	5		EDBDHM
CC1(C)CO[C@@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000872549035	596960140	/nfs/dbraw/zinc/96/01/40/596960140.db2.gz	JSMAFCFYJYHCKT-SNVBAGLBSA-N	-1	3	332.353	1.827	20	5		EDBDHM
CCOC(=O)C[C@H](C)CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825499288	608018319	/nfs/dbraw/zinc/01/83/19/608018319.db2.gz	JWTDHQQZAQXHCN-VIFPVBQESA-N	-1	3	334.336	1.776	20	5		EDBDHM
CCOC(=O)C[C@H](C)CNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825499288	608018320	/nfs/dbraw/zinc/01/83/20/608018320.db2.gz	JWTDHQQZAQXHCN-VIFPVBQESA-N	-1	3	334.336	1.776	20	5		EDBDHM
CS[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2[O-])C[C@@H]1N(C)C	ZINC000271204094	295671645	/nfs/dbraw/zinc/67/16/45/295671645.db2.gz	XPTQCIYUSUUQRA-RYUDHWBXSA-N	-1	3	325.390	1.418	20	5		EDBDHM
CC(C)(C(=O)Nc1ccc(-c2nnn[n-]2)cc1)n1cc([N+](=O)[O-])cn1	ZINC000104367809	219380819	/nfs/dbraw/zinc/38/08/19/219380819.db2.gz	VEOMDCKXOOPOQM-UHFFFAOYSA-N	-1	3	342.319	1.345	20	5		EDBDHM
CC(C)(C(=O)Nc1ccc(-c2nn[n-]n2)cc1)n1cc([N+](=O)[O-])cn1	ZINC000104367809	219380822	/nfs/dbraw/zinc/38/08/22/219380822.db2.gz	VEOMDCKXOOPOQM-UHFFFAOYSA-N	-1	3	342.319	1.345	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]Cc1cn2c(n1)CCCC2	ZINC000263797279	139360969	/nfs/dbraw/zinc/36/09/69/139360969.db2.gz	PCENOEDHJSBEKS-UHFFFAOYSA-N	-1	3	336.373	1.606	20	5		EDBDHM
O=C(Nc1ccc(N2CCOC2=O)cc1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000490689295	255099874	/nfs/dbraw/zinc/09/98/74/255099874.db2.gz	AUGSATKUKSYRSQ-UHFFFAOYSA-N	-1	3	344.283	1.904	20	5		EDBDHM
C[S@@](=O)CCC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000116901538	221009632	/nfs/dbraw/zinc/00/96/32/221009632.db2.gz	XKWSYZRHXXJHQO-IBGZPJMESA-N	-1	3	340.810	1.295	20	5		EDBDHM
CS[C@H](CO)[C@H](C)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000270376743	140088974	/nfs/dbraw/zinc/08/89/74/140088974.db2.gz	LTUVZILUIDOPJN-CMPLNLGQSA-N	-1	3	348.446	1.602	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2CCO[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000271241558	140262380	/nfs/dbraw/zinc/26/23/80/140262380.db2.gz	DUXJTTXTYRTCTB-WDEREUQCSA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@H](O)C(F)(F)F)cc([N+](=O)[O-])c1F	ZINC000271368514	140286118	/nfs/dbraw/zinc/28/61/18/140286118.db2.gz	DDPZBACWJCCUNL-QMMMGPOBSA-N	-1	3	346.258	1.244	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC(C)(C)CCCO	ZINC000271665074	140330189	/nfs/dbraw/zinc/33/01/89/140330189.db2.gz	KJJGDULHRMDSKN-UHFFFAOYSA-N	-1	3	346.405	1.680	20	5		EDBDHM
CN1CCC[C@H]1C[N-]S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000271800538	140352132	/nfs/dbraw/zinc/35/21/32/140352132.db2.gz	WLQHAXYVCZOQSO-JTQLQIEISA-N	-1	3	333.797	1.621	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@](C)(O)C2CC2)c([N+](=O)[O-])c1	ZINC000319852065	140659049	/nfs/dbraw/zinc/65/90/49/140659049.db2.gz	HNBRSSGNBOSEEW-ZDUSSCGKSA-N	-1	3	330.362	1.043	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)[C@H]1CCCO1	ZINC000339448942	142048322	/nfs/dbraw/zinc/04/83/22/142048322.db2.gz	JLEYQCQGMOPOLI-NWDGAFQWSA-N	-1	3	344.389	1.839	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H](CO)c1cccnc1	ZINC000344961933	143031605	/nfs/dbraw/zinc/03/16/05/143031605.db2.gz	XMNUYUBLMFNOOR-LBPRGKRZSA-N	-1	3	337.357	1.044	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CCCC1	ZINC000344988987	143035923	/nfs/dbraw/zinc/03/59/23/143035923.db2.gz	YNEGVBWZTRBOOI-UHFFFAOYSA-N	-1	3	342.373	1.500	20	5		EDBDHM
O=C(Nc1ccc(OC(F)F)cn1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000347637063	143343861	/nfs/dbraw/zinc/34/38/61/143343861.db2.gz	HPEVJNIAOLYMRJ-UHFFFAOYSA-N	-1	3	326.215	1.944	20	5		EDBDHM
COc1cc(OC)cc(N(C)C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000347655195	143345920	/nfs/dbraw/zinc/34/59/20/143345920.db2.gz	OYJJTABLUREHTK-UHFFFAOYSA-N	-1	3	333.300	1.989	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H]1C[C@@H](C)O[C@@H]1C	ZINC000416608438	304337169	/nfs/dbraw/zinc/33/71/69/304337169.db2.gz	RRDHNZZSUFYLEJ-UTUOFQBUSA-N	-1	3	328.390	1.995	20	5		EDBDHM
O=C(c1cc([N+](=O)[O-])c[n-]c1=O)N1CCC(Cc2ncc[nH]2)CC1	ZINC000353134979	149299814	/nfs/dbraw/zinc/29/98/14/149299814.db2.gz	IRCCONUIYSRPRD-UHFFFAOYSA-N	-1	3	331.332	1.513	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-][C@@H]1CCO[C@H]1C1CC1	ZINC000363977349	153112702	/nfs/dbraw/zinc/11/27/02/153112702.db2.gz	OMRVEVVKNLVWTL-OCCSQVGLSA-N	-1	3	326.374	1.582	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCNC(=O)C2CC2)cc1C	ZINC000060497713	287235488	/nfs/dbraw/zinc/23/54/88/287235488.db2.gz	ZVENPLCDOVIPTK-UHFFFAOYSA-N	-1	3	341.389	1.016	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H]2CCCN(C)C2)c1C	ZINC000120467420	287361469	/nfs/dbraw/zinc/36/14/69/287361469.db2.gz	QMGFPCBNKNENHF-CYBMUJFWSA-N	-1	3	341.433	1.832	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCC[C@H]2CCO)c([N+](=O)[O-])c1	ZINC000275029332	268268523	/nfs/dbraw/zinc/26/85/23/268268523.db2.gz	ADVMSGSSVWHGIL-JQWIXIFHSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CCC(=O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000275393689	268336277	/nfs/dbraw/zinc/33/62/77/268336277.db2.gz	NNJVHHXBLHCRCR-UHFFFAOYSA-N	-1	3	340.279	1.871	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H](C)CSC)cc1[N+](=O)[O-]	ZINC000275078905	273099953	/nfs/dbraw/zinc/09/99/53/273099953.db2.gz	MVVZHIFREFDTAQ-SSDOTTSWSA-N	-1	3	338.382	1.772	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CSC1(C)C	ZINC000276354833	273162816	/nfs/dbraw/zinc/16/28/16/273162816.db2.gz	SAQMVTCQUQXZSK-LLVKDONJSA-N	-1	3	332.403	1.776	20	5		EDBDHM
O=C([N-]c1cc([N+](=O)[O-])ccc1F)c1cn(C2CCOCC2)nn1	ZINC000291276964	289029760	/nfs/dbraw/zinc/02/97/60/289029760.db2.gz	YLBHYWPODPMUTA-UHFFFAOYSA-N	-1	3	335.295	1.929	20	5		EDBDHM
Cc1nnc2n1CCC[C@H]2[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000365859765	302828951	/nfs/dbraw/zinc/82/89/51/302828951.db2.gz	GZVOTHWWZDNTHA-SNVBAGLBSA-N	-1	3	337.361	1.308	20	5		EDBDHM
CCC[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)OC	ZINC000295147019	303179789	/nfs/dbraw/zinc/17/97/89/303179789.db2.gz	AMIYSLJPHWWPLR-NSHDSACASA-N	-1	3	332.378	1.697	20	5		EDBDHM
CCOC(=O)C(C)(C)O[N-]C(=O)c1cc(OC)ccc1[N+](=O)[O-]	ZINC000295788480	303266674	/nfs/dbraw/zinc/26/66/74/303266674.db2.gz	YRRKLNHLUDSWQP-UHFFFAOYSA-N	-1	3	326.305	1.607	20	5		EDBDHM
Cc1nc(N2CCN(C(=O)c3ccccc3[O-])CC2)ncc1[N+](=O)[O-]	ZINC000296572365	303325394	/nfs/dbraw/zinc/32/53/94/303325394.db2.gz	QMHAUOMAEGCYFQ-UHFFFAOYSA-N	-1	3	343.343	1.361	20	5		EDBDHM
CC[C@H](O)[C@H](CC)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000313102719	303760386	/nfs/dbraw/zinc/76/03/86/303760386.db2.gz	VMRNTPQHPOZFHY-QWRGUYRKSA-N	-1	3	332.378	1.431	20	5		EDBDHM
O=C(C[C@@H]1CSCCN1)Nc1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000423751418	304908177	/nfs/dbraw/zinc/90/81/77/304908177.db2.gz	YPUUWYMAPNSMEU-MRVPVSSYSA-N	-1	3	331.781	1.987	20	5		EDBDHM
C[C@@H](CO[C@@H]1CCOC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000441540851	305222719	/nfs/dbraw/zinc/22/27/19/305222719.db2.gz	CHCVDKLPMQUEKO-GXSJLCMTSA-N	-1	3	348.352	1.206	20	5		EDBDHM
CO[C@@H]1COCC[C@H]1C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000451781044	305368584	/nfs/dbraw/zinc/36/85/84/305368584.db2.gz	XDGDDVCQBONQGH-WCQYABFASA-N	-1	3	344.389	1.233	20	5		EDBDHM
CCC1(C[N-]S(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)COC1	ZINC000451950353	305373415	/nfs/dbraw/zinc/37/34/15/305373415.db2.gz	GZZBLMQYGOMACQ-UHFFFAOYSA-N	-1	3	348.352	1.447	20	5		EDBDHM
CNC(=O)C[C@H](C)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000451953912	305373753	/nfs/dbraw/zinc/37/37/53/305373753.db2.gz	KOWQYAXHRGIZHW-ZETCQYMHSA-N	-1	3	335.769	1.051	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCC[C@H]1CCOC1	ZINC000452012917	305378279	/nfs/dbraw/zinc/37/82/79/305378279.db2.gz	GDYAQDUZFBOYEQ-LBPRGKRZSA-N	-1	3	328.390	1.998	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@@H](O)C2CCC2)cc1[N+](=O)[O-]	ZINC000452045496	305379927	/nfs/dbraw/zinc/37/99/27/305379927.db2.gz	KQNCLKQQIPRINV-GFCCVEGCSA-N	-1	3	348.352	1.182	20	5		EDBDHM
CC(C)(CN1CCCC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000452090638	305382270	/nfs/dbraw/zinc/38/22/70/305382270.db2.gz	UXEVPBVIHBINPB-UHFFFAOYSA-N	-1	3	333.435	1.809	20	5		EDBDHM
CN1CCC[C@@H](C[N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000108406202	441452190	/nfs/dbraw/zinc/45/21/90/441452190.db2.gz	OWXHQUZZHTXEBZ-JTQLQIEISA-N	-1	3	331.369	1.354	20	5		EDBDHM
Cc1noc(CCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])n1	ZINC000066935281	441590678	/nfs/dbraw/zinc/59/06/78/441590678.db2.gz	IBUPPVCCWHXMGQ-UHFFFAOYSA-N	-1	3	326.334	1.197	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@]1(O)CCc2ccccc21	ZINC000077180402	441728924	/nfs/dbraw/zinc/72/89/24/441728924.db2.gz	FOJWWWXBUNGBGK-MRXNPFEDSA-N	-1	3	348.380	1.707	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2C=C[C@H](CO)C2)c1C	ZINC000124565529	441936203	/nfs/dbraw/zinc/93/62/03/441936203.db2.gz	WZHUGULVUWGJDS-NWDGAFQWSA-N	-1	3	326.374	1.427	20	5		EDBDHM
C[C@H](CCO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000120356427	442055527	/nfs/dbraw/zinc/05/55/27/442055527.db2.gz	JMJRMQSQVYMIEZ-SSDOTTSWSA-N	-1	3	342.295	1.663	20	5		EDBDHM
Cn1cnnc1-c1cccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)c1	ZINC000121160239	442185763	/nfs/dbraw/zinc/18/57/63/442185763.db2.gz	KDCZOTOVVOWDEH-UHFFFAOYSA-N	-1	3	340.299	1.743	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1cncc(C)c1	ZINC000120911515	442151013	/nfs/dbraw/zinc/15/10/13/442151013.db2.gz	NRTPLHRVQWSJTF-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
O=C(NCc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)C(=O)[N-]C2=O	ZINC000171471843	442351057	/nfs/dbraw/zinc/35/10/57/442351057.db2.gz	UPFOPNVIIJWIMF-UHFFFAOYSA-N	-1	3	325.280	1.408	20	5		EDBDHM
COCc1nsc([N-]C(=O)c2cc(F)cc([N+](=O)[O-])c2N)n1	ZINC000135182820	442566296	/nfs/dbraw/zinc/56/62/96/442566296.db2.gz	RGRYMOAXQPLIKQ-UHFFFAOYSA-N	-1	3	327.297	1.566	20	5		EDBDHM
O=C(c1ccc(O)cc1[O-])N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000192522534	442657077	/nfs/dbraw/zinc/65/70/77/442657077.db2.gz	COJDIPAAVKMBSR-UHFFFAOYSA-N	-1	3	343.339	1.968	20	5		EDBDHM
CN(C)[C@@H](CNC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)c1ccccc1	ZINC000188056021	442705947	/nfs/dbraw/zinc/70/59/47/442705947.db2.gz	QMBFUQHUOHBJFR-AWEZNQCLSA-N	-1	3	330.344	1.728	20	5		EDBDHM
CN(C)CCN(Cc1ccccn1)C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000181990048	442725969	/nfs/dbraw/zinc/72/59/69/442725969.db2.gz	LBRMKUPPMITBLO-UHFFFAOYSA-N	-1	3	344.371	1.899	20	5		EDBDHM
CCN(C)C(=O)[C@H](C)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000188461909	442753103	/nfs/dbraw/zinc/75/31/03/442753103.db2.gz	HISRCJKKGUHALB-NSHDSACASA-N	-1	3	343.405	1.357	20	5		EDBDHM
CCOC(=O)c1ccc(NC(=O)CCn2cc([N+](=O)[O-])cn2)c([O-])c1	ZINC000265451897	442777673	/nfs/dbraw/zinc/77/76/73/442777673.db2.gz	DCIPPWJPONTYBF-UHFFFAOYSA-N	-1	3	348.315	1.702	20	5		EDBDHM
Cc1noc(CC[N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])n1	ZINC000189920297	443028997	/nfs/dbraw/zinc/02/89/97/443028997.db2.gz	RGHSSDHYIPNMJT-UHFFFAOYSA-N	-1	3	340.361	1.424	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)c2cnn(C)c2)cc1C	ZINC000266259023	443077120	/nfs/dbraw/zinc/07/71/20/443077120.db2.gz	ZBEIBBFSLSZPSU-LLVKDONJSA-N	-1	3	338.389	1.985	20	5		EDBDHM
COC(=O)CCc1csc([N-]C(=O)c2n[nH]c(C)c2[N+](=O)[O-])n1	ZINC000268969129	443161755	/nfs/dbraw/zinc/16/17/55/443161755.db2.gz	CIVQUVYIIJRDDN-UHFFFAOYSA-N	-1	3	339.333	1.441	20	5		EDBDHM
COCCC1(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)CC1	ZINC000269148281	443213348	/nfs/dbraw/zinc/21/33/48/443213348.db2.gz	QSELYKRSBVOJQY-UHFFFAOYSA-N	-1	3	344.389	1.698	20	5		EDBDHM
Cc1nncn1CC[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000414456109	319327456	/nfs/dbraw/zinc/32/74/56/319327456.db2.gz	GWWCAESYXLOGFD-UHFFFAOYSA-N	-1	3	339.377	1.090	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1C[C@@H](C)O[C@H]1C	ZINC000416597295	319449438	/nfs/dbraw/zinc/44/94/38/319449438.db2.gz	GDPAYMFQTXZUMN-VWYCJHECSA-N	-1	3	344.389	1.695	20	5		EDBDHM
CC[C@H](NC(=O)c1cn(C)c(=O)[n-]c1=O)c1cccc([N+](=O)[O-])c1	ZINC000267317922	443416711	/nfs/dbraw/zinc/41/67/11/443416711.db2.gz	VIALPYRGWMCESE-LBPRGKRZSA-N	-1	3	332.316	1.275	20	5		EDBDHM
CCC[C@@](C)(O)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000269762322	443429484	/nfs/dbraw/zinc/42/94/84/443429484.db2.gz	KCCNKMIMOQUGCA-CYBMUJFWSA-N	-1	3	332.378	1.433	20	5		EDBDHM
C[C@H](CS(C)(=O)=O)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000272233060	443563572	/nfs/dbraw/zinc/56/35/72/443563572.db2.gz	PPHFQHKIPVWVRO-MRVPVSSYSA-N	-1	3	336.316	1.236	20	5		EDBDHM
Cc1c(NC(=O)CNC(=O)c2cccc([O-])c2)cccc1[N+](=O)[O-]	ZINC000426587923	319886126	/nfs/dbraw/zinc/88/61/26/319886126.db2.gz	MPTKRRVMBXXGRL-UHFFFAOYSA-N	-1	3	329.312	1.977	20	5		EDBDHM
CC(C)(C)OC(=O)C[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000443766316	320112916	/nfs/dbraw/zinc/11/29/16/320112916.db2.gz	WKDFAEPFLCVLOM-UHFFFAOYSA-N	-1	3	330.362	1.356	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H](C)c2ncn(C)n2)cc1[N+](=O)[O-]	ZINC000444223924	320121155	/nfs/dbraw/zinc/12/11/55/320121155.db2.gz	NYNLYYGLKRIMOQ-ZCFIWIBFSA-N	-1	3	331.379	1.133	20	5		EDBDHM
COCC1(CC[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])CC1	ZINC000520401769	320477817	/nfs/dbraw/zinc/47/78/17/320477817.db2.gz	ZGHMUWHSTIOJRA-UHFFFAOYSA-N	-1	3	328.390	1.998	20	5		EDBDHM
CCCCOCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000299333043	444020445	/nfs/dbraw/zinc/02/04/45/444020445.db2.gz	LYELACCSQMTJDS-UHFFFAOYSA-N	-1	3	332.378	1.698	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@H](OC)C2CC2)cc1[N+](=O)[O-]	ZINC000293749679	444087690	/nfs/dbraw/zinc/08/76/90/444087690.db2.gz	IQEOKTXKLDVERP-LBPRGKRZSA-N	-1	3	348.352	1.446	20	5		EDBDHM
CC(C)Oc1nc(N2CCc3c(nc[n-]c3=O)C2)ccc1[N+](=O)[O-]	ZINC000572057766	321412843	/nfs/dbraw/zinc/41/28/43/321412843.db2.gz	ACPNBZNHXGOUKZ-UHFFFAOYSA-N	-1	3	331.332	1.835	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCOC1(C)C	ZINC000295204945	444170844	/nfs/dbraw/zinc/17/08/44/444170844.db2.gz	FQUVLZRMJZQCJG-LBPRGKRZSA-N	-1	3	330.362	1.449	20	5		EDBDHM
O=c1nc([C@H]2CCCN(CCOc3cccc([N+](=O)[O-])c3)C2)[nH][n-]1	ZINC000289437454	444143975	/nfs/dbraw/zinc/14/39/75/444143975.db2.gz	OENBSQIKAWYWEE-NSHDSACASA-N	-1	3	333.348	1.265	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@]2(C)CCOC2=O)cc1[N+](=O)[O-]	ZINC000289578261	444175374	/nfs/dbraw/zinc/17/53/74/444175374.db2.gz	OVYKCEZJCSLGQU-LBPRGKRZSA-N	-1	3	348.764	1.541	20	5		EDBDHM
COCC(C)(C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC	ZINC000322452522	444340041	/nfs/dbraw/zinc/34/00/41/444340041.db2.gz	DTBMUEPAZHGDQQ-UHFFFAOYSA-N	-1	3	346.361	1.085	20	5		EDBDHM
CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCN2C(=O)[N-]C(=O)[C@@H]2C1	ZINC000342542251	444737429	/nfs/dbraw/zinc/73/74/29/444737429.db2.gz	SMEALJKQBBUMEJ-ZDUSSCGKSA-N	-1	3	348.359	1.118	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])ncn1	ZINC000616425922	450417995	/nfs/dbraw/zinc/41/79/95/450417995.db2.gz	KLWBRASIRVHHMI-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@@H]2CCO[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000330653955	445081358	/nfs/dbraw/zinc/08/13/58/445081358.db2.gz	ZMCHBQSOESCHAU-NWDGAFQWSA-N	-1	3	328.390	1.997	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCc2ccncc2)c(F)c1	ZINC000355788535	445478908	/nfs/dbraw/zinc/47/89/08/445478908.db2.gz	CAEWJXULSGJSAV-UHFFFAOYSA-N	-1	3	325.321	1.650	20	5		EDBDHM
COCc1nc(S[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)n[n-]1	ZINC000353831086	445774809	/nfs/dbraw/zinc/77/48/09/445774809.db2.gz	XJLXWZBMPMKUBQ-NSHDSACASA-N	-1	3	349.372	1.757	20	5		EDBDHM
Cc1cc(C)c([N+](=O)[O-])c([N-]c2cnn(CCN3CCOCC3)c2)n1	ZINC000359079571	445930066	/nfs/dbraw/zinc/93/00/66/445930066.db2.gz	CEHJBRJZFZZXMK-UHFFFAOYSA-N	-1	3	346.391	1.879	20	5		EDBDHM
CN1CCC[C@@H](N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3[O-])CC2)C1	ZINC000370365226	446247606	/nfs/dbraw/zinc/24/76/06/446247606.db2.gz	DTWNKEFWCBLXOC-CQSZACIVSA-N	-1	3	348.403	1.152	20	5		EDBDHM
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CNCCC1(F)F	ZINC000420442857	446618963	/nfs/dbraw/zinc/61/89/63/446618963.db2.gz	KUBZLKTZAHKHAV-LBPRGKRZSA-N	-1	3	349.359	1.433	20	5		EDBDHM
CC[C@H](C)[C@H](O)C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000443275829	447022716	/nfs/dbraw/zinc/02/27/16/447022716.db2.gz	YFJFCMCJFMSIHT-GZMMTYOYSA-N	-1	3	336.797	1.934	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1C[C@H]2OCCC[C@@H]12	ZINC000368920302	447202713	/nfs/dbraw/zinc/20/27/13/447202713.db2.gz	SQRZGEQEWFIAAP-DMDPSCGWSA-N	-1	3	342.373	1.449	20	5		EDBDHM
NC(=O)[N-]C(=O)OCCCN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000495627740	447530502	/nfs/dbraw/zinc/53/05/02/447530502.db2.gz	YCWKOOIYIPKLGV-UHFFFAOYSA-N	-1	3	336.348	1.754	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])nc1=N	ZINC000408516025	447669907	/nfs/dbraw/zinc/66/99/07/447669907.db2.gz	DNLODSXPJCSYPW-XEHSLEBBSA-N	-1	3	342.359	1.513	20	5		EDBDHM
CC[C@@H](C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(=O)OC	ZINC000592078104	448665418	/nfs/dbraw/zinc/66/54/18/448665418.db2.gz	SDOFPRNJRQDZIO-VIFPVBQESA-N	-1	3	346.361	1.081	20	5		EDBDHM
C[C@H](COCC1CC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000593654185	449132144	/nfs/dbraw/zinc/13/21/44/449132144.db2.gz	SINVSLPMDOBUOG-SECBINFHSA-N	-1	3	332.353	1.827	20	5		EDBDHM
CC(C)(CO)[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C1CC1	ZINC000593596493	449096758	/nfs/dbraw/zinc/09/67/58/449096758.db2.gz	CJZNWXGEUSKGQJ-GFCCVEGCSA-N	-1	3	329.378	1.065	20	5		EDBDHM
CC(C)[C@H]1C[C@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCO1	ZINC000593602493	449102018	/nfs/dbraw/zinc/10/20/18/449102018.db2.gz	VALNFEREKCPDQB-DGCLKSJQSA-N	-1	3	343.405	1.719	20	5		EDBDHM
CO[C@](C)([C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C1CC1	ZINC000593609864	449106719	/nfs/dbraw/zinc/10/67/19/449106719.db2.gz	YTSQHYZOXBLMDD-TVQRCGJNSA-N	-1	3	329.378	1.472	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1CCCC[C@H]1OC	ZINC000593640046	449124688	/nfs/dbraw/zinc/12/46/88/449124688.db2.gz	GWUVEQFCXGHKJY-ZYHUDNBSSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CCOc1cc(C(=O)[N-]c2nnc3nc[nH]n23)c([N+](=O)[O-])cc1OC	ZINC000590379003	449139417	/nfs/dbraw/zinc/13/94/17/449139417.db2.gz	IPQYOWIUKLQLHT-UHFFFAOYSA-N	-1	3	347.291	1.020	20	5		EDBDHM
CC(C)C(C)(C)NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000593791119	449198361	/nfs/dbraw/zinc/19/83/61/449198361.db2.gz	MGJOQCRNZXELQP-UHFFFAOYSA-N	-1	3	343.405	1.424	20	5		EDBDHM
CO[C@]1(C)C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1(C)C	ZINC000593554712	449345442	/nfs/dbraw/zinc/34/54/42/449345442.db2.gz	AVLXKVRXBMCAHZ-ZWNOBZJWSA-N	-1	3	329.378	1.472	20	5		EDBDHM
O=C(CC1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1)N1CCCC1	ZINC000596078369	449351682	/nfs/dbraw/zinc/35/16/82/449351682.db2.gz	UGWACLZGVRUYDS-UHFFFAOYSA-N	-1	3	334.376	1.924	20	5		EDBDHM
O=c1[n-]ccc(NCCN2CCN(c3ccccc3)CC2)c1[N+](=O)[O-]	ZINC000596079037	449352092	/nfs/dbraw/zinc/35/20/92/449352092.db2.gz	ZSQPCQNWPPWJMM-UHFFFAOYSA-N	-1	3	343.387	1.930	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2nc(C3CC3)cs2)nc1	ZINC000593564802	449353679	/nfs/dbraw/zinc/35/36/79/449353679.db2.gz	CKBLMNOPDOCCNV-UHFFFAOYSA-N	-1	3	340.386	1.802	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCN2Cc3ccccc3C2)nc1	ZINC000593539131	449333275	/nfs/dbraw/zinc/33/32/75/449333275.db2.gz	YBQYKQVLDOAXQN-UHFFFAOYSA-N	-1	3	348.384	1.284	20	5		EDBDHM
C[C@@H]1CCC[C@@H](C)N1CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593542041	449336414	/nfs/dbraw/zinc/33/64/14/449336414.db2.gz	DNDOCDUUWFHQDN-VXGBXAGGSA-N	-1	3	342.421	1.531	20	5		EDBDHM
CC[C@@H]1CCCCN1CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593545788	449338540	/nfs/dbraw/zinc/33/85/40/449338540.db2.gz	VVUAJPJMFOYPKA-GFCCVEGCSA-N	-1	3	342.421	1.533	20	5		EDBDHM
CCOC(=O)C[C@@H](Sc1cc[n-]c(=O)c1[N+](=O)[O-])C(=O)OCC	ZINC000596216974	449421949	/nfs/dbraw/zinc/42/19/49/449421949.db2.gz	ITDBOJOAZBCLGP-SECBINFHSA-N	-1	3	344.345	1.672	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H]1CCCN2CCCC[C@@H]12	ZINC000594482713	449547128	/nfs/dbraw/zinc/54/71/28/449547128.db2.gz	CTFRSEYAWDSGIN-STQMWFEESA-N	-1	3	339.417	1.890	20	5		EDBDHM
COC[C@@H](CC[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)OC	ZINC000594795494	449706122	/nfs/dbraw/zinc/70/61/22/449706122.db2.gz	NLCWPHOIEUQKJR-SECBINFHSA-N	-1	3	338.407	1.295	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN(C)C(C)C)c(F)cc1[N+](=O)[O-]	ZINC000601400015	449916105	/nfs/dbraw/zinc/91/61/05/449916105.db2.gz	WFFIRYPVHQADQS-UHFFFAOYSA-N	-1	3	333.385	1.661	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C1CC1	ZINC000609121261	449960530	/nfs/dbraw/zinc/96/05/30/449960530.db2.gz	GUDPDGGNCRMNAL-SECBINFHSA-N	-1	3	342.373	1.690	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@H]2CCCCN(C)C2)c([N+](=O)[O-])s1	ZINC000601474761	449998200	/nfs/dbraw/zinc/99/82/00/449998200.db2.gz	SRHWOTFKDWNPEC-LLVKDONJSA-N	-1	3	347.462	1.975	20	5		EDBDHM
CC[C@H](CN1CCCC1)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000610576999	450265898	/nfs/dbraw/zinc/26/58/98/450265898.db2.gz	RXOZXKUHYCEAAE-GFCCVEGCSA-N	-1	3	327.406	1.748	20	5		EDBDHM
CN(C)C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])[n-]2)c2ccccc2O1	ZINC000610764805	450327042	/nfs/dbraw/zinc/32/70/42/450327042.db2.gz	UZTUAVDHJZTTBZ-LLVKDONJSA-N	-1	3	330.344	1.892	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC)C(C)C	ZINC000619486800	450487848	/nfs/dbraw/zinc/48/78/48/450487848.db2.gz	YQDVQTIMSNHRJG-JTQLQIEISA-N	-1	3	332.378	1.553	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1CCO[C@H](C)C1	ZINC000619494675	450491331	/nfs/dbraw/zinc/49/13/31/450491331.db2.gz	BBHAWWMVIZRPJE-NXEZZACHSA-N	-1	3	330.362	1.449	20	5		EDBDHM
CC1(C)[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@H]2CCO[C@H]21	ZINC000246890408	535076851	/nfs/dbraw/zinc/07/68/51/535076851.db2.gz	LSACVFNFIKQYOF-OASPWFOLSA-N	-1	3	326.374	1.687	20	5		EDBDHM
CCN1CCC[C@@H](C[N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1	ZINC000726602241	578351176	/nfs/dbraw/zinc/35/11/76/578351176.db2.gz	CQLZFDVPMFGWDW-NSHDSACASA-N	-1	3	345.396	1.744	20	5		EDBDHM
CN(CCNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)CC(F)(F)F	ZINC000736799646	579021623	/nfs/dbraw/zinc/02/16/23/579021623.db2.gz	CBLREJSRVARMHC-UHFFFAOYSA-N	-1	3	345.285	1.681	20	5		EDBDHM
CN(CCNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)CC(F)(F)F	ZINC000736799646	579021624	/nfs/dbraw/zinc/02/16/24/579021624.db2.gz	CBLREJSRVARMHC-UHFFFAOYSA-N	-1	3	345.285	1.681	20	5		EDBDHM
Cc1nn(C)cc1[C@H](C)Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000737513388	579102916	/nfs/dbraw/zinc/10/29/16/579102916.db2.gz	LJFYVKRXTYVBFQ-QMMMGPOBSA-N	-1	3	328.336	1.990	20	5		EDBDHM
Cc1nn(C)cc1[C@H](C)Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000737513388	579102919	/nfs/dbraw/zinc/10/29/19/579102919.db2.gz	LJFYVKRXTYVBFQ-QMMMGPOBSA-N	-1	3	328.336	1.990	20	5		EDBDHM
NC(=O)[C@@H]1CCC[C@H](Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000737742929	579127492	/nfs/dbraw/zinc/12/74/92/579127492.db2.gz	HSGOKVYQBSMYHZ-SCZZXKLOSA-N	-1	3	331.336	1.231	20	5		EDBDHM
NC(=O)[C@@H]1CCC[C@H](Nc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1	ZINC000737742929	579127493	/nfs/dbraw/zinc/12/74/93/579127493.db2.gz	HSGOKVYQBSMYHZ-SCZZXKLOSA-N	-1	3	331.336	1.231	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1	ZINC000738382818	579188786	/nfs/dbraw/zinc/18/87/86/579188786.db2.gz	KLZPLGOCANMLCB-UHFFFAOYSA-N	-1	3	328.325	1.498	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1	ZINC000738382818	579188787	/nfs/dbraw/zinc/18/87/87/579188787.db2.gz	KLZPLGOCANMLCB-UHFFFAOYSA-N	-1	3	328.325	1.498	20	5		EDBDHM
COC(=O)[C@@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C(C)(C)C	ZINC000768836861	580221826	/nfs/dbraw/zinc/22/18/26/580221826.db2.gz	ZRLYHFFGMCUZKW-SECBINFHSA-N	-1	3	336.391	1.522	20	5		EDBDHM
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000780516236	580525482	/nfs/dbraw/zinc/52/54/82/580525482.db2.gz	KYOHOTVUSNTWQK-INIZCTEOSA-N	-1	3	349.387	1.674	20	5		EDBDHM
COCCSc1ccc([N+](=O)[O-])cc1C(=O)[N-]N1CCCC1=O	ZINC000780700468	580531645	/nfs/dbraw/zinc/53/16/45/580531645.db2.gz	JLEOJNUFMUDGNO-UHFFFAOYSA-N	-1	3	339.373	1.601	20	5		EDBDHM
C[C@H]1CCCN1CC[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000780864806	580535521	/nfs/dbraw/zinc/53/55/21/580535521.db2.gz	AWNCSBIWWQASPR-JTQLQIEISA-N	-1	3	331.369	1.497	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@@H]2CCC=CO2)cc1[N+](=O)[O-]	ZINC000780900767	580537038	/nfs/dbraw/zinc/53/70/38/580537038.db2.gz	KATVCZZAVAEODB-VIFPVBQESA-N	-1	3	346.336	1.714	20	5		EDBDHM
O=C(CNC(=O)c1cccc([O-])c1)OCCc1ccc([N+](=O)[O-])cc1	ZINC000785692521	580650252	/nfs/dbraw/zinc/65/02/52/580650252.db2.gz	MGMWEQUHIUHDPY-UHFFFAOYSA-N	-1	3	344.323	1.816	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H](O)c2ccco2)c1[N+](=O)[O-]	ZINC000790853619	580780085	/nfs/dbraw/zinc/78/00/85/580780085.db2.gz	VHXWFTSWBJENEH-LLVKDONJSA-N	-1	3	340.357	1.817	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1cccn1C	ZINC000795126009	580913817	/nfs/dbraw/zinc/91/38/17/580913817.db2.gz	XEVKRIKNPRZJTF-UHFFFAOYSA-N	-1	3	325.346	1.420	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H]2[C@@H]3COC[C@@H]32)c1	ZINC000795302390	580918346	/nfs/dbraw/zinc/91/83/46/580918346.db2.gz	UAQFWMFJFRCXQY-JDICNCQASA-N	-1	3	332.765	1.480	20	5		EDBDHM
O=C([O-])C1(CCN2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CCC1	ZINC000903696115	592277066	/nfs/dbraw/zinc/27/70/66/592277066.db2.gz	BFBCJSGLCDSDRF-UHFFFAOYSA-N	-1	3	334.376	1.757	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1COC[C@H]1C1CC1	ZINC000908409959	592484933	/nfs/dbraw/zinc/48/49/33/592484933.db2.gz	LXVXRSBGWURJTN-NWDGAFQWSA-N	-1	3	326.374	1.607	20	5		EDBDHM
CN1CCN(CCCCNc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1	ZINC000910346740	592839207	/nfs/dbraw/zinc/83/92/07/592839207.db2.gz	RRBYHRGPIHWGEM-UHFFFAOYSA-N	-1	3	336.392	1.733	20	5		EDBDHM
CC(=O)c1cc([N+](=O)[O-])ccc1OS(=O)(=O)c1cn[n-]c1C	ZINC000758404917	593403252	/nfs/dbraw/zinc/40/32/52/593403252.db2.gz	NNAUYPCKBVZWBH-UHFFFAOYSA-N	-1	3	325.302	1.597	20	5		EDBDHM
CC(C)OC(=O)[C@@H](C)CNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000820137303	593794479	/nfs/dbraw/zinc/79/44/79/593794479.db2.gz	ITITWSWXOVLLSW-VIFPVBQESA-N	-1	3	334.336	1.775	20	5		EDBDHM
CC(C)OC(=O)[C@@H](C)CNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000820137303	593794480	/nfs/dbraw/zinc/79/44/80/593794480.db2.gz	ITITWSWXOVLLSW-VIFPVBQESA-N	-1	3	334.336	1.775	20	5		EDBDHM
C[C@@H](CO)[C@@H](C)Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820280200	593805558	/nfs/dbraw/zinc/80/55/58/593805558.db2.gz	ATHDQIYDWOCPRA-DTWKUNHWSA-N	-1	3	343.347	1.752	20	5		EDBDHM
C[C@@H](CO)[C@@H](C)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820280200	593805559	/nfs/dbraw/zinc/80/55/59/593805559.db2.gz	ATHDQIYDWOCPRA-DTWKUNHWSA-N	-1	3	343.347	1.752	20	5		EDBDHM
C[C@@H](CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)c1ccncc1	ZINC000820280708	593805815	/nfs/dbraw/zinc/80/58/15/593805815.db2.gz	NADDOLHYENIDJH-VIFPVBQESA-N	-1	3	326.320	1.781	20	5		EDBDHM
C[C@@H](CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)c1ccncc1	ZINC000820280708	593805816	/nfs/dbraw/zinc/80/58/16/593805816.db2.gz	NADDOLHYENIDJH-VIFPVBQESA-N	-1	3	326.320	1.781	20	5		EDBDHM
O=C([O-])C[C@H]1CCCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000821517135	593852082	/nfs/dbraw/zinc/85/20/82/593852082.db2.gz	XNUDJPGFHNRWHG-CHWSQXEVSA-N	-1	3	338.360	1.521	20	5		EDBDHM
COC(=O)C[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000821659178	593900941	/nfs/dbraw/zinc/90/09/41/593900941.db2.gz	UUOPCRUBVVDSEH-VIFPVBQESA-N	-1	3	332.320	1.307	20	5		EDBDHM
COC(=O)C[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000821659178	593900944	/nfs/dbraw/zinc/90/09/44/593900944.db2.gz	UUOPCRUBVVDSEH-VIFPVBQESA-N	-1	3	332.320	1.307	20	5		EDBDHM
COCCCOC1CN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000821687985	593914358	/nfs/dbraw/zinc/91/43/58/593914358.db2.gz	YMKWYQFQQHRFDT-UHFFFAOYSA-N	-1	3	334.336	1.017	20	5		EDBDHM
COCCCOC1CN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1	ZINC000821687985	593914360	/nfs/dbraw/zinc/91/43/60/593914360.db2.gz	YMKWYQFQQHRFDT-UHFFFAOYSA-N	-1	3	334.336	1.017	20	5		EDBDHM
COc1ccc(CCNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cc1	ZINC000821790056	593940329	/nfs/dbraw/zinc/94/03/29/593940329.db2.gz	GQBGERQJJOQRPA-UHFFFAOYSA-N	-1	3	341.331	1.833	20	5		EDBDHM
COc1ccc(CCNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)cc1	ZINC000821790056	593940333	/nfs/dbraw/zinc/94/03/33/593940333.db2.gz	GQBGERQJJOQRPA-UHFFFAOYSA-N	-1	3	341.331	1.833	20	5		EDBDHM
Cc1cc(C[C@@H](C)Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)n[nH]1	ZINC000822199876	594008597	/nfs/dbraw/zinc/00/85/97/594008597.db2.gz	LBYPXFFKRAPWAR-SSDOTTSWSA-N	-1	3	329.324	1.245	20	5		EDBDHM
Cc1cc(C[C@@H](C)Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)[nH]n1	ZINC000822199876	594008599	/nfs/dbraw/zinc/00/85/99/594008599.db2.gz	LBYPXFFKRAPWAR-SSDOTTSWSA-N	-1	3	329.324	1.245	20	5		EDBDHM
Cc1cc(C[C@@H](C)Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)n[nH]1	ZINC000822199876	594008602	/nfs/dbraw/zinc/00/86/02/594008602.db2.gz	LBYPXFFKRAPWAR-SSDOTTSWSA-N	-1	3	329.324	1.245	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)Oc1ccc(-c2nnn[n-]2)cc1F	ZINC000822685363	594085558	/nfs/dbraw/zinc/08/55/58/594085558.db2.gz	XZOQAAKAYGWSEG-UHFFFAOYSA-N	-1	3	332.251	1.472	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)Oc1ccc(-c2nn[n-]n2)cc1F	ZINC000822685363	594085559	/nfs/dbraw/zinc/08/55/59/594085559.db2.gz	XZOQAAKAYGWSEG-UHFFFAOYSA-N	-1	3	332.251	1.472	20	5		EDBDHM
CC[C@H](Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@@H](O)C(F)(F)F	ZINC000825146311	594136279	/nfs/dbraw/zinc/13/62/79/594136279.db2.gz	CCKHTWVJRWWZJV-OIBJUYFYSA-N	-1	3	346.269	1.889	20	5		EDBDHM
CC[C@H](Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])[C@@H](O)C(F)(F)F	ZINC000825146311	594136280	/nfs/dbraw/zinc/13/62/80/594136280.db2.gz	CCKHTWVJRWWZJV-OIBJUYFYSA-N	-1	3	346.269	1.889	20	5		EDBDHM
CCc1nn(C)c(N(C)Cc2ccc(-c3nnn[n-]3)cc2)c1[N+](=O)[O-]	ZINC000825759950	594239730	/nfs/dbraw/zinc/23/97/30/594239730.db2.gz	QBGSUCZELAOJQL-UHFFFAOYSA-N	-1	3	342.363	1.707	20	5		EDBDHM
CCc1nn(C)c(N(C)Cc2ccc(-c3nn[n-]n3)cc2)c1[N+](=O)[O-]	ZINC000825759950	594239732	/nfs/dbraw/zinc/23/97/32/594239732.db2.gz	QBGSUCZELAOJQL-UHFFFAOYSA-N	-1	3	342.363	1.707	20	5		EDBDHM
CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1c[nH]c(-c2nnn[n-]2)c1	ZINC000825986135	594298051	/nfs/dbraw/zinc/29/80/51/594298051.db2.gz	PZXQMVDSJZNKIT-UHFFFAOYSA-N	-1	3	327.304	1.375	20	5		EDBDHM
CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1c[nH]c(-c2nn[n-]n2)c1	ZINC000825986135	594298053	/nfs/dbraw/zinc/29/80/53/594298053.db2.gz	PZXQMVDSJZNKIT-UHFFFAOYSA-N	-1	3	327.304	1.375	20	5		EDBDHM
COc1ccc(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cc1[N+](=O)[O-]	ZINC000826209501	594379868	/nfs/dbraw/zinc/37/98/68/594379868.db2.gz	FIXSXIQZDXZJED-UHFFFAOYSA-N	-1	3	329.276	1.364	20	5		EDBDHM
COc1ccc(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cc1[N+](=O)[O-]	ZINC000826209501	594379871	/nfs/dbraw/zinc/37/98/71/594379871.db2.gz	FIXSXIQZDXZJED-UHFFFAOYSA-N	-1	3	329.276	1.364	20	5		EDBDHM
Cc1cn2c(n1)CN(c1ccc(-c3nnn[n-]3)cc1[N+](=O)[O-])CC2	ZINC000826317265	594421966	/nfs/dbraw/zinc/42/19/66/594421966.db2.gz	VHTOEELOISIMHQ-UHFFFAOYSA-N	-1	3	326.320	1.300	20	5		EDBDHM
Cc1cn2c(n1)CN(c1ccc(-c3nn[n-]n3)cc1[N+](=O)[O-])CC2	ZINC000826317265	594421967	/nfs/dbraw/zinc/42/19/67/594421967.db2.gz	VHTOEELOISIMHQ-UHFFFAOYSA-N	-1	3	326.320	1.300	20	5		EDBDHM
O=C1C[C@@H](CNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CN1C1CC1	ZINC000826478844	594493437	/nfs/dbraw/zinc/49/34/37/594493437.db2.gz	KJYUMMSAMGFOKG-VIFPVBQESA-N	-1	3	343.347	1.198	20	5		EDBDHM
O=C1C[C@@H](CNc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CN1C1CC1	ZINC000826478844	594493439	/nfs/dbraw/zinc/49/34/39/594493439.db2.gz	KJYUMMSAMGFOKG-VIFPVBQESA-N	-1	3	343.347	1.198	20	5		EDBDHM
C[C@@H]1CN(CCC(=O)[O-])CCN1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000833628290	594891473	/nfs/dbraw/zinc/89/14/73/594891473.db2.gz	FOKAHUCXYNULEB-DOMZBBRYSA-N	-1	3	337.376	1.109	20	5		EDBDHM
CC1(C)COC(=O)[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000841536083	594917806	/nfs/dbraw/zinc/91/78/06/594917806.db2.gz	YJXSQXGIKBFZFC-JTQLQIEISA-N	-1	3	348.764	1.478	20	5		EDBDHM
CC1(C)COC(=O)[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000841536084	594917834	/nfs/dbraw/zinc/91/78/34/594917834.db2.gz	YJXSQXGIKBFZFC-SNVBAGLBSA-N	-1	3	348.764	1.478	20	5		EDBDHM
O=C([O-])N1CC[C@@H](N(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)C1	ZINC000834084371	595009915	/nfs/dbraw/zinc/00/99/15/595009915.db2.gz	SICATSJFPMUQCN-HUUCEWRRSA-N	-1	3	335.360	1.845	20	5		EDBDHM
Nc1ccc([N+](=O)[O-])cc1C(=O)OCc1cc(=O)[n-]c(C2CC2)n1	ZINC000837401230	595101482	/nfs/dbraw/zinc/10/14/82/595101482.db2.gz	VFUIKBJYEKMDLF-UHFFFAOYSA-N	-1	3	330.300	1.907	20	5		EDBDHM
COC[C@]1(C(=O)[O-])CCCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000846287386	595199085	/nfs/dbraw/zinc/19/90/85/595199085.db2.gz	XRTAGHNSQMALFK-HOCLYGCPSA-N	-1	3	338.360	1.441	20	5		EDBDHM
CN1CCC[C@@H]([N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1=O	ZINC000848586659	595410400	/nfs/dbraw/zinc/41/04/00/595410400.db2.gz	AQKROXGIIOTJHH-LLVKDONJSA-N	-1	3	343.286	1.303	20	5		EDBDHM
CC(C)(CO)O[N-]C(=O)c1c(Br)cccc1[N+](=O)[O-]	ZINC000861880737	596134460	/nfs/dbraw/zinc/13/44/60/596134460.db2.gz	QGQVOSDFIVDRLW-UHFFFAOYSA-N	-1	3	333.138	1.790	20	5		EDBDHM
COC(OC)[C@H](C)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000866106243	596790409	/nfs/dbraw/zinc/79/04/09/596790409.db2.gz	YXKRRVHSSPFRST-QMMMGPOBSA-N	-1	3	334.275	1.690	20	5		EDBDHM
Cc1cc(C)[n-]c(=NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2C)n1	ZINC000032585299	695984185	/nfs/dbraw/zinc/98/41/85/695984185.db2.gz	OEHBHCIXPFWXBG-UHFFFAOYSA-N	-1	3	337.361	1.615	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](CO)c1ccccc1	ZINC000102888379	219238694	/nfs/dbraw/zinc/23/86/94/219238694.db2.gz	NKNIXSQQBCIFJB-ZDUSSCGKSA-N	-1	3	336.369	1.915	20	5		EDBDHM
COc1cc(C(=O)NCCc2c(C)[n-][nH]c2=O)cc([N+](=O)[O-])c1C	ZINC000562310526	306294616	/nfs/dbraw/zinc/29/46/16/306294616.db2.gz	HVINVBLQWWTZCO-NSHDSACASA-N	-1	3	334.332	1.154	20	5		EDBDHM
O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1cc(=O)[n-]c(C2CC2)n1	ZINC000412976508	304047617	/nfs/dbraw/zinc/04/76/17/304047617.db2.gz	IOKDZMCTJNGWTJ-UHFFFAOYSA-N	-1	3	340.295	1.764	20	5		EDBDHM
O=C(Cc1cccc([N+](=O)[O-])c1)NCCNC(=O)c1ccc([O-])cc1	ZINC000175484856	237310327	/nfs/dbraw/zinc/31/03/27/237310327.db2.gz	SQRJEDLIMMJKSN-UHFFFAOYSA-N	-1	3	343.339	1.389	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]Cc2ccn(C)c2)cc1[N+](=O)[O-]	ZINC000491602384	255132071	/nfs/dbraw/zinc/13/20/71/255132071.db2.gz	UDGDUDNPWJQVGX-UHFFFAOYSA-N	-1	3	343.336	1.560	20	5		EDBDHM
O=C(C=Cc1ccc([N+](=O)[O-])cc1)N1CCc2nc[n-]c(=O)c2C1	ZINC000493643127	255217977	/nfs/dbraw/zinc/21/79/77/255217977.db2.gz	LXDHIZCSUIHZSL-UTCJRWHESA-N	-1	3	326.312	1.689	20	5		EDBDHM
CCn1cc([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)ccc1=O	ZINC000119049052	221232023	/nfs/dbraw/zinc/23/20/23/221232023.db2.gz	NZWWLOJWQXKZLN-UHFFFAOYSA-N	-1	3	343.386	1.947	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-][C@@H]1CC=CCC1)OCCO2	ZINC000265465620	296502147	/nfs/dbraw/zinc/50/21/47/296502147.db2.gz	IDYGASZZRJGHSF-SNVBAGLBSA-N	-1	3	340.357	1.753	20	5		EDBDHM
CC1(C)CCCN(CC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000331285659	141003683	/nfs/dbraw/zinc/00/36/83/141003683.db2.gz	NAPRDUUVMRZABM-UHFFFAOYSA-N	-1	3	341.433	1.995	20	5		EDBDHM
COc1ccc(C(=O)N2CCc3c(nc[n-]c3=O)C2)cc1[N+](=O)[O-]	ZINC000345238613	143068460	/nfs/dbraw/zinc/06/84/60/143068460.db2.gz	ZTQZQKNNCSKSQX-UHFFFAOYSA-N	-1	3	330.300	1.298	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H](C)c2csnn2)cc1[N+](=O)[O-]	ZINC000416637798	304339706	/nfs/dbraw/zinc/33/97/06/304339706.db2.gz	VBVGIXUFKBQZAB-YFKPBYRVSA-N	-1	3	334.404	1.856	20	5		EDBDHM
CCn1ncnc1C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000360368947	152009123	/nfs/dbraw/zinc/00/91/23/152009123.db2.gz	GLNNCECIAOQIRJ-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
Cc1cc(=O)[n-]c([C@H](C)N2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)n1	ZINC000364273647	153193219	/nfs/dbraw/zinc/19/32/19/153193219.db2.gz	QEJBXHYTSGFDNK-RYUDHWBXSA-N	-1	3	332.364	1.993	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CSC[C@H]1C	ZINC000352345981	162131981	/nfs/dbraw/zinc/13/19/81/162131981.db2.gz	PAFNHMVBTPEWNR-SCZZXKLOSA-N	-1	3	332.403	1.633	20	5		EDBDHM
Cc1nc(C)c(CCC(=O)NCc2cccc([N+](=O)[O-])c2)c(=O)[n-]1	ZINC000067072386	287244470	/nfs/dbraw/zinc/24/44/70/287244470.db2.gz	KKQOLMXRDBGCOT-UHFFFAOYSA-N	-1	3	330.344	1.544	20	5		EDBDHM
Cc1nnc([C@@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000273575369	273045968	/nfs/dbraw/zinc/04/59/68/273045968.db2.gz	HCQHXAAAHGEGPX-SSDOTTSWSA-N	-1	3	328.375	1.794	20	5		EDBDHM
COc1ccc(-n2c([O-])c(CC(F)(F)F)[nH]c2=O)cc1[N+](=O)[O-]	ZINC000278074279	273247119	/nfs/dbraw/zinc/24/71/19/273247119.db2.gz	JQFZRDPFEXKCPH-SSDOTTSWSA-N	-1	3	333.222	1.981	20	5		EDBDHM
C[C@H](CN1CCCCC1)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000193096204	279303341	/nfs/dbraw/zinc/30/33/41/279303341.db2.gz	XKVRMXFQRUFVKY-GFCCVEGCSA-N	-1	3	327.406	1.748	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(N2CCN(C(=O)c3cccc([O-])c3)CC2)n1	ZINC000124010297	281011734	/nfs/dbraw/zinc/01/17/34/281011734.db2.gz	OVSCVLXQLQXEDW-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
CCNC(=O)[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(C)C	ZINC000292523686	289371457	/nfs/dbraw/zinc/37/14/57/289371457.db2.gz	HUXZIOLPHYXUOC-LBPRGKRZSA-N	-1	3	329.378	1.034	20	5		EDBDHM
O=c1[n-]nc([C@H]2CCCN(C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)o1	ZINC000295385498	303212110	/nfs/dbraw/zinc/21/21/10/303212110.db2.gz	QKCNJSYUBUEOAV-AAEUAGOBSA-N	-1	3	334.332	1.184	20	5		EDBDHM
Cc1cc(NCCCc2nc(=O)[n-][nH]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000302063089	303710999	/nfs/dbraw/zinc/71/09/99/303710999.db2.gz	ABWXAQVSHIWRQV-UHFFFAOYSA-N	-1	3	328.332	1.908	20	5		EDBDHM
CC[C@@H]1C[C@H]([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)CCO1	ZINC000420723118	304776250	/nfs/dbraw/zinc/77/62/50/304776250.db2.gz	JMKWMGPMBOBTBW-ZYHUDNBSSA-N	-1	3	344.389	1.839	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-][C@@H]1C[C@H]1C1CC1)OCCO2	ZINC000430041476	305043531	/nfs/dbraw/zinc/04/35/31/305043531.db2.gz	VSFSOIKQLOBHTN-VHSXEESVSA-N	-1	3	340.357	1.443	20	5		EDBDHM
Nc1c(=O)[n-]c(=O)[nH]c1C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000438130658	305181770	/nfs/dbraw/zinc/18/17/70/305181770.db2.gz	MPWXTWYFRDEFTQ-UHFFFAOYSA-N	-1	3	345.315	1.183	20	5		EDBDHM
CSCC[C@@H](CO)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000443489331	305238381	/nfs/dbraw/zinc/23/83/81/305238381.db2.gz	VJZNRXQDIKUQSP-JTQLQIEISA-N	-1	3	334.419	1.296	20	5		EDBDHM
COCC[C@@]1([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])CCOC1	ZINC000445064117	305255491	/nfs/dbraw/zinc/25/54/91/305255491.db2.gz	HXHIHIZZWHMSGX-CQSZACIVSA-N	-1	3	344.389	1.377	20	5		EDBDHM
O=C(Nc1cccc(-c2c[nH]nn2)c1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000445156852	305257300	/nfs/dbraw/zinc/25/73/00/305257300.db2.gz	HJRJRWFJDYZTQP-UHFFFAOYSA-N	-1	3	326.272	1.733	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)[C@@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000451987728	305376386	/nfs/dbraw/zinc/37/63/86/305376386.db2.gz	JVKVHRIOQILYLU-YMTOWFKASA-N	-1	3	344.389	1.695	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)[C@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000451987727	305376401	/nfs/dbraw/zinc/37/64/01/305376401.db2.gz	JVKVHRIOQILYLU-XPTSAGLGSA-N	-1	3	344.389	1.695	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F	ZINC000544562809	306076508	/nfs/dbraw/zinc/07/65/08/306076508.db2.gz	OCUCQBLLKFORGA-PELKAZGASA-N	-1	3	336.323	1.466	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]Cc2cc(C)on2)cc1[N+](=O)[O-]	ZINC000548619579	306132575	/nfs/dbraw/zinc/13/25/75/306132575.db2.gz	GUUSEGRUOCRXLY-UHFFFAOYSA-N	-1	3	345.308	1.517	20	5		EDBDHM
COc1ccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)cc1NC(C)=O	ZINC000026622142	441381853	/nfs/dbraw/zinc/38/18/53/441381853.db2.gz	FSKXTXPSEAUVKH-UHFFFAOYSA-N	-1	3	346.299	1.502	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@H]2CCCN(C)C2)c([N+](=O)[O-])c1	ZINC000108406313	441452382	/nfs/dbraw/zinc/45/23/82/441452382.db2.gz	UDFZMOCWERVCEZ-GFCCVEGCSA-N	-1	3	327.406	1.523	20	5		EDBDHM
CCOC(=O)C(C)(C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000066937931	441591539	/nfs/dbraw/zinc/59/15/39/441591539.db2.gz	ZTAUFSDWDSIXDO-UHFFFAOYSA-N	-1	3	346.361	1.223	20	5		EDBDHM
O=C(CC1CCC1)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000173529288	441780012	/nfs/dbraw/zinc/78/00/12/441780012.db2.gz	JQZMJIJKKANPCI-UHFFFAOYSA-N	-1	3	341.389	1.180	20	5		EDBDHM
CN(C)CCN(Cc1ccccn1)C(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000160292588	441871354	/nfs/dbraw/zinc/87/13/54/441871354.db2.gz	FMKVNOVXDKYHLY-UHFFFAOYSA-N	-1	3	344.371	1.899	20	5		EDBDHM
O=C(c1ccc([N+](=O)[O-])o1)N1CCN(C(=O)c2ccccc2[O-])CC1	ZINC000160543914	441894593	/nfs/dbraw/zinc/89/45/93/441894593.db2.gz	OOEPMJRHIPSGQR-UHFFFAOYSA-N	-1	3	345.311	1.492	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@H]2CCN(C)C2=O)c1	ZINC000161604843	442015223	/nfs/dbraw/zinc/01/52/23/442015223.db2.gz	MPPVGEQGCFCSFY-MRVPVSSYSA-N	-1	3	347.780	1.066	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCC[C@H]1CCO	ZINC000494621200	447448524	/nfs/dbraw/zinc/44/85/24/447448524.db2.gz	NVZPIHNLHZTTDG-JQWIXIFHSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COc1nnc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)[n-]1	ZINC000179362871	442631753	/nfs/dbraw/zinc/63/17/53/442631753.db2.gz	PQIJPZOIBZWWPJ-UHFFFAOYSA-N	-1	3	349.350	1.920	20	5		EDBDHM
COc1nc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n[n-]1	ZINC000179362871	442631758	/nfs/dbraw/zinc/63/17/58/442631758.db2.gz	PQIJPZOIBZWWPJ-UHFFFAOYSA-N	-1	3	349.350	1.920	20	5		EDBDHM
COc1n[n-]c(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n1	ZINC000179362871	442631766	/nfs/dbraw/zinc/63/17/66/442631766.db2.gz	PQIJPZOIBZWWPJ-UHFFFAOYSA-N	-1	3	349.350	1.920	20	5		EDBDHM
O=C(Nc1ccc(-n2cccn2)nc1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000187551520	442681054	/nfs/dbraw/zinc/68/10/54/442681054.db2.gz	QHRIZSBJHAOOKP-UHFFFAOYSA-N	-1	3	326.272	1.528	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C[C@H]2CC[C@@H](O)C2)cc1[N+](=O)[O-]	ZINC000188335040	442740539	/nfs/dbraw/zinc/74/05/39/442740539.db2.gz	SWTKWXRINOHGMC-VHSXEESVSA-N	-1	3	348.808	1.996	20	5		EDBDHM
C[C@@H](C[S@](C)=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000183194242	442899417	/nfs/dbraw/zinc/89/94/17/442899417.db2.gz	XUXGHRLNHRQHLS-IIYDVTGLSA-N	-1	3	340.810	1.294	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H](C)C[C@H](C)O)c1[N+](=O)[O-]	ZINC000190002276	443045976	/nfs/dbraw/zinc/04/59/76/443045976.db2.gz	IYUKXHDVQQSKLZ-CABZTGNLSA-N	-1	3	330.406	1.897	20	5		EDBDHM
CCOC(=O)[C@@H](C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000268787190	443108026	/nfs/dbraw/zinc/10/80/26/443108026.db2.gz	LPDCRUARIUMDOZ-VIFPVBQESA-N	-1	3	346.361	1.081	20	5		EDBDHM
O=C(NCCn1cc([N+](=O)[O-])cn1)c1cc2c(cc1[O-])CCCC2	ZINC000269155682	443215907	/nfs/dbraw/zinc/21/59/07/443215907.db2.gz	RQFIRNZGVLPWCM-UHFFFAOYSA-N	-1	3	330.344	1.806	20	5		EDBDHM
Cn1cc(S(=O)(=O)[N-]CCc2ccccc2[N+](=O)[O-])nc1Cl	ZINC000269262435	443256722	/nfs/dbraw/zinc/25/67/22/443256722.db2.gz	COVRIRODGYYVIG-UHFFFAOYSA-N	-1	3	344.780	1.503	20	5		EDBDHM
Cc1cc(NCC[N-]S(=O)(=O)c2cccs2)ncc1[N+](=O)[O-]	ZINC000269458911	443313809	/nfs/dbraw/zinc/31/38/09/443313809.db2.gz	GOMXXRACUISRBL-UHFFFAOYSA-N	-1	3	342.402	1.750	20	5		EDBDHM
CCCCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC	ZINC000273014533	443518541	/nfs/dbraw/zinc/51/85/41/443518541.db2.gz	BGONERIPFWOSGW-UHFFFAOYSA-N	-1	3	330.362	1.850	20	5		EDBDHM
CCc1[nH]n(C)c2nnc([N-]C(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])c1-2	ZINC000433762689	319985484	/nfs/dbraw/zinc/98/54/84/319985484.db2.gz	RQJWVLCKJFVRHW-UHFFFAOYSA-N	-1	3	346.351	1.866	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H]2CCC[C@H]2O)c1[N+](=O)[O-]	ZINC000276778184	443823060	/nfs/dbraw/zinc/82/30/60/443823060.db2.gz	HVAWXDYZSZLMJN-VXGBXAGGSA-N	-1	3	328.390	1.651	20	5		EDBDHM
CN1CCN(CCNC(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC1(C)C	ZINC000281718524	443988266	/nfs/dbraw/zinc/98/82/66/443988266.db2.gz	IGPLHGJKJNARDL-UHFFFAOYSA-N	-1	3	336.392	1.056	20	5		EDBDHM
O=C([O-])c1cnccc1N1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000568986230	321312855	/nfs/dbraw/zinc/31/28/55/321312855.db2.gz	KLVQFFFIDBEQHP-UHFFFAOYSA-N	-1	3	329.316	1.410	20	5		EDBDHM
C[C@](O)(C[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)C(F)(F)F	ZINC000340595034	444454264	/nfs/dbraw/zinc/45/42/64/444454264.db2.gz	GYZDNSLCOSOZHI-JTQLQIEISA-N	-1	3	342.295	1.328	20	5		EDBDHM
CCOC(=O)CC[C@@H](C)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000340604000	444456889	/nfs/dbraw/zinc/45/68/89/444456889.db2.gz	MCEXBOGOFPVURD-LLVKDONJSA-N	-1	3	344.389	1.913	20	5		EDBDHM
CO[C@H]1CCC[C@@H]1C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000341213770	444732860	/nfs/dbraw/zinc/73/28/60/444732860.db2.gz	JRCVMFYPUHWZQX-YPMHNXCESA-N	-1	3	328.390	1.997	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@H](C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)on1	ZINC000344210795	444841860	/nfs/dbraw/zinc/84/18/60/444841860.db2.gz	LSSAAOSFJQUCMA-VIFPVBQESA-N	-1	3	339.329	1.692	20	5		EDBDHM
O=C(Nc1ccc(OC(F)F)nc1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000338974592	444964767	/nfs/dbraw/zinc/96/47/67/444964767.db2.gz	PZMPECYFHPIDMU-UHFFFAOYSA-N	-1	3	326.215	1.944	20	5		EDBDHM
C[C@@]1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCOC1	ZINC000354481056	445256037	/nfs/dbraw/zinc/25/60/37/445256037.db2.gz	FWCUPENGWWGHMJ-LBPRGKRZSA-N	-1	3	334.781	1.953	20	5		EDBDHM
NC(=O)c1ccc(NCc2nnc(C(F)(F)F)[n-]2)c([N+](=O)[O-])c1	ZINC000359676843	445370051	/nfs/dbraw/zinc/37/00/51/445370051.db2.gz	SXOGQEWNQVOVND-UHFFFAOYSA-N	-1	3	330.226	1.443	20	5		EDBDHM
NC(=O)c1ccc(NCc2n[n-]c(C(F)(F)F)n2)c([N+](=O)[O-])c1	ZINC000359676843	445370055	/nfs/dbraw/zinc/37/00/55/445370055.db2.gz	SXOGQEWNQVOVND-UHFFFAOYSA-N	-1	3	330.226	1.443	20	5		EDBDHM
NC(=O)c1ccc(NCc2nc(C(F)(F)F)n[n-]2)c([N+](=O)[O-])c1	ZINC000359676843	445370059	/nfs/dbraw/zinc/37/00/59/445370059.db2.gz	SXOGQEWNQVOVND-UHFFFAOYSA-N	-1	3	330.226	1.443	20	5		EDBDHM
COC(=O)c1n[nH]cc1NC(=O)c1n[n-]c2ccc([N+](=O)[O-])cc21	ZINC000357203759	445479925	/nfs/dbraw/zinc/47/99/25/445479925.db2.gz	MCEMATXXLQHBMU-UHFFFAOYSA-N	-1	3	330.260	1.233	20	5		EDBDHM
O=C(c1cccc([O-])c1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000357207716	445482313	/nfs/dbraw/zinc/48/23/13/445482313.db2.gz	SQYKNCBCUXXJOR-UHFFFAOYSA-N	-1	3	328.328	1.658	20	5		EDBDHM
C/C=C\C[C@@H](CO)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000351607963	446203196	/nfs/dbraw/zinc/20/31/96/446203196.db2.gz	LAQNFUPFLNEGCM-RXNFCKPNSA-N	-1	3	328.390	1.817	20	5		EDBDHM
Cc1cc(C(=O)N[C@H]2COc3ccccc3[C@@H]2O)c([N+](=O)[O-])c(=O)[n-]1	ZINC000366521770	446247641	/nfs/dbraw/zinc/24/76/41/446247641.db2.gz	PUQCEAVNONCYKS-FZMZJTMJSA-N	-1	3	345.311	1.228	20	5		EDBDHM
CSC[C@](C)(O)C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000443248692	447014563	/nfs/dbraw/zinc/01/45/63/447014563.db2.gz	LNKJKVUWVMERMR-GFCCVEGCSA-N	-1	3	334.419	1.296	20	5		EDBDHM
CC[C@H](C[C@@H](C)CO)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000443325698	447033449	/nfs/dbraw/zinc/03/34/49/447033449.db2.gz	HPUFMUZVHZAXEH-VXGBXAGGSA-N	-1	3	330.406	1.979	20	5		EDBDHM
Cc1n[nH]cc1-c1nnc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)s1	ZINC000372599467	447173099	/nfs/dbraw/zinc/17/30/99/447173099.db2.gz	GUICQRXGNIMNQD-UHFFFAOYSA-N	-1	3	347.316	1.498	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C2(C(=O)N(C)C)CC2)c1[N+](=O)[O-]	ZINC000416583754	447655376	/nfs/dbraw/zinc/65/53/76/447655376.db2.gz	IALIPXBJTFDNID-UHFFFAOYSA-N	-1	3	341.389	1.111	20	5		EDBDHM
O=C([O-])[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)C[C@H]1c1ccccc1	ZINC000566218986	448417299	/nfs/dbraw/zinc/41/72/99/448417299.db2.gz	BQLWUHUFOWEMJS-UONOGXRCSA-N	-1	3	330.344	1.592	20	5		EDBDHM
O=C(CCNc1ccccc1[N+](=O)[O-])NCCCc1cc(=O)[nH][n-]1	ZINC000588875861	448944164	/nfs/dbraw/zinc/94/41/64/448944164.db2.gz	JNTMUOVEOMCZHW-UHFFFAOYSA-N	-1	3	333.348	1.169	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](CO)CC1CC1	ZINC000611109704	449171245	/nfs/dbraw/zinc/17/12/45/449171245.db2.gz	CCULALBFMNVELZ-JTQLQIEISA-N	-1	3	330.362	1.043	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCOC3(CCCC3)C2)nc1	ZINC000593563856	449353857	/nfs/dbraw/zinc/35/38/57/449353857.db2.gz	GPRJPRWKJNTEOB-LLVKDONJSA-N	-1	3	341.389	1.760	20	5		EDBDHM
O=c1[n-]ccc(N2CCN(CC(F)(F)C(F)F)CC2)c1[N+](=O)[O-]	ZINC000596128993	449378457	/nfs/dbraw/zinc/37/84/57/449378457.db2.gz	SIBZJLRWOCUZDP-UHFFFAOYSA-N	-1	3	338.261	1.718	20	5		EDBDHM
CS(=O)(=O)C1(CNc2cc[n-]c(=O)c2[N+](=O)[O-])CCCCC1	ZINC000596472049	449519084	/nfs/dbraw/zinc/51/90/84/449519084.db2.gz	AJIOKLZGSOJWAB-UHFFFAOYSA-N	-1	3	329.378	1.855	20	5		EDBDHM
Cn1ncc([N+](=O)[O-])c1C(=O)[N-]c1cc(C(=O)OC(C)(C)C)ccn1	ZINC000598746470	449579683	/nfs/dbraw/zinc/57/96/83/449579683.db2.gz	PLPABQQPOIBZPP-UHFFFAOYSA-N	-1	3	347.331	1.931	20	5		EDBDHM
CCCN1CCC([N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])CC1	ZINC000594744482	449661728	/nfs/dbraw/zinc/66/17/28/449661728.db2.gz	LWUUGQALGOBDAY-UHFFFAOYSA-N	-1	3	328.394	1.143	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])CN1CCCCC1	ZINC000594755083	449669552	/nfs/dbraw/zinc/66/95/52/449669552.db2.gz	HYLMZCCPKDMKAF-GFCCVEGCSA-N	-1	3	342.421	1.390	20	5		EDBDHM
C[C@@H]1CC[C@H]([N-]S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CN1	ZINC000599102394	449733211	/nfs/dbraw/zinc/73/32/11/449733211.db2.gz	FFEZEHCXWKMCSP-BDAKNGLRSA-N	-1	3	333.797	1.667	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@]1(C)CC1(F)F	ZINC000594851762	449760265	/nfs/dbraw/zinc/76/02/65/449760265.db2.gz	LSQYKAFIXQVMSI-LLVKDONJSA-N	-1	3	336.316	1.927	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]C[C@@]1(C)CC1(F)F	ZINC000594856585	449765864	/nfs/dbraw/zinc/76/58/64/449765864.db2.gz	IMGOKSMDRXJDBK-LLVKDONJSA-N	-1	3	336.316	1.927	20	5		EDBDHM
CCN1CCC[C@@H]([N-]S(=O)(=O)c2cc(C)sc2[N+](=O)[O-])C1	ZINC000601314101	449823717	/nfs/dbraw/zinc/82/37/17/449823717.db2.gz	YRZKOTBXRMOJDE-SNVBAGLBSA-N	-1	3	333.435	1.727	20	5		EDBDHM
CCN1CCC[C@@H](C[N-]S(=O)(=O)c2cc(C)sc2[N+](=O)[O-])C1	ZINC000601328776	449837212	/nfs/dbraw/zinc/83/72/12/449837212.db2.gz	YVMXRGFXXOUZNQ-NSHDSACASA-N	-1	3	347.462	1.975	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN2CC=CCC2)c(F)cc1[N+](=O)[O-]	ZINC000601406452	449922638	/nfs/dbraw/zinc/92/26/38/449922638.db2.gz	AJJRVQSISHYBOH-UHFFFAOYSA-N	-1	3	343.380	1.583	20	5		EDBDHM
CN1CCCC[C@@H](C[N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])C1	ZINC000599415441	449960933	/nfs/dbraw/zinc/96/09/33/449960933.db2.gz	PAHSTAFJQWMOHV-NSHDSACASA-N	-1	3	328.394	1.000	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000609793540	450098226	/nfs/dbraw/zinc/09/82/26/450098226.db2.gz	FHWJYPZUANHAJX-NSHDSACASA-N	-1	3	338.751	1.419	20	5		EDBDHM
NC(=O)c1cc([N+](=O)[O-])cnc1[N-]c1cnn(-c2ccccn2)c1	ZINC000610076964	450135626	/nfs/dbraw/zinc/13/56/26/450135626.db2.gz	HXJASCARPOWPJM-UHFFFAOYSA-N	-1	3	325.288	1.413	20	5		EDBDHM
CCO[C@H]1COCC[C@@H]1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000352977580	535642098	/nfs/dbraw/zinc/64/20/98/535642098.db2.gz	PGXUOHXWSJQXTG-JQWIXIFHSA-N	-1	3	330.362	1.067	20	5		EDBDHM
Cc1ccc(C(=O)[N-]N2C(=O)NC3(CCCCC3)C2=O)cc1[N+](=O)[O-]	ZINC000017114179	536299497	/nfs/dbraw/zinc/29/94/97/536299497.db2.gz	DELQIMGUDSIFQC-UHFFFAOYSA-N	-1	3	346.343	1.803	20	5		EDBDHM
C[C@@H](Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@@H](C)N1CCOCC1	ZINC000736136767	578956145	/nfs/dbraw/zinc/95/61/45/578956145.db2.gz	HJZNTAURFDCUDL-GHMZBOCLSA-N	-1	3	347.379	1.296	20	5		EDBDHM
C[C@@H](Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])[C@@H](C)N1CCOCC1	ZINC000736136767	578956146	/nfs/dbraw/zinc/95/61/46/578956146.db2.gz	HJZNTAURFDCUDL-GHMZBOCLSA-N	-1	3	347.379	1.296	20	5		EDBDHM
CN(C(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(-c2nnn[n-]2)cc1	ZINC000736738617	579016268	/nfs/dbraw/zinc/01/62/68/579016268.db2.gz	CJFURPWEMQXIDX-UHFFFAOYSA-N	-1	3	338.327	1.980	20	5		EDBDHM
CN(C(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(-c2nn[n-]n2)cc1	ZINC000736738617	579016269	/nfs/dbraw/zinc/01/62/69/579016269.db2.gz	CJFURPWEMQXIDX-UHFFFAOYSA-N	-1	3	338.327	1.980	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]CC2(O)CCC2)cc1[N+](=O)[O-]	ZINC000751244861	579798963	/nfs/dbraw/zinc/79/89/63/579798963.db2.gz	FTBMPJMZCKVZNZ-UHFFFAOYSA-N	-1	3	334.781	1.750	20	5		EDBDHM
CC1(C)OCC([N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CO1	ZINC000758629646	579988126	/nfs/dbraw/zinc/98/81/26/579988126.db2.gz	AWDWKQJUZCUXIE-UHFFFAOYSA-N	-1	3	330.362	1.166	20	5		EDBDHM
O=C(Nc1nnc(SCCO)[n-]1)c1ccc([N+](=O)[O-])c(Cl)c1	ZINC000768722500	580218986	/nfs/dbraw/zinc/21/89/86/580218986.db2.gz	WLOPYBSWLIWLJI-UHFFFAOYSA-N	-1	3	343.752	1.703	20	5		EDBDHM
O=C(Nc1nc(SCCO)n[n-]1)c1ccc([N+](=O)[O-])c(Cl)c1	ZINC000768722500	580218987	/nfs/dbraw/zinc/21/89/87/580218987.db2.gz	WLOPYBSWLIWLJI-UHFFFAOYSA-N	-1	3	343.752	1.703	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]CCNc2ccccn2)cs1	ZINC000768848476	580222308	/nfs/dbraw/zinc/22/23/08/580222308.db2.gz	JEASJPQDYGKHMT-UHFFFAOYSA-N	-1	3	328.375	1.442	20	5		EDBDHM
CC(C)(C)[C@@H]([N-]S(C)(=O)=O)C(=O)OCc1ccccc1[N+](=O)[O-]	ZINC000770101370	580252927	/nfs/dbraw/zinc/25/29/27/580252927.db2.gz	UBDSFBAXXYSTFA-LBPRGKRZSA-N	-1	3	344.389	1.602	20	5		EDBDHM
COc1c([O-])ccc(CN[C@@H](C)[C@@H]2CN(C)CCO2)c1[N+](=O)[O-]	ZINC000893142403	590679972	/nfs/dbraw/zinc/67/99/72/590679972.db2.gz	AONPVTNQTOGIOP-GWCFXTLKSA-N	-1	3	325.365	1.118	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]Cc2cnn(C)n2)cc1[N+](=O)[O-]	ZINC000805102193	593333765	/nfs/dbraw/zinc/33/37/65/593333765.db2.gz	IMSYWYWKJNTUJY-UHFFFAOYSA-N	-1	3	345.768	1.164	20	5		EDBDHM
O=[N+]([O-])c1ccc(CS(=O)(=O)[N-]Cc2nccnc2Cl)cc1	ZINC000809379969	593334815	/nfs/dbraw/zinc/33/48/15/593334815.db2.gz	QYXPMYXEAACGOP-UHFFFAOYSA-N	-1	3	342.764	1.658	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2C[C@H](C)OC2=O)c1[N+](=O)[O-]	ZINC000809383413	593335704	/nfs/dbraw/zinc/33/57/04/593335704.db2.gz	XIERPDFRBJSZJR-VHSXEESVSA-N	-1	3	328.346	1.194	20	5		EDBDHM
CC(C)OCCO[N-]C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000812801555	593509616	/nfs/dbraw/zinc/50/96/16/593509616.db2.gz	VNDHGMDIGSJLGV-UHFFFAOYSA-N	-1	3	326.305	1.452	20	5		EDBDHM
CCn1c(=O)c2ccc(C(=O)OCC(C)[N+](=O)[O-])cc2[n-]c1=S	ZINC000813111448	593518604	/nfs/dbraw/zinc/51/86/04/593518604.db2.gz	HJTMZSJGUVIFPO-MRVPVSSYSA-N	-1	3	337.357	1.527	20	5		EDBDHM
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)[N-]C1=NC[C@H](C)S1	ZINC000819774942	593768486	/nfs/dbraw/zinc/76/84/86/593768486.db2.gz	WBOZPRJMMAPJCL-IONNQARKSA-N	-1	3	340.409	1.435	20	5		EDBDHM
CC(C)(C)OC(=O)CCNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000819928600	593777618	/nfs/dbraw/zinc/77/76/18/593777618.db2.gz	RJNFGYRESHZHAF-UHFFFAOYSA-N	-1	3	334.336	1.919	20	5		EDBDHM
CC(C)(C)OC(=O)CCNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000819928600	593777619	/nfs/dbraw/zinc/77/76/19/593777619.db2.gz	RJNFGYRESHZHAF-UHFFFAOYSA-N	-1	3	334.336	1.919	20	5		EDBDHM
CCO[C@@H](C)C(=O)Nc1cc(-c2nnn[n-]2)cc([N+](=O)[O-])c1Cl	ZINC000825576681	594202837	/nfs/dbraw/zinc/20/28/37/594202837.db2.gz	NLFLPCJCYLTUKN-LURJTMIESA-N	-1	3	340.727	1.792	20	5		EDBDHM
CCO[C@@H](C)C(=O)Nc1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl	ZINC000825576681	594202838	/nfs/dbraw/zinc/20/28/38/594202838.db2.gz	NLFLPCJCYLTUKN-LURJTMIESA-N	-1	3	340.727	1.792	20	5		EDBDHM
O=[N+]([O-])c1c(F)cccc1NCCNc1ncccc1-c1nnn[n-]1	ZINC000823630104	594222865	/nfs/dbraw/zinc/22/28/65/594222865.db2.gz	RRFVXNCWYBQRQG-UHFFFAOYSA-N	-1	3	344.310	1.833	20	5		EDBDHM
O=[N+]([O-])c1c(F)cccc1NCCNc1ncccc1-c1nn[n-]n1	ZINC000823630104	594222866	/nfs/dbraw/zinc/22/28/66/594222866.db2.gz	RRFVXNCWYBQRQG-UHFFFAOYSA-N	-1	3	344.310	1.833	20	5		EDBDHM
O=[N+]([O-])c1cc(NCc2nncn2C2CC2)ccc1-c1nnn[n-]1	ZINC000823634467	594223413	/nfs/dbraw/zinc/22/34/13/594223413.db2.gz	GMDGLVOLENQYNS-UHFFFAOYSA-N	-1	3	327.308	1.313	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC[C@]3(O)CCCC[C@H]3C2)c(-c2nnn[n-]2)c1	ZINC000823647158	594224550	/nfs/dbraw/zinc/22/45/50/594224550.db2.gz	HDTSGQDMHFTAJZ-ZUZCIYMTSA-N	-1	3	345.363	1.301	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC[C@]3(O)CCCC[C@H]3C2)c(-c2nn[n-]n2)c1	ZINC000823647158	594224551	/nfs/dbraw/zinc/22/45/51/594224551.db2.gz	HDTSGQDMHFTAJZ-ZUZCIYMTSA-N	-1	3	345.363	1.301	20	5		EDBDHM
COc1ccc(CNc2cccnc2[N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000826203873	594377233	/nfs/dbraw/zinc/37/72/33/594377233.db2.gz	JTFBCGOAIILLMP-UHFFFAOYSA-N	-1	3	327.304	1.791	20	5		EDBDHM
COc1ccc(CNc2cccnc2[N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000826203873	594377235	/nfs/dbraw/zinc/37/72/35/594377235.db2.gz	JTFBCGOAIILLMP-UHFFFAOYSA-N	-1	3	327.304	1.791	20	5		EDBDHM
Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)c1c[nH]c(-c3nnn[n-]3)c1)CC2	ZINC000826273001	594406672	/nfs/dbraw/zinc/40/66/72/594406672.db2.gz	LDZHIDNETUUQDE-UHFFFAOYSA-N	-1	3	339.315	1.614	20	5		EDBDHM
Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)c1c[nH]c(-c3nn[n-]n3)c1)CC2	ZINC000826273001	594406674	/nfs/dbraw/zinc/40/66/74/594406674.db2.gz	LDZHIDNETUUQDE-UHFFFAOYSA-N	-1	3	339.315	1.614	20	5		EDBDHM
Cc1nn(CCCOc2cccc(-c3nnn[n-]3)c2)cc1[N+](=O)[O-]	ZINC000826334801	594431051	/nfs/dbraw/zinc/43/10/51/594431051.db2.gz	KCZACMUDPBWJBC-UHFFFAOYSA-N	-1	3	329.320	1.749	20	5		EDBDHM
Cc1nn(CCCOc2cccc(-c3nn[n-]n3)c2)cc1[N+](=O)[O-]	ZINC000826334801	594431053	/nfs/dbraw/zinc/43/10/53/594431053.db2.gz	KCZACMUDPBWJBC-UHFFFAOYSA-N	-1	3	329.320	1.749	20	5		EDBDHM
Cn1ncc([N+](=O)[O-])c1C(=O)OCc1ccc(-c2nnn[n-]2)cc1F	ZINC000826366793	594448027	/nfs/dbraw/zinc/44/80/27/594448027.db2.gz	XWWDWVRRHGSTDJ-UHFFFAOYSA-N	-1	3	347.266	1.005	20	5		EDBDHM
Cn1ncc([N+](=O)[O-])c1C(=O)OCc1ccc(-c2nn[n-]n2)cc1F	ZINC000826366793	594448028	/nfs/dbraw/zinc/44/80/28/594448028.db2.gz	XWWDWVRRHGSTDJ-UHFFFAOYSA-N	-1	3	347.266	1.005	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H]2COC3(CCCC3)O2)c(-c2nnn[n-]2)c1	ZINC000826500899	594503743	/nfs/dbraw/zinc/50/37/43/594503743.db2.gz	QXSIINFHPYYLLN-JTQLQIEISA-N	-1	3	347.335	1.268	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H]2COC3(CCCC3)O2)c(-c2nn[n-]n2)c1	ZINC000826500899	594503745	/nfs/dbraw/zinc/50/37/45/594503745.db2.gz	QXSIINFHPYYLLN-JTQLQIEISA-N	-1	3	347.335	1.268	20	5		EDBDHM
CSCCO[N-]C(=O)c1cc([N+](=O)[O-])ncc1Br	ZINC000830990367	594533264	/nfs/dbraw/zinc/53/32/64/594533264.db2.gz	GXAFRLFEUCXTTJ-UHFFFAOYSA-N	-1	3	336.167	1.777	20	5		EDBDHM
O=C([O-])CC1(NCc2nc3cc([N+](=O)[O-])ccc3o2)CCOCC1	ZINC000833205932	594804540	/nfs/dbraw/zinc/80/45/40/594804540.db2.gz	QVXROFBJKICQGF-UHFFFAOYSA-N	-1	3	335.316	1.850	20	5		EDBDHM
CC[C@@H](C)CO[N-]C(=O)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000836790856	594998330	/nfs/dbraw/zinc/99/83/30/594998330.db2.gz	VOLJRAGRXRPUNX-SECBINFHSA-N	-1	3	330.362	1.706	20	5		EDBDHM
O=C([O-])N1CCC[C@H]1CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000834111254	595017681	/nfs/dbraw/zinc/01/76/81/595017681.db2.gz	DBHONUSZRLGGIW-YPMHNXCESA-N	-1	3	335.364	1.618	20	5		EDBDHM
CCCCC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(=O)OC	ZINC000845890515	595090067	/nfs/dbraw/zinc/09/00/67/595090067.db2.gz	IUMOQAGHTNLQID-NSHDSACASA-N	-1	3	345.377	1.390	20	5		EDBDHM
C[C@H](C1CC1)n1[n-]ccc1=NC(=O)Cn1cc([N+](=O)[O-])cc(F)c1=O	ZINC000842637598	595152585	/nfs/dbraw/zinc/15/25/85/595152585.db2.gz	OVCDQCYONQCUPP-SECBINFHSA-N	-1	3	349.322	1.124	20	5		EDBDHM
O=C([O-])CCN(C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@@H]1CCCO1	ZINC000846272937	595193742	/nfs/dbraw/zinc/19/37/42/595193742.db2.gz	QKBXWPMBUBMBGV-GJZGRUSLSA-N	-1	3	338.360	1.584	20	5		EDBDHM
CC[C@H]([N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)C(=O)NC	ZINC000848592165	595411983	/nfs/dbraw/zinc/41/19/83/595411983.db2.gz	QZMFDDNAJKOVSF-JTQLQIEISA-N	-1	3	331.275	1.207	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(OC)OC	ZINC000849406305	595521279	/nfs/dbraw/zinc/52/12/79/595521279.db2.gz	IECOJLQAKVIGOT-NSHDSACASA-N	-1	3	346.405	1.887	20	5		EDBDHM
COc1cc(C(=O)OCc2onc(C)c2[N+](=O)[O-])cc(OC)c1[O-]	ZINC000853907380	595918419	/nfs/dbraw/zinc/91/84/19/595918419.db2.gz	VCXMGJRFACEXFP-UHFFFAOYSA-N	-1	3	338.272	1.971	20	5		EDBDHM
O=C1[N-]C(=O)N2CCN(c3c(Cl)c(Cl)ccc3[N+](=O)[O-])C[C@@H]12	ZINC000865662933	596643084	/nfs/dbraw/zinc/64/30/84/596643084.db2.gz	HRHGKNQQISGVAF-QMMMGPOBSA-N	-1	3	345.142	1.642	20	5		EDBDHM
O=c1c([N+](=O)[O-])cccn1CCOc1ccccc1-c1nnn[n-]1	ZINC000738370319	598316713	/nfs/dbraw/zinc/31/67/13/598316713.db2.gz	CESXNPNKITWEQS-UHFFFAOYSA-N	-1	3	328.288	1.016	20	5		EDBDHM
O=c1c([N+](=O)[O-])cccn1CCOc1ccccc1-c1nn[n-]n1	ZINC000738370319	598316714	/nfs/dbraw/zinc/31/67/14/598316714.db2.gz	CESXNPNKITWEQS-UHFFFAOYSA-N	-1	3	328.288	1.016	20	5		EDBDHM
O=C([O-])c1cc(C(=O)N2CC[C@@H](N3CCCCC3)C2)cc([N+](=O)[O-])c1	ZINC000738668929	599762718	/nfs/dbraw/zinc/76/27/18/599762718.db2.gz	JFHFVKQOARMFFF-CQSZACIVSA-N	-1	3	347.371	1.993	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCNc2ccccc2[N+](=O)[O-])o1	ZINC000358432039	709478825	/nfs/dbraw/zinc/47/88/25/709478825.db2.gz	WFWHSTPUTMWWCG-UHFFFAOYSA-N	-1	3	325.346	1.887	20	5		EDBDHM
CO[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C1(C)C	ZINC000440406423	305205843	/nfs/dbraw/zinc/20/58/43/305205843.db2.gz	XRAMKFCPJJENAY-STQMWFEESA-N	-1	3	328.390	1.995	20	5		EDBDHM
O=C(Cc1nc2cccnc2c(=O)[n-]1)NCc1ccc([N+](=O)[O-])cc1	ZINC000491580824	255131606	/nfs/dbraw/zinc/13/16/06/255131606.db2.gz	FXIFPXWMLAMKHY-UHFFFAOYSA-N	-1	3	339.311	1.498	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2C(=O)/C=C/c2cccc([N+](=O)[O-])c2)nc1=N	ZINC000493047527	255189640	/nfs/dbraw/zinc/18/96/40/255189640.db2.gz	LRJYANQEFKLBHX-GWJCSSMESA-N	-1	3	342.359	1.513	20	5		EDBDHM
CSC[C@@](C)(O)C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000269802350	139997032	/nfs/dbraw/zinc/99/70/32/139997032.db2.gz	SQYUAQJDWYBICB-ZDUSSCGKSA-N	-1	3	348.446	1.604	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@]1(O)CCSC1	ZINC000269865974	140008884	/nfs/dbraw/zinc/00/88/84/140008884.db2.gz	STMCCZZQIJTVDU-LBPRGKRZSA-N	-1	3	332.403	1.050	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCCOCC2)c([N+](=O)[O-])c1	ZINC000271954800	140378450	/nfs/dbraw/zinc/37/84/50/140378450.db2.gz	KVUCNHSASZXINV-SNVBAGLBSA-N	-1	3	330.362	1.451	20	5		EDBDHM
O=C(NCc1ccc(-c2nnn[n-]2)cc1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000347568328	143335953	/nfs/dbraw/zinc/33/59/53/143335953.db2.gz	UYBVOWRUQOXPHS-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=C(NCc1ccc(-c2nn[n-]n2)cc1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000347568328	143335954	/nfs/dbraw/zinc/33/59/54/143335954.db2.gz	UYBVOWRUQOXPHS-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
CCO[C@H]1C[C@@H]([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)C1	ZINC000416525760	304328535	/nfs/dbraw/zinc/32/85/35/304328535.db2.gz	JFMQFUOSIRVYKY-JGZJWPJOSA-N	-1	3	330.362	1.449	20	5		EDBDHM
COCCC(C)(C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000352980461	149238990	/nfs/dbraw/zinc/23/89/90/149238990.db2.gz	IGOUTLUIATVPCL-UHFFFAOYSA-N	-1	3	332.378	1.697	20	5		EDBDHM
COCCCN1CCCN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC1	ZINC000363795232	153058842	/nfs/dbraw/zinc/05/88/42/153058842.db2.gz	MBGULOBIBPZUAT-UHFFFAOYSA-N	-1	3	337.376	1.485	20	5		EDBDHM
C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCO[C@H](CN(C)CC(=O)[O-])C1	ZINC000363925521	153098622	/nfs/dbraw/zinc/09/86/22/153098622.db2.gz	QASJFPPAZYZZMX-SWLSCSKDSA-N	-1	3	337.376	1.373	20	5		EDBDHM
Cc1c(CN2CCO[C@H](CN(C)CC(=O)[O-])C2)cccc1[N+](=O)[O-]	ZINC000364007104	153120026	/nfs/dbraw/zinc/12/00/26/153120026.db2.gz	MDLVBCXUHUEDCO-CQSZACIVSA-N	-1	3	337.376	1.120	20	5		EDBDHM
Cc1cnn([C@H]2CCCN(C(=O)c3cc(C)[n-]c(=O)c3[N+](=O)[O-])C2)c1	ZINC000367395906	154105383	/nfs/dbraw/zinc/10/53/83/154105383.db2.gz	ZVJADPGIGNLCII-LBPRGKRZSA-N	-1	3	345.359	1.986	20	5		EDBDHM
O=C(NCCNC(=O)c1ccc(F)cc1[N+](=O)[O-])c1ccc([O-])cc1	ZINC000136249056	287577996	/nfs/dbraw/zinc/57/79/96/287577996.db2.gz	SZCMLNHKMAHQIJ-UHFFFAOYSA-N	-1	3	347.302	1.599	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCCC(=O)OC(C)C	ZINC000274213073	273078653	/nfs/dbraw/zinc/07/86/53/273078653.db2.gz	QSRJTPFMYXXGCI-UHFFFAOYSA-N	-1	3	344.389	1.913	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CCc2nc[n-]c(=O)c2C1	ZINC000283739287	273947189	/nfs/dbraw/zinc/94/71/89/273947189.db2.gz	IXPZXVRHRQEUPX-UHFFFAOYSA-N	-1	3	344.327	1.748	20	5		EDBDHM
CC[C@H](CCO)C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000190066111	287841944	/nfs/dbraw/zinc/84/19/44/287841944.db2.gz	XBIJKIOMSMBXNU-GFCCVEGCSA-N	-1	3	330.406	1.899	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC1=CCCOC1	ZINC000287164645	288170916	/nfs/dbraw/zinc/17/09/16/288170916.db2.gz	DFDCIDOJOWNGNF-UHFFFAOYSA-N	-1	3	328.346	1.228	20	5		EDBDHM
COC(=O)[C@H](CF)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000287374875	288223300	/nfs/dbraw/zinc/22/33/00/288223300.db2.gz	JCOZDWCIYVCYTQ-VIFPVBQESA-N	-1	3	334.325	1.001	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)C(F)(F)F)cc1[N+](=O)[O-]	ZINC000288620472	288529494	/nfs/dbraw/zinc/52/94/94/288529494.db2.gz	MIPAQNHEAGMHAV-LURJTMIESA-N	-1	3	328.268	1.833	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1snnc1C	ZINC000291823428	289189219	/nfs/dbraw/zinc/18/92/19/289189219.db2.gz	FHJPGEYIWRPMKI-UHFFFAOYSA-N	-1	3	344.374	1.242	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCCC[C@H]2O)cc1C	ZINC000120477585	301427363	/nfs/dbraw/zinc/42/73/63/301427363.db2.gz	MQNWHCKRBHXCGR-DGCLKSJQSA-N	-1	3	328.390	1.793	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@H]2CCO[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000330653654	303771973	/nfs/dbraw/zinc/77/19/73/303771973.db2.gz	ZMCHBQSOESCHAU-NEPJUHHUSA-N	-1	3	328.390	1.997	20	5		EDBDHM
NC(=O)N1CCc2ccc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)cc21	ZINC000429592849	305032773	/nfs/dbraw/zinc/03/27/73/305032773.db2.gz	MRLASWSYCANLPG-UHFFFAOYSA-N	-1	3	343.299	1.389	20	5		EDBDHM
CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCC[C@]2(C1)NC(=O)[N-]C2=O	ZINC000435042128	305135208	/nfs/dbraw/zinc/13/52/08/305135208.db2.gz	LTUZPTVXLCLXFZ-FWVUHSSSSA-N	-1	3	344.371	1.672	20	5		EDBDHM
O=C(c1c([O-])cccc1O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000436646211	305163740	/nfs/dbraw/zinc/16/37/40/305163740.db2.gz	GQWHZSBQBBVAOF-JTQLQIEISA-N	-1	3	344.327	1.728	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2C[C@H](OC)C2(C)C)c([N+](=O)[O-])c1	ZINC000440397910	305205498	/nfs/dbraw/zinc/20/54/98/305205498.db2.gz	MCRKRNYSVDXDQY-STQMWFEESA-N	-1	3	344.389	1.695	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])CCC1	ZINC000446916970	305271897	/nfs/dbraw/zinc/27/18/97/305271897.db2.gz	UBRDBGAQEUMNHG-UHFFFAOYSA-N	-1	3	328.346	1.277	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCC[C@@H]1CCOC1	ZINC000452022929	305379371	/nfs/dbraw/zinc/37/93/71/305379371.db2.gz	VXXZAEXVHKUTPL-LLVKDONJSA-N	-1	3	344.389	1.698	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-]C1(C3CC3)CC1)OCCO2	ZINC000532367486	305981758	/nfs/dbraw/zinc/98/17/58/305981758.db2.gz	WGCAZVLFKJDVTL-UHFFFAOYSA-N	-1	3	340.357	1.587	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC(=O)NC(C)C)cc1C	ZINC000060497828	441247155	/nfs/dbraw/zinc/24/71/55/441247155.db2.gz	CYJWCEPDKSJZHF-UHFFFAOYSA-N	-1	3	329.378	1.015	20	5		EDBDHM
CN(C)c1ccc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)cn1	ZINC000066000162	441499399	/nfs/dbraw/zinc/49/93/99/441499399.db2.gz	AKUPPXBRYOZAEZ-UHFFFAOYSA-N	-1	3	342.402	1.596	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCCOCC1CC1	ZINC000032407452	441555922	/nfs/dbraw/zinc/55/59/22/441555922.db2.gz	KCLQGYVJCCJDMA-UHFFFAOYSA-N	-1	3	344.389	1.698	20	5		EDBDHM
CC(C)OC(=O)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000055218446	441630516	/nfs/dbraw/zinc/63/05/16/441630516.db2.gz	NIYWLQCOZOXKOX-UHFFFAOYSA-N	-1	3	334.325	1.354	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCCC[C@H]2O)c1C	ZINC000158478377	441739586	/nfs/dbraw/zinc/73/95/86/441739586.db2.gz	QYAYVTRBOCRMJO-WCQYABFASA-N	-1	3	328.390	1.793	20	5		EDBDHM
CC(=O)N1CC[C@H]([N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C1	ZINC000126727172	442137933	/nfs/dbraw/zinc/13/79/33/442137933.db2.gz	RGWOPIOHSQCDGP-LBPRGKRZSA-N	-1	3	341.389	1.111	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1C[C@@H](C)N(C2CC2)C1	ZINC000126302224	442096679	/nfs/dbraw/zinc/09/66/79/442096679.db2.gz	NOYPBYGVDCMLBF-VXGBXAGGSA-N	-1	3	339.417	1.807	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC2(CCO)CCC2)c([N+](=O)[O-])c1	ZINC000127372018	442196607	/nfs/dbraw/zinc/19/66/07/442196607.db2.gz	YSHJCHQCKLYGBQ-UHFFFAOYSA-N	-1	3	328.390	1.734	20	5		EDBDHM
CC(C)(C)C(=O)C[N-]S(=O)(=O)CCc1ccccc1[N+](=O)[O-]	ZINC000133449649	442418603	/nfs/dbraw/zinc/41/86/03/442418603.db2.gz	RCJWBCRZNSFJNH-UHFFFAOYSA-N	-1	3	328.390	1.672	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1[C@H]2CCO[C@@H]2C12CCC2	ZINC000155770139	442425947	/nfs/dbraw/zinc/42/59/47/442425947.db2.gz	HRUSONYNQNQSGK-HONMWMINSA-N	-1	3	338.385	1.831	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2C[C@@H](O)C2(C)C)c1C	ZINC000188144071	442716374	/nfs/dbraw/zinc/71/63/74/442716374.db2.gz	OJTAKAFGUPGKQH-NWDGAFQWSA-N	-1	3	328.390	1.649	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H]2CC[C@H](O)C2)c1C	ZINC000188354410	442742445	/nfs/dbraw/zinc/74/24/45/442742445.db2.gz	UROUMUYEGBFHIT-NEPJUHHUSA-N	-1	3	328.390	1.651	20	5		EDBDHM
CC1(C)[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)[C@H]2CCO[C@H]21	ZINC000246688319	442803153	/nfs/dbraw/zinc/80/31/53/442803153.db2.gz	BKKPXZRBSGXRJQ-OASPWFOLSA-N	-1	3	344.364	1.826	20	5		EDBDHM
COCc1nc(SCC(=O)Nc2cc([N+](=O)[O-])ccc2F)n[n-]1	ZINC000268497202	443010316	/nfs/dbraw/zinc/01/03/16/443010316.db2.gz	QQEBKIYDWMWECL-UHFFFAOYSA-N	-1	3	341.324	1.729	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2C(=O)NCC[C@@H]2C)c1C	ZINC000195477110	443023232	/nfs/dbraw/zinc/02/32/32/443023232.db2.gz	QNYIHRBJSGQENO-JOYOIKCWSA-N	-1	3	341.389	1.015	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2C[C@H](O)C2(C)C)c1[N+](=O)[O-]	ZINC000190169061	443066718	/nfs/dbraw/zinc/06/67/18/443066718.db2.gz	HKFAHRNANUIVRF-QWRGUYRKSA-N	-1	3	328.390	1.649	20	5		EDBDHM
C[C@@H]1CN(C2CC2)C[C@H]1[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000268816950	443117882	/nfs/dbraw/zinc/11/78/82/443117882.db2.gz	WCRQFZUCILVWHA-BXKDBHETSA-N	-1	3	343.380	1.495	20	5		EDBDHM
CCOC(=O)[C@H](C)C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000268836085	443123153	/nfs/dbraw/zinc/12/31/53/443123153.db2.gz	XELCAJTXLLPJQU-LLVKDONJSA-N	-1	3	344.389	1.689	20	5		EDBDHM
C/C=C/C[C@H](CO)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000185267724	443173381	/nfs/dbraw/zinc/17/33/81/443173381.db2.gz	RNUREWPCGIITLS-ZYOFXKKJSA-N	-1	3	328.390	1.817	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CC[C@@H](CO)CC2)c(F)c1	ZINC000245568656	443237152	/nfs/dbraw/zinc/23/71/52/443237152.db2.gz	GBNYFDZINSPJHT-AOOOYVTPSA-N	-1	3	332.353	1.563	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])[C@H]1CCCO1	ZINC000278865766	443466883	/nfs/dbraw/zinc/46/68/83/443466883.db2.gz	YFUBSTASBMOKJF-DGCLKSJQSA-N	-1	3	344.389	1.376	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])[C@@H]1CCCO1	ZINC000278865764	443466901	/nfs/dbraw/zinc/46/69/01/443466901.db2.gz	YFUBSTASBMOKJF-AAEUAGOBSA-N	-1	3	344.389	1.376	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000440365553	320074439	/nfs/dbraw/zinc/07/44/39/320074439.db2.gz	IERSDVWKCGOBDR-UHFFFAOYSA-N	-1	3	330.260	1.233	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](C)c2ncn(C)n2)c1[N+](=O)[O-]	ZINC000276789377	443827768	/nfs/dbraw/zinc/82/77/68/443827768.db2.gz	JFORPJWODLQZTO-SNVBAGLBSA-N	-1	3	339.377	1.380	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H]2CC[C@@H](CO)O2)c1[N+](=O)[O-]	ZINC000292891574	443871257	/nfs/dbraw/zinc/87/12/57/443871257.db2.gz	DRAWMTSHRZTAIK-NEPJUHHUSA-N	-1	3	344.389	1.030	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCN3CCCC[C@@H]23)c(F)c1	ZINC000298823752	443877811	/nfs/dbraw/zinc/87/78/11/443877811.db2.gz	QPQFOJBMUOPJPP-OLZOCXBDSA-N	-1	3	343.380	1.639	20	5		EDBDHM
Cc1nc([C@H](C)[N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)n[nH]1	ZINC000285380931	443962445	/nfs/dbraw/zinc/96/24/45/443962445.db2.gz	NHGZNCFHCGKFKL-QMMMGPOBSA-N	-1	3	325.350	1.369	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CCOC[C@@H]1C	ZINC000285667796	444066617	/nfs/dbraw/zinc/06/66/17/444066617.db2.gz	QDTCNWAUXAETHQ-WDEREUQCSA-N	-1	3	344.389	1.554	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCOCC2CCC2)c(F)c1	ZINC000572710336	321435492	/nfs/dbraw/zinc/43/54/92/321435492.db2.gz	UZQRILXQUBQDLI-UHFFFAOYSA-N	-1	3	332.353	1.829	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCCCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000322346530	444339771	/nfs/dbraw/zinc/33/97/71/444339771.db2.gz	DRFKYTLIGDQGCG-AAEUAGOBSA-N	-1	3	344.389	1.575	20	5		EDBDHM
O=C1C[C@H]([N-]c2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]2CCCCN12	ZINC000337801964	444414689	/nfs/dbraw/zinc/41/46/89/444414689.db2.gz	IUSVVFVDNIXCTM-STQMWFEESA-N	-1	3	343.343	2.210	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCC[C@@]1(C)CO	ZINC000331188681	444436976	/nfs/dbraw/zinc/43/69/76/444436976.db2.gz	PQTCVIWXWWTFNB-OCCSQVGLSA-N	-1	3	328.390	1.733	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)c2ccon2)c([N+](=O)[O-])c1	ZINC000342365311	444657547	/nfs/dbraw/zinc/65/75/47/444657547.db2.gz	VHIMFXKFHAHOJH-QMMMGPOBSA-N	-1	3	327.318	1.631	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)c1nc(C)no1	ZINC000338904395	444923889	/nfs/dbraw/zinc/92/38/89/444923889.db2.gz	SBDLCGGABGAOPE-ZETCQYMHSA-N	-1	3	342.333	1.334	20	5		EDBDHM
O=C(Nc1ccc(N2CCC2=O)cc1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000337120358	444951389	/nfs/dbraw/zinc/95/13/89/444951389.db2.gz	YSYYTXNSVYEKEX-UHFFFAOYSA-N	-1	3	328.284	1.684	20	5		EDBDHM
Cc1c(Cl)cc(S(=O)(=O)[N-]c2ccc(=O)[nH]n2)cc1[N+](=O)[O-]	ZINC000337146712	444962282	/nfs/dbraw/zinc/96/22/82/444962282.db2.gz	YLMZFXFVTRIQLE-UHFFFAOYSA-N	-1	3	344.736	1.853	20	5		EDBDHM
C[C@@]1(c2ccc(CNc3ccc([N+](=O)[O-])nc3)cc2)NC(=O)[N-]C1=O	ZINC000344432732	444967473	/nfs/dbraw/zinc/96/74/73/444967473.db2.gz	MFOCFKKMGLQESG-INIZCTEOSA-N	-1	3	341.327	1.657	20	5		EDBDHM
Cn1ccc2ccc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)cc2c1=O	ZINC000357166022	445462908	/nfs/dbraw/zinc/46/29/08/445462908.db2.gz	PCPRATCBXOFVKH-UHFFFAOYSA-N	-1	3	340.295	1.800	20	5		EDBDHM
CCO[C@H]1COCC[C@H]1[N-]c1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000353258964	445583715	/nfs/dbraw/zinc/58/37/15/445583715.db2.gz	DGPKJWOQFOIAGJ-OLZOCXBDSA-N	-1	3	334.332	2.251	20	5		EDBDHM
O=C([O-])CC1CCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000583817766	326146576	/nfs/dbraw/zinc/14/65/76/326146576.db2.gz	ANXBDIXPDVPCAE-CYBMUJFWSA-N	-1	3	338.360	1.521	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC(=O)C(C)(C)C	ZINC000361960745	446108921	/nfs/dbraw/zinc/10/89/21/446108921.db2.gz	CAVJQKMCQLKHBQ-UHFFFAOYSA-N	-1	3	330.362	1.497	20	5		EDBDHM
O=C1CCC[C@@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)N1	ZINC000433451720	446574382	/nfs/dbraw/zinc/57/43/82/446574382.db2.gz	RULWRIYQNQNEEL-QMMMGPOBSA-N	-1	3	347.780	1.195	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCCC2(O)CCC2)c([N+](=O)[O-])c1	ZINC000420718464	446768768	/nfs/dbraw/zinc/76/87/68/446768768.db2.gz	OMSJSGZFUSUQOV-UHFFFAOYSA-N	-1	3	344.389	1.577	20	5		EDBDHM
O=C(/C=C/c1cncc([O-])c1)N1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368406969	446842349	/nfs/dbraw/zinc/84/23/49/446842349.db2.gz	JFAPZUAJHKMCJQ-OOPCZODUSA-N	-1	3	343.343	1.769	20	5		EDBDHM
C[C@@H](CN(C)c1ncc([N+](=O)[O-])cc1C(F)(F)F)c1nnn[n-]1	ZINC000413236910	447087090	/nfs/dbraw/zinc/08/70/90/447087090.db2.gz	RETOHVNSVHFADE-LURJTMIESA-N	-1	3	331.258	1.762	20	5		EDBDHM
C[C@@H](CN(C)c1ncc([N+](=O)[O-])cc1C(F)(F)F)c1nn[n-]n1	ZINC000413236910	447087098	/nfs/dbraw/zinc/08/70/98/447087098.db2.gz	RETOHVNSVHFADE-LURJTMIESA-N	-1	3	331.258	1.762	20	5		EDBDHM
COc1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c(OC)c1OC	ZINC000445005750	447155312	/nfs/dbraw/zinc/15/53/12/447155312.db2.gz	NDZKWYORFQAASP-UHFFFAOYSA-N	-1	3	349.299	1.974	20	5		EDBDHM
COC(=O)c1cc(C(=O)[N-]c2nc3n(n2)CCCC3)cc([N+](=O)[O-])c1	ZINC000457134630	447533877	/nfs/dbraw/zinc/53/38/77/447533877.db2.gz	BTXKPWDOLZLMQQ-UHFFFAOYSA-N	-1	3	345.315	1.562	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000427132535	447551036	/nfs/dbraw/zinc/55/10/36/447551036.db2.gz	DPVHIZRQAWJWSL-UHFFFAOYSA-N	-1	3	343.299	1.698	20	5		EDBDHM
CO[C@H]1C[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C12CCC2	ZINC000416569888	447651387	/nfs/dbraw/zinc/65/13/87/447651387.db2.gz	YXUFPYQOYKKLLR-STQMWFEESA-N	-1	3	326.374	1.831	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2cc(OC)ccc2[N+](=O)[O-])n[n-]1	ZINC000539782961	448620040	/nfs/dbraw/zinc/62/00/40/448620040.db2.gz	LIMRZGOWJITNMV-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2cc(OC)ccc2[N+](=O)[O-])[n-]n1	ZINC000539782961	448620041	/nfs/dbraw/zinc/62/00/41/448620041.db2.gz	LIMRZGOWJITNMV-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1CSC[C@H]1C	ZINC000586773092	448807837	/nfs/dbraw/zinc/80/78/37/448807837.db2.gz	ACHAANONTOKNOS-BDAKNGLRSA-N	-1	3	332.403	1.633	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1c[nH]nc1C	ZINC000588112216	448873485	/nfs/dbraw/zinc/87/34/85/448873485.db2.gz	GWOPLEFJYZKSHY-UHFFFAOYSA-N	-1	3	326.334	1.113	20	5		EDBDHM
CN1C[C@H]2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3[O-])[C@@H]2C1	ZINC000592802344	448996534	/nfs/dbraw/zinc/99/65/34/448996534.db2.gz	XFLNGZKYAUUFGI-PRHODGIISA-N	-1	3	325.752	1.730	20	5		EDBDHM
C/C=C\C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(=O)OCC	ZINC000593578463	449086234	/nfs/dbraw/zinc/08/62/34/449086234.db2.gz	SYRAOIIPHDHUMV-USEMIUTHSA-N	-1	3	343.361	1.166	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC[C@@]2(O)CCOC2)c1[N+](=O)[O-]	ZINC000593638192	449123824	/nfs/dbraw/zinc/12/38/24/449123824.db2.gz	ZEXSERHRYNWXQB-CQSZACIVSA-N	-1	3	344.389	1.031	20	5		EDBDHM
COC(=O)[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000590760585	449279271	/nfs/dbraw/zinc/27/92/71/449279271.db2.gz	CUWJXWKJGKIRLV-MNOVXSKESA-N	-1	3	342.373	1.523	20	5		EDBDHM
CSC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCOCC1	ZINC000593554681	449345529	/nfs/dbraw/zinc/34/55/29/449345529.db2.gz	DUCLMPGBTJWMOC-UHFFFAOYSA-N	-1	3	347.418	1.180	20	5		EDBDHM
CCOc1cc(N2CCC[C@H]2c2nc(=N)n(C)[n-]2)ccc1[N+](=O)[O-]	ZINC000596253088	449441037	/nfs/dbraw/zinc/44/10/37/449441037.db2.gz	WDYAZXUMKVVVGG-LBPRGKRZSA-N	-1	3	332.364	1.876	20	5		EDBDHM
C[C@H](CN1CCC[C@@H](C)C1)[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594770452	449683490	/nfs/dbraw/zinc/68/34/90/449683490.db2.gz	HHYGBXYJNPHKHH-VXGBXAGGSA-N	-1	3	342.421	1.389	20	5		EDBDHM
CC(C)(C)N1CC[C@@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000594790806	449700579	/nfs/dbraw/zinc/70/05/79/449700579.db2.gz	XMBMKBMKOCTHSG-SNVBAGLBSA-N	-1	3	328.394	1.141	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](CO)C2CCC2)c([N+](=O)[O-])c1	ZINC000594802683	449715193	/nfs/dbraw/zinc/71/51/93/449715193.db2.gz	YUTRGHREOADMRT-NSHDSACASA-N	-1	3	330.362	1.043	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C/C=C/CO)c(C(F)(F)F)c1	ZINC000594820397	449729941	/nfs/dbraw/zinc/72/99/41/449729941.db2.gz	UWUHDLDQIVNPDV-OWOJBTEDSA-N	-1	3	340.279	1.440	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2C[C@H](O)C23CCC3)c(F)c1	ZINC000594865275	449778930	/nfs/dbraw/zinc/77/89/30/449778930.db2.gz	NWFRLTNBCQELEZ-RYUDHWBXSA-N	-1	3	330.337	1.316	20	5		EDBDHM
COC(=O)[C@H]1CN(c2cc[n-]c(=O)c2[N+](=O)[O-])Cc2ccccc21	ZINC000599184158	449785025	/nfs/dbraw/zinc/78/50/25/449785025.db2.gz	IRXUEUAKMPVGQT-LBPRGKRZSA-N	-1	3	329.312	1.972	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](CO)CC(C)C	ZINC000594840665	449748941	/nfs/dbraw/zinc/74/89/41/449748941.db2.gz	MBBHFWDWXFDSEF-JTQLQIEISA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H](C)CN(C)C(C)C)c([N+](=O)[O-])s1	ZINC000601415447	449932339	/nfs/dbraw/zinc/93/23/39/449932339.db2.gz	GSKGZZUAVXUXRW-SECBINFHSA-N	-1	3	335.451	1.972	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CC23CCOCC3)c(F)cc1[N+](=O)[O-]	ZINC000601428787	449949318	/nfs/dbraw/zinc/94/93/18/449949318.db2.gz	CYXSCXRHNQMZPU-ZDUSSCGKSA-N	-1	3	344.364	1.890	20	5		EDBDHM
COc1ccc([N-]C(=O)c2cn(C[C@@H]3CCOC3)nn2)c([N+](=O)[O-])c1	ZINC000599790550	450219096	/nfs/dbraw/zinc/21/90/96/450219096.db2.gz	GRXAMBDSHODCOS-JTQLQIEISA-N	-1	3	347.331	1.484	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)[n-]1	ZINC000619448050	450476372	/nfs/dbraw/zinc/47/63/72/450476372.db2.gz	ACZYEBBLXPJQJG-UHFFFAOYSA-N	-1	3	348.271	1.476	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c[n-]1	ZINC000619448050	450476374	/nfs/dbraw/zinc/47/63/74/450476374.db2.gz	ACZYEBBLXPJQJG-UHFFFAOYSA-N	-1	3	348.271	1.476	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](C)c1cnn(C)c1	ZINC000619486587	450487839	/nfs/dbraw/zinc/48/78/39/450487839.db2.gz	HAZHDMYKIFESNA-SECBINFHSA-N	-1	3	340.361	1.376	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1cc(C)ncn1	ZINC000619493398	450490428	/nfs/dbraw/zinc/49/04/28/450490428.db2.gz	DVSSNCKCAFHECO-UHFFFAOYSA-N	-1	3	338.345	1.180	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](C)[C@H]1CCCCO1	ZINC000619495423	450490917	/nfs/dbraw/zinc/49/09/17/450490917.db2.gz	RQFJCKJZAODQGQ-ZYHUDNBSSA-N	-1	3	344.389	1.839	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)C1(CO)CC1	ZINC000594825827	486637310	/nfs/dbraw/zinc/63/73/10/486637310.db2.gz	CGCOSMRTWXXQRW-SECBINFHSA-N	-1	3	330.362	1.043	20	5		EDBDHM
O=[N+]([O-])c1ccc([O-])c(CNCc2ccnc(N3CCOCC3)c2)c1	ZINC000725847157	578288726	/nfs/dbraw/zinc/28/87/26/578288726.db2.gz	FGNPUQDEAXJYCP-UHFFFAOYSA-N	-1	3	344.371	1.822	20	5		EDBDHM
O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1cc2c(cc1[O-])OCO2	ZINC000731838978	578681173	/nfs/dbraw/zinc/68/11/73/578681173.db2.gz	RUVCBAQIIPTQKU-UHFFFAOYSA-N	-1	3	346.295	1.838	20	5		EDBDHM
O=C(O[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1cncc([O-])c1	ZINC000732394744	578709319	/nfs/dbraw/zinc/70/93/19/578709319.db2.gz	TUOATVYPHOUICM-CQSZACIVSA-N	-1	3	343.295	1.658	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCNc1ncccn1	ZINC000736330532	578979180	/nfs/dbraw/zinc/97/91/80/578979180.db2.gz	XERCEOQGDKFIAD-UHFFFAOYSA-N	-1	3	337.361	1.084	20	5		EDBDHM
O=C(CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[N-]OC[C@H]1CCOC1	ZINC000788123009	579250437	/nfs/dbraw/zinc/25/04/37/579250437.db2.gz	PPSPAJBLVYGINZ-JTQLQIEISA-N	-1	3	339.304	1.520	20	5		EDBDHM
O=[N+]([O-])c1ccc[n-]c1=NNS(=O)(=O)c1ccc2c(c1)COC2	ZINC000759169992	580000095	/nfs/dbraw/zinc/00/00/95/580000095.db2.gz	WCMQVQLIQLQIOT-UHFFFAOYSA-N	-1	3	336.329	1.325	20	5		EDBDHM
Cc1sc2ncn([N-]C(=O)c3ccc([N+](=O)[O-])n3C)c(=O)c2c1C	ZINC000762060975	580066165	/nfs/dbraw/zinc/06/61/65/580066165.db2.gz	WYGAEESAAHSLSG-UHFFFAOYSA-N	-1	3	347.356	1.705	20	5		EDBDHM
C[C@@H](Sc1n[n-]c(CO)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000767083551	580181248	/nfs/dbraw/zinc/18/12/48/580181248.db2.gz	QCMVDUKHTCVTMZ-ZCFIWIBFSA-N	-1	3	341.324	1.464	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@H](O)c1ccccn1	ZINC000775593091	580394638	/nfs/dbraw/zinc/39/46/38/580394638.db2.gz	IXQQLSTXJHQRTB-ZDUSSCGKSA-N	-1	3	337.357	1.310	20	5		EDBDHM
CCCNC(=O)C[N-]c1c([N+](=O)[O-])cc(CO)c(C)c1[N+](=O)[O-]	ZINC000796454065	580954247	/nfs/dbraw/zinc/95/42/47/580954247.db2.gz	DFHSAWWISYPTTN-UHFFFAOYSA-N	-1	3	326.309	1.242	20	5		EDBDHM
Cc1c([N-]C(=O)c2ccnc3c2nnn3C)c(F)ccc1[N+](=O)[O-]	ZINC000800974883	581063317	/nfs/dbraw/zinc/06/33/17/581063317.db2.gz	TXVODUIWNGXHQO-UHFFFAOYSA-N	-1	3	330.279	1.971	20	5		EDBDHM
COc1c([O-])ccc(CN2CCOC3(CCOCC3)C2)c1[N+](=O)[O-]	ZINC000892216423	590868856	/nfs/dbraw/zinc/86/88/56/590868856.db2.gz	RUNJPFZCVGKOTO-UHFFFAOYSA-N	-1	3	338.360	1.690	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2COC[C@H]2C2CC2)c1[N+](=O)[O-]	ZINC000908412218	592486100	/nfs/dbraw/zinc/48/61/00/592486100.db2.gz	VAHXQWXZMDUXDC-QWHCGFSZSA-N	-1	3	340.401	1.915	20	5		EDBDHM
Cc1cc(N[C@H](C)[C@@H]2CN(C)CCN2C)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000910364581	592844909	/nfs/dbraw/zinc/84/49/09/592844909.db2.gz	SGUBFJQLRGZFPB-RISCZKNCSA-N	-1	3	336.392	1.648	20	5		EDBDHM
CC1(C(=O)Nc2cc(-c3nnn[n-]3)cc([N+](=O)[O-])c2Cl)COC1	ZINC000824784492	594074254	/nfs/dbraw/zinc/07/42/54/594074254.db2.gz	VEFWDYOIXFCFGE-UHFFFAOYSA-N	-1	3	338.711	1.403	20	5		EDBDHM
CC1(C(=O)Nc2cc(-c3nn[n-]n3)cc([N+](=O)[O-])c2Cl)COC1	ZINC000824784492	594074255	/nfs/dbraw/zinc/07/42/55/594074255.db2.gz	VEFWDYOIXFCFGE-UHFFFAOYSA-N	-1	3	338.711	1.403	20	5		EDBDHM
Cn1cc(-c2nnn[n-]2)cc1C(=O)OCc1ccc([N+](=O)[O-])cc1F	ZINC000822665749	594081892	/nfs/dbraw/zinc/08/18/92/594081892.db2.gz	XLIGXGHUBWRIBN-UHFFFAOYSA-N	-1	3	346.278	1.610	20	5		EDBDHM
Cn1cc(-c2nn[n-]n2)cc1C(=O)OCc1ccc([N+](=O)[O-])cc1F	ZINC000822665749	594081894	/nfs/dbraw/zinc/08/18/94/594081894.db2.gz	XLIGXGHUBWRIBN-UHFFFAOYSA-N	-1	3	346.278	1.610	20	5		EDBDHM
O=C([O-])N1CCC[C@@H]1C1CCN(CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000832003743	594718489	/nfs/dbraw/zinc/71/84/89/594718489.db2.gz	AWCUFGVLBXWOHI-CQSZACIVSA-N	-1	3	337.380	1.646	20	5		EDBDHM
CC(C)(C)[C@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(=O)[O-]	ZINC000833426042	594846075	/nfs/dbraw/zinc/84/60/75/594846075.db2.gz	MSDWEJXZZHDXDA-GFCCVEGCSA-N	-1	3	344.389	1.457	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CC(=O)OCc1cc(=O)[n-]c(C2CC2)n1	ZINC000837476866	595120150	/nfs/dbraw/zinc/12/01/50/595120150.db2.gz	RGWLZWLMBFRUCT-UHFFFAOYSA-N	-1	3	333.304	1.216	20	5		EDBDHM
C[C@H](Cn1ccnc1)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848580853	595408059	/nfs/dbraw/zinc/40/80/59/595408059.db2.gz	GWFCCIPDKUDGPF-SNVBAGLBSA-N	-1	3	340.286	1.968	20	5		EDBDHM
O=C([N-]C[C@@H]1COCCO1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848580837	595408465	/nfs/dbraw/zinc/40/84/65/595408465.db2.gz	GDNMJSOSUHYNDA-LLVKDONJSA-N	-1	3	332.259	1.098	20	5		EDBDHM
COC(=O)C(C)(C)C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848585895	595410402	/nfs/dbraw/zinc/41/04/02/595410402.db2.gz	UDDQPUQPJCSEIF-UHFFFAOYSA-N	-1	3	346.286	1.882	20	5		EDBDHM
C[C@@H]1OCC[C@@]1(O)C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848589410	595411006	/nfs/dbraw/zinc/41/10/06/595411006.db2.gz	FHZMUBWJWVTOFS-TVQRCGJNSA-N	-1	3	346.286	1.223	20	5		EDBDHM
CC(=Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCCc1cc(=O)[nH][n-]1	ZINC000854485920	596095124	/nfs/dbraw/zinc/09/51/24/596095124.db2.gz	FRDPCKQPCICCTD-PKNBQFBNSA-N	-1	3	330.344	1.770	20	5		EDBDHM
C[C@@H]1[C@H]([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CCS1(=O)=O	ZINC000862990004	596478619	/nfs/dbraw/zinc/47/86/19/596478619.db2.gz	ABCSQRZBTSESMV-LDYMZIIASA-N	-1	3	348.327	1.378	20	5		EDBDHM
CCn1cc([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)ccc1=O	ZINC000120032389	596879707	/nfs/dbraw/zinc/87/97/07/596879707.db2.gz	NSEGXVCQUBKWEU-UHFFFAOYSA-N	-1	3	329.359	1.639	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCC2Cc3ccccc3C2)c(-c2nnn[n-]2)c1	ZINC000738374983	599232021	/nfs/dbraw/zinc/23/20/21/599232021.db2.gz	WSELBLSHDXYCRZ-UHFFFAOYSA-N	-1	3	337.343	1.997	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCC2Cc3ccccc3C2)c(-c2nn[n-]n2)c1	ZINC000738374983	599232024	/nfs/dbraw/zinc/23/20/24/599232024.db2.gz	WSELBLSHDXYCRZ-UHFFFAOYSA-N	-1	3	337.343	1.997	20	5		EDBDHM
O=[N+]([O-])c1ccc[nH]c1=N[N-]S(=O)(=O)c1ccc(Cl)nc1	ZINC000125575867	596978306	/nfs/dbraw/zinc/97/83/06/596978306.db2.gz	FCOIOCNAZJDEHT-UHFFFAOYSA-N	-1	3	329.725	1.344	20	5		EDBDHM
O=[N+]([O-])c1ccc[n-]c1=NNS(=O)(=O)c1ccc(Cl)nc1	ZINC000125575867	596978309	/nfs/dbraw/zinc/97/83/09/596978309.db2.gz	FCOIOCNAZJDEHT-UHFFFAOYSA-N	-1	3	329.725	1.344	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC(c3cn[nH]c3)CC2)c(-c2nnn[n-]2)c1	ZINC000738369344	598501057	/nfs/dbraw/zinc/50/10/57/598501057.db2.gz	LKSXIAGVZPLKIA-UHFFFAOYSA-N	-1	3	341.335	1.277	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC(c3cn[nH]c3)CC2)c(-c2nn[n-]n2)c1	ZINC000738369344	598501059	/nfs/dbraw/zinc/50/10/59/598501059.db2.gz	LKSXIAGVZPLKIA-UHFFFAOYSA-N	-1	3	341.335	1.277	20	5		EDBDHM
C[C@]1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCCCO1	ZINC000921676323	706481134	/nfs/dbraw/zinc/48/11/34/706481134.db2.gz	SYPNJAWGKVWCFJ-CYBMUJFWSA-N	-1	3	332.353	1.971	20	5		EDBDHM
O=C([N-]c1nnc2n1CCCC2)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000272528966	304021497	/nfs/dbraw/zinc/02/14/97/304021497.db2.gz	MQPOFRDPNOYQKM-UHFFFAOYSA-N	-1	3	345.315	1.546	20	5		EDBDHM
CC[C@@H](CCO)C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000094960471	138296013	/nfs/dbraw/zinc/29/60/13/138296013.db2.gz	ZBRJCWULHBXNHX-VIFPVBQESA-N	-1	3	336.797	1.935	20	5		EDBDHM
C[C@H]1CCNC(=O)[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000195479169	290598773	/nfs/dbraw/zinc/59/87/73/290598773.db2.gz	GTWRYGXDGPIIRX-WRWORJQWSA-N	-1	3	347.780	1.051	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H]2CC[C@H](O)C2)c1C	ZINC000188354431	138839372	/nfs/dbraw/zinc/83/93/72/138839372.db2.gz	UROUMUYEGBFHIT-RYUDHWBXSA-N	-1	3	328.390	1.651	20	5		EDBDHM
COc1c(C(=O)[N-]c2cc3c(cc2[N+](=O)[O-])OCCCO3)cnn1C	ZINC000414755965	304137534	/nfs/dbraw/zinc/13/75/34/304137534.db2.gz	PWCXUYUHAOZVRV-UHFFFAOYSA-N	-1	3	348.315	1.751	20	5		EDBDHM
CNC(=O)C[C@@H](C)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000451957063	305373994	/nfs/dbraw/zinc/37/39/94/305373994.db2.gz	OTTCHRBQIHKRKT-SECBINFHSA-N	-1	3	329.378	1.015	20	5		EDBDHM
O=C(Nc1cnn(Cc2ccncc2)c1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000195225057	139010569	/nfs/dbraw/zinc/01/05/69/139010569.db2.gz	FCCHRHQMCRXJGJ-UHFFFAOYSA-N	-1	3	340.299	1.588	20	5		EDBDHM
CSC[C@](C)(O)C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000230848186	139024655	/nfs/dbraw/zinc/02/46/55/139024655.db2.gz	GOSAENAWPUCVKT-GFCCVEGCSA-N	-1	3	334.419	1.128	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H](CC(C)C)OC	ZINC000416652867	251096670	/nfs/dbraw/zinc/09/66/70/251096670.db2.gz	SULOHOYVXIAWSE-GFCCVEGCSA-N	-1	3	346.405	1.943	20	5		EDBDHM
CC(=O)c1cccc(NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)c1[O-]	ZINC000570478913	306544168	/nfs/dbraw/zinc/54/41/68/306544168.db2.gz	WGUQQWAKZSWODD-UHFFFAOYSA-N	-1	3	331.284	1.303	20	5		EDBDHM
CNC(=O)[C@H]1CCC[C@@H]1[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000345510815	143100148	/nfs/dbraw/zinc/10/01/48/143100148.db2.gz	NUPKZNSSTSLXNF-QWRGUYRKSA-N	-1	3	341.389	1.096	20	5		EDBDHM
COC(=O)[C@H]([N-]S(=O)(=O)CCc1ccccc1[N+](=O)[O-])C(C)C	ZINC000347021241	143272531	/nfs/dbraw/zinc/27/25/31/143272531.db2.gz	ZFXGNNYFYUDSCY-CYBMUJFWSA-N	-1	3	344.389	1.254	20	5		EDBDHM
CO[C@@H]1CCC[C@@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000341192163	143885633	/nfs/dbraw/zinc/88/56/33/143885633.db2.gz	OHSUWUKIXOESRA-BXKDBHETSA-N	-1	3	332.353	1.827	20	5		EDBDHM
COCC[C@H](C)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000416576816	304333480	/nfs/dbraw/zinc/33/34/80/304333480.db2.gz	DXUHSKGNRWHHDI-JTQLQIEISA-N	-1	3	332.378	1.554	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@@H]2C[C@@H](C)O[C@@H]2C)c([N+](=O)[O-])c1	ZINC000416610550	304337760	/nfs/dbraw/zinc/33/77/60/304337760.db2.gz	WWGBRFVPVPPDJB-UTUOFQBUSA-N	-1	3	328.390	1.995	20	5		EDBDHM
COC[C@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])OC	ZINC000358500458	151397240	/nfs/dbraw/zinc/39/72/40/151397240.db2.gz	MMEFRWZEJZTRDI-VIFPVBQESA-N	-1	3	338.769	1.188	20	5		EDBDHM
CSCC[C@H](CO)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000359987477	151878137	/nfs/dbraw/zinc/87/81/37/151878137.db2.gz	NYMNOQAPXCSKQQ-LLVKDONJSA-N	-1	3	348.446	1.604	20	5		EDBDHM
Cc1cccc(C(=O)NCc2nnc(C(F)(F)F)[n-]2)c1[N+](=O)[O-]	ZINC000360841666	152225893	/nfs/dbraw/zinc/22/58/93/152225893.db2.gz	SRZVLZHLNVTILN-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1cccc(C(=O)NCc2n[n-]c(C(F)(F)F)n2)c1[N+](=O)[O-]	ZINC000360841666	152225894	/nfs/dbraw/zinc/22/58/94/152225894.db2.gz	SRZVLZHLNVTILN-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1cccc(C(=O)NCc2nc(C(F)(F)F)n[n-]2)c1[N+](=O)[O-]	ZINC000360841666	152225895	/nfs/dbraw/zinc/22/58/95/152225895.db2.gz	SRZVLZHLNVTILN-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1cccc(N(CCC(N)=O)C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000361984110	152575689	/nfs/dbraw/zinc/57/56/89/152575689.db2.gz	RXHAUTWUZCZSHH-UHFFFAOYSA-N	-1	3	344.327	1.526	20	5		EDBDHM
Cc1cnn([C@@H]2CCN(C(=O)c3cc(C)[n-]c(=O)c3[N+](=O)[O-])C2)c1	ZINC000367838570	154293317	/nfs/dbraw/zinc/29/33/17/154293317.db2.gz	FXKWTSVCKJEBRY-LLVKDONJSA-N	-1	3	331.332	1.596	20	5		EDBDHM
O=C(Nc1cccc(-n2ccnn2)c1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000120353418	287360576	/nfs/dbraw/zinc/36/05/76/287360576.db2.gz	PLTDJLAAUYMOOI-UHFFFAOYSA-N	-1	3	326.272	1.528	20	5		EDBDHM
C[C@@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1	ZINC000123674605	222315019	/nfs/dbraw/zinc/31/50/19/222315019.db2.gz	QPDGQODYJMXIBU-ZCFIWIBFSA-N	-1	3	339.167	1.016	20	5		EDBDHM
CN(C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[n-]c1=O)c1cccs1	ZINC000027678044	267379838	/nfs/dbraw/zinc/37/98/38/267379838.db2.gz	RXFVLEUYJPXOKI-NSHDSACASA-N	-1	3	336.373	1.377	20	5		EDBDHM
COCC[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC	ZINC000273608585	268064010	/nfs/dbraw/zinc/06/40/10/268064010.db2.gz	SRQHZYBUNBHUCJ-VIFPVBQESA-N	-1	3	346.361	1.085	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCCC[C@H]1O	ZINC000274736983	268194489	/nfs/dbraw/zinc/19/44/89/268194489.db2.gz	MHAZQMHYBNLGQO-GHMZBOCLSA-N	-1	3	330.362	1.185	20	5		EDBDHM
COc1cc(C(=O)[N-]c2cc3c(cc2[N+](=O)[O-])OCCCO3)nn1C	ZINC000274922256	268239288	/nfs/dbraw/zinc/23/92/88/268239288.db2.gz	XZSMLDSOJWPIND-UHFFFAOYSA-N	-1	3	348.315	1.751	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CC2CCOCC2)cc1[N+](=O)[O-]	ZINC000275050994	268271729	/nfs/dbraw/zinc/27/17/29/268271729.db2.gz	GQIANJSHRSLHJR-UHFFFAOYSA-N	-1	3	348.352	1.447	20	5		EDBDHM
CC[C@@](C)(O)C[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	ZINC000275056829	268272021	/nfs/dbraw/zinc/27/20/21/268272021.db2.gz	ISGUBNSXDUUWFX-GFCCVEGCSA-N	-1	3	336.341	1.182	20	5		EDBDHM
CC[C@H](COC)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC	ZINC000276229017	268409182	/nfs/dbraw/zinc/40/91/82/268409182.db2.gz	OKCKFMUWJXVVNN-SECBINFHSA-N	-1	3	346.361	1.085	20	5		EDBDHM
CCOC(=O)[C@H](C)C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276917051	273169028	/nfs/dbraw/zinc/16/90/28/273169028.db2.gz	YBRNLEOMFWRXTC-LLVKDONJSA-N	-1	3	344.389	1.689	20	5		EDBDHM
Cc1nnsc1C[N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000292109528	289263410	/nfs/dbraw/zinc/26/34/10/289263410.db2.gz	VJXIBOWIUUOJNU-UHFFFAOYSA-N	-1	3	328.375	1.374	20	5		EDBDHM
CCC1(C)CN(C(=O)C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000292314005	289314240	/nfs/dbraw/zinc/31/42/40/289314240.db2.gz	ANZRBOQNGJRLKQ-UHFFFAOYSA-N	-1	3	341.389	1.132	20	5		EDBDHM
CC1=C([O-])N(C)S(=O)(=O)N1Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000295396548	303213408	/nfs/dbraw/zinc/21/34/08/303213408.db2.gz	RLBZUCVMROXKDG-SSDOTTSWSA-N	-1	3	333.753	1.156	20	5		EDBDHM
CC[C@H]1C[C@@H]([N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])CCO1	ZINC000420722820	304776304	/nfs/dbraw/zinc/77/63/04/304776304.db2.gz	JHGOHAXWMXNKGA-QWRGUYRKSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CC[C@@H](C)CNC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000421922480	304819949	/nfs/dbraw/zinc/81/99/49/304819949.db2.gz	UJKZXSIDRUGQPA-SNVBAGLBSA-N	-1	3	329.378	1.035	20	5		EDBDHM
CO[C@H]1COCC[C@H]1C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000451781042	305368655	/nfs/dbraw/zinc/36/86/55/305368655.db2.gz	XDGDDVCQBONQGH-AAEUAGOBSA-N	-1	3	344.389	1.233	20	5		EDBDHM
Cc1cc(C(=O)N2CCC[C@H]2c2nc(=N)n(C)[n-]2)ccc1[N+](=O)[O-]	ZINC000549744462	306148345	/nfs/dbraw/zinc/14/83/45/306148345.db2.gz	VDFPBEARCPXXJL-LBPRGKRZSA-N	-1	3	330.348	1.422	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCN1CCC[C@@H](C)C1	ZINC000046035189	441070762	/nfs/dbraw/zinc/07/07/62/441070762.db2.gz	JTPSMUDVCFREJI-GFCCVEGCSA-N	-1	3	341.433	1.913	20	5		EDBDHM
Cc1nc(C)c(CC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(=O)[n-]1	ZINC000057283055	441105186	/nfs/dbraw/zinc/10/51/86/441105186.db2.gz	XHGNDFYKFCJXJM-VIFPVBQESA-N	-1	3	330.344	1.715	20	5		EDBDHM
CN1CCC([N-]S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1	ZINC000114735650	441679923	/nfs/dbraw/zinc/67/99/23/441679923.db2.gz	AUNMFVPGJBMJNN-UHFFFAOYSA-N	-1	3	333.797	1.621	20	5		EDBDHM
COC(=O)C(C)(C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000056041287	441683579	/nfs/dbraw/zinc/68/35/79/441683579.db2.gz	PEWKOVLTEKIGIC-UHFFFAOYSA-N	-1	3	336.753	1.478	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H](CO)c2ccccc2)c([N+](=O)[O-])c1	ZINC000158464708	441739145	/nfs/dbraw/zinc/73/91/45/441739145.db2.gz	DGDLXUDVLJWBNV-ZDUSSCGKSA-N	-1	3	336.369	1.915	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CCN(CC3CC3)C2)cc1[N+](=O)[O-]	ZINC000123876919	441902097	/nfs/dbraw/zinc/90/20/97/441902097.db2.gz	STGIVXVEWSTNOU-NSHDSACASA-N	-1	3	345.446	1.727	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H]1CCO[C@@H](C2CC2)C1	ZINC000162658812	442112845	/nfs/dbraw/zinc/11/28/45/442112845.db2.gz	WPLBAOIUYACVIH-WCQYABFASA-N	-1	3	326.374	1.831	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@H]3OCC[C@@H]32)c(F)c1	ZINC000129297892	442310034	/nfs/dbraw/zinc/31/00/34/442310034.db2.gz	CZNRKGFUAFSFGU-RAIGVLPGSA-N	-1	3	344.364	1.970	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]C[C@H]2CCCCO2)cc1[N+](=O)[O-]	ZINC000133730939	442432067	/nfs/dbraw/zinc/43/20/67/442432067.db2.gz	CEARICHAQQWZFR-SNVBAGLBSA-N	-1	3	332.353	1.890	20	5		EDBDHM
CC(C)(CCO)C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000178829798	442497502	/nfs/dbraw/zinc/49/75/02/442497502.db2.gz	PASJUKROXREHIL-UHFFFAOYSA-N	-1	3	336.797	1.935	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CCCC[C@H]1CO	ZINC000178916589	442525307	/nfs/dbraw/zinc/52/53/07/442525307.db2.gz	SVXRNJICOKUBPT-RYUDHWBXSA-N	-1	3	328.390	1.733	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@H]2CCO)c(F)c1	ZINC000188933307	442844846	/nfs/dbraw/zinc/84/48/46/442844846.db2.gz	HAQBUXDCHPHRAF-JOYOIKCWSA-N	-1	3	332.353	1.563	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2C(=O)NCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000195476503	443023260	/nfs/dbraw/zinc/02/32/60/443023260.db2.gz	UAWBQFWWMIYQGY-GZMMTYOYSA-N	-1	3	341.389	1.015	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-][C@H]1c2ccccc2C[C@H]1O	ZINC000184538337	443035970	/nfs/dbraw/zinc/03/59/70/443035970.db2.gz	UPOCQLDSHGIOKW-CVEARBPZSA-N	-1	3	348.380	1.673	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCCC[C@@H]2OC)c([N+](=O)[O-])c1	ZINC000266155922	443038136	/nfs/dbraw/zinc/03/81/36/443038136.db2.gz	GLIBUNGVUSIGQN-YPMHNXCESA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)[C@H]2CCOC2)cc1C	ZINC000266217142	443061793	/nfs/dbraw/zinc/06/17/93/443061793.db2.gz	RKAYWFANJYBXOY-NEPJUHHUSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Cc1cccc(F)c1S(=O)(=O)[N-]CCn1cc([N+](=O)[O-])cn1	ZINC000185281147	443174975	/nfs/dbraw/zinc/17/49/75/443174975.db2.gz	HEBZXSDCVPTPSA-UHFFFAOYSA-N	-1	3	328.325	1.217	20	5		EDBDHM
CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1[n-]nnc1C(N)=O	ZINC000410857718	319161513	/nfs/dbraw/zinc/16/15/13/319161513.db2.gz	ITAWDEAPFZXGTD-VIFPVBQESA-N	-1	3	332.320	1.019	20	5		EDBDHM
CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nn[n-]c1C(N)=O	ZINC000410857718	319161515	/nfs/dbraw/zinc/16/15/15/319161515.db2.gz	ITAWDEAPFZXGTD-VIFPVBQESA-N	-1	3	332.320	1.019	20	5		EDBDHM
CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1n[n-]nc1C(N)=O	ZINC000410857718	319161518	/nfs/dbraw/zinc/16/15/18/319161518.db2.gz	ITAWDEAPFZXGTD-VIFPVBQESA-N	-1	3	332.320	1.019	20	5		EDBDHM
COC1([C@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCC1	ZINC000416623676	319450657	/nfs/dbraw/zinc/45/06/57/319450657.db2.gz	YNOXFTMPSURCEJ-VIFPVBQESA-N	-1	3	332.353	1.970	20	5		EDBDHM
C[C@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br	ZINC000269465982	443315447	/nfs/dbraw/zinc/31/54/47/443315447.db2.gz	JAZKHLLSRRAAJN-LURJTMIESA-N	-1	3	339.167	1.016	20	5		EDBDHM
O=C([N-]Cc1nncn1C1CC1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000272521989	443349623	/nfs/dbraw/zinc/34/96/23/443349623.db2.gz	LNQABSVZFJJNNL-UHFFFAOYSA-N	-1	3	337.286	1.929	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])[C@H]1CCCO1	ZINC000278736803	443419840	/nfs/dbraw/zinc/41/98/40/443419840.db2.gz	MKSSXACLUDOYKW-CMPLNLGQSA-N	-1	3	330.362	1.067	20	5		EDBDHM
CNc1ccc(C(=O)N=c2cc(-c3cccc([N+](=O)[O-])c3)[n-][nH]2)cn1	ZINC000431780788	319946755	/nfs/dbraw/zinc/94/67/55/319946755.db2.gz	HFIKEEZBDKWGGN-UHFFFAOYSA-N	-1	3	338.327	1.518	20	5		EDBDHM
CCC(O)(CC)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000276167395	443660551	/nfs/dbraw/zinc/66/05/51/443660551.db2.gz	CFHDMHXSDRNEIB-UHFFFAOYSA-N	-1	3	346.405	1.823	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccc([O-])cc2CCOC)n1	ZINC000444601687	320128788	/nfs/dbraw/zinc/12/87/88/320128788.db2.gz	ZBYKSNFPGCBESR-UHFFFAOYSA-N	-1	3	334.332	1.958	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])[C@@H](O)C(F)F	ZINC000451716479	320238551	/nfs/dbraw/zinc/23/85/51/320238551.db2.gz	RWLKHUJDXJEMHB-LDYMZIIASA-N	-1	3	338.332	1.586	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](CO)C(C)(C)C	ZINC000276771402	443820940	/nfs/dbraw/zinc/82/09/40/443820940.db2.gz	HFHMKBIWWPGOHG-LBPRGKRZSA-N	-1	3	332.378	1.289	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2CC[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000276793617	443829406	/nfs/dbraw/zinc/82/94/06/443829406.db2.gz	YFHZUNLQKXQGIT-NXEZZACHSA-N	-1	3	330.362	1.043	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@](C)(O)C2CC2)cc1C	ZINC000319463132	444324220	/nfs/dbraw/zinc/32/42/20/444324220.db2.gz	QDTJAUUKIFSHHT-CQSZACIVSA-N	-1	3	328.390	1.651	20	5		EDBDHM
CCN(c1ccc([O-])cc1)S(=O)(=O)c1cn(CC)nc1[N+](=O)[O-]	ZINC000337794351	444411422	/nfs/dbraw/zinc/41/14/22/444411422.db2.gz	CHVWSBJBKISTEW-UHFFFAOYSA-N	-1	3	340.361	1.732	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H](CO)CC2CCCC2)c(F)c1	ZINC000338029958	444491666	/nfs/dbraw/zinc/49/16/66/444491666.db2.gz	SBAKGMOLTFMPKU-NSHDSACASA-N	-1	3	346.380	1.953	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2C(=O)Cc2ccccc2[N+](=O)[O-])nc1=N	ZINC000581442700	322178845	/nfs/dbraw/zinc/17/88/45/322178845.db2.gz	QYSSDHPFPHWKQW-LBPRGKRZSA-N	-1	3	330.348	1.042	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]c2cc(C)c(=O)n(C)c2)cc1[N+](=O)[O-]	ZINC000342379592	444666380	/nfs/dbraw/zinc/66/63/80/444666380.db2.gz	HNFPOLZZNRQQQO-UHFFFAOYSA-N	-1	3	343.386	1.773	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CC(=O)N(C(C)C)C2)cc1[N+](=O)[O-]	ZINC000343465670	445228276	/nfs/dbraw/zinc/22/82/76/445228276.db2.gz	JACZSMOHMKTYJJ-VIFPVBQESA-N	-1	3	347.418	1.252	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@]2(C)CCOC2)c([N+](=O)[O-])c1	ZINC000354497324	445263573	/nfs/dbraw/zinc/26/35/73/445263573.db2.gz	PKXDWHIBLRVODY-ZDUSSCGKSA-N	-1	3	330.362	1.308	20	5		EDBDHM
NC(=O)c1ccc(NC(=O)c2n[n-]c3ccc([N+](=O)[O-])cc32)c(F)c1	ZINC000343621428	445266311	/nfs/dbraw/zinc/26/63/11/445266311.db2.gz	UYNAFSSBGCZHLH-UHFFFAOYSA-N	-1	3	343.274	1.961	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C(C)(C)CF	ZINC000351744499	445304525	/nfs/dbraw/zinc/30/45/25/445304525.db2.gz	YLQUYGNNUHFFER-UHFFFAOYSA-N	-1	3	334.325	1.408	20	5		EDBDHM
COc1ccc([N-]C(=O)c2c(OC)ncnc2OC)cc1[N+](=O)[O-]	ZINC000360006137	445524089	/nfs/dbraw/zinc/52/40/89/445524089.db2.gz	XAKKNUYNKWAHTJ-UHFFFAOYSA-N	-1	3	334.288	1.663	20	5		EDBDHM
Cc1cc([N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])cn(C)c1=O	ZINC000353779047	445752031	/nfs/dbraw/zinc/75/20/31/445752031.db2.gz	IFJBVOVCSYJHCO-UHFFFAOYSA-N	-1	3	337.357	1.544	20	5		EDBDHM
Cc1n[nH]cc1-c1nnc([N-]C(=O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000364013207	445891739	/nfs/dbraw/zinc/89/17/39/445891739.db2.gz	RDLHNNZYQRQKHU-UHFFFAOYSA-N	-1	3	330.329	2.397	20	5		EDBDHM
CN1CCC[C@@H](N2CCN(C(=O)c3ccc([O-])c([N+](=O)[O-])c3)CC2)C1	ZINC000368320447	446784820	/nfs/dbraw/zinc/78/48/20/446784820.db2.gz	YFRCTGMMRBIZSU-CQSZACIVSA-N	-1	3	348.403	1.152	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC[C@@H](O)C(C)C	ZINC000443248734	447014465	/nfs/dbraw/zinc/01/44/65/447014465.db2.gz	LCWKLWVHCWKVCH-LLVKDONJSA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cn1c(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)nc2c1cccc2F	ZINC000445011021	447155026	/nfs/dbraw/zinc/15/50/26/447155026.db2.gz	UZDOVANOFYFNDF-UHFFFAOYSA-N	-1	3	331.263	1.974	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC(C)(C)C(C)(C)O	ZINC000393552135	447530659	/nfs/dbraw/zinc/53/06/59/447530659.db2.gz	TUJOAKIVXVRWEN-UHFFFAOYSA-N	-1	3	346.405	1.679	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)c2ccn(C)n2)c([N+](=O)[O-])c1	ZINC000416557988	447648354	/nfs/dbraw/zinc/64/83/54/447648354.db2.gz	IGNWAKYLPVWTIJ-VIFPVBQESA-N	-1	3	340.361	1.376	20	5		EDBDHM
C[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)c2nccn21	ZINC000451934515	447789786	/nfs/dbraw/zinc/78/97/86/447789786.db2.gz	CUASCBZPTJJSIU-SFYZADRCSA-N	-1	3	328.375	1.837	20	5		EDBDHM
C[C@@H]1CCCCN1CC[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000525699702	448014002	/nfs/dbraw/zinc/01/40/02/448014002.db2.gz	NWFJWCOTNXZMEM-LLVKDONJSA-N	-1	3	328.394	1.143	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1CS[C@H](C)C1	ZINC000591331923	448326724	/nfs/dbraw/zinc/32/67/24/448326724.db2.gz	XKMSMGHYTHDISC-BDAKNGLRSA-N	-1	3	332.403	1.776	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1(CF)CCC1	ZINC000577949792	448423391	/nfs/dbraw/zinc/42/33/91/448423391.db2.gz	FPCQMALLMFVGJC-UHFFFAOYSA-N	-1	3	346.336	1.552	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1c[nH]c(=O)c(C)c1	ZINC000535233319	448490002	/nfs/dbraw/zinc/49/00/02/448490002.db2.gz	LJORGWJGCWIFKD-UHFFFAOYSA-N	-1	3	339.329	1.813	20	5		EDBDHM
O=[N+]([O-])c1ncccc1S(=O)(=O)[N-]C[C@H]1NCCc2ccccc21	ZINC000566620178	448523165	/nfs/dbraw/zinc/52/31/65/448523165.db2.gz	QQBJSLJXPXUHFS-CYBMUJFWSA-N	-1	3	348.384	1.155	20	5		EDBDHM
COC(=O)c1ccc(S(=O)(=O)[N-]C2(CF)CCC2)cc1[N+](=O)[O-]	ZINC000518175196	448651259	/nfs/dbraw/zinc/65/12/59/448651259.db2.gz	DCJUQCMKXKCZMA-UHFFFAOYSA-N	-1	3	346.336	1.552	20	5		EDBDHM
CC[C@@H](C)C[C@H](CO)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000592081736	448667967	/nfs/dbraw/zinc/66/79/67/448667967.db2.gz	CFRMLNFPHDQFME-ZYHUDNBSSA-N	-1	3	330.406	1.979	20	5		EDBDHM
O=C(NCCCc1cc(=O)[nH][n-]1)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000588875865	448944116	/nfs/dbraw/zinc/94/41/16/448944116.db2.gz	JVJROAIJWMGQAB-UHFFFAOYSA-N	-1	3	345.359	1.555	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1C[N-]c1nnc(C(F)(F)F)o1)OCCO2	ZINC000589596838	449036691	/nfs/dbraw/zinc/03/66/91/449036691.db2.gz	XHSIVFDTHDAREX-UHFFFAOYSA-N	-1	3	346.221	2.380	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCC[C@@H]2CCCCO2)nc1	ZINC000593577157	449084885	/nfs/dbraw/zinc/08/48/85/449084885.db2.gz	BKDAMIHYQBSOAL-LBPRGKRZSA-N	-1	3	329.378	1.617	20	5		EDBDHM
CC(C)OC(=O)CC[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593585288	449091504	/nfs/dbraw/zinc/09/15/04/449091504.db2.gz	DFXDMRLABFWQJQ-JTQLQIEISA-N	-1	3	345.377	1.388	20	5		EDBDHM
CO[C@](C)([C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C1CC1	ZINC000593609860	449107013	/nfs/dbraw/zinc/10/70/13/449107013.db2.gz	YTSQHYZOXBLMDD-NOZJJQNGSA-N	-1	3	329.378	1.472	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C1CCC1	ZINC000611117465	449175341	/nfs/dbraw/zinc/17/53/41/449175341.db2.gz	COUNXWFOBFJDID-VIFPVBQESA-N	-1	3	342.373	1.833	20	5		EDBDHM
CC[C@H](CCO)C[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F	ZINC000590591284	449206225	/nfs/dbraw/zinc/20/62/25/449206225.db2.gz	SOCVPYZAOKMRHY-SNVBAGLBSA-N	-1	3	334.369	1.729	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1[nH][n-]c2cc(=O)ccc1-2	ZINC000590557426	449190097	/nfs/dbraw/zinc/19/00/97/449190097.db2.gz	AHEZEDSDVYMVPC-UHFFFAOYSA-N	-1	3	330.304	1.710	20	5		EDBDHM
CCc1cnc(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)s1	ZINC000593552578	449343091	/nfs/dbraw/zinc/34/30/91/449343091.db2.gz	RXCBIXJDTWFSAF-UHFFFAOYSA-N	-1	3	342.402	1.530	20	5		EDBDHM
NC(=O)C1(c2ccccc2)CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596127693	449377450	/nfs/dbraw/zinc/37/74/50/449377450.db2.gz	CZDHIXNANBRGBZ-UHFFFAOYSA-N	-1	3	342.355	1.719	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)N1CCC(C)CC1	ZINC000593536475	449332544	/nfs/dbraw/zinc/33/25/44/449332544.db2.gz	RFWAKEHHSPFNAL-GFCCVEGCSA-N	-1	3	342.421	1.389	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])N1CCC[C@@H](C)C1	ZINC000594749367	449666247	/nfs/dbraw/zinc/66/62/47/449666247.db2.gz	SNVCILCEGVZFLW-VXGBXAGGSA-N	-1	3	342.421	1.389	20	5		EDBDHM
O=[N+]([O-])c1cccnc1S(=O)(=O)[N-][C@@H]1CCCN2CCCC[C@@H]12	ZINC000594793624	449703323	/nfs/dbraw/zinc/70/33/23/449703323.db2.gz	FRZJMFMJSIFUHD-NEPJUHHUSA-N	-1	3	340.405	1.285	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2COC(C)(C)C2)c([N+](=O)[O-])c1	ZINC000594798104	449708575	/nfs/dbraw/zinc/70/85/75/449708575.db2.gz	ZIHXMJJCILCLFU-SECBINFHSA-N	-1	3	330.362	1.449	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2C[C@@H](C)n3ncnc32)cc1[N+](=O)[O-]	ZINC000594805726	449717657	/nfs/dbraw/zinc/71/76/57/449717657.db2.gz	CFCHEARZGMCVAY-SVRRBLITSA-N	-1	3	343.390	1.541	20	5		EDBDHM
CC(C)(CO)C[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594776677	449689259	/nfs/dbraw/zinc/68/92/59/449689259.db2.gz	RGUGSSLREJWKBH-UHFFFAOYSA-N	-1	3	339.373	1.440	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](O)[C@H]2CCCO2)c1C	ZINC000599392280	449939326	/nfs/dbraw/zinc/93/93/26/449939326.db2.gz	PWJXWZBNQLCHAH-CHWSQXEVSA-N	-1	3	344.389	1.030	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CCOC2(C)C)c(F)cc1[N+](=O)[O-]	ZINC000601424674	449943929	/nfs/dbraw/zinc/94/39/29/449943929.db2.gz	BZWAJTWUFOXDMT-LBPRGKRZSA-N	-1	3	332.353	1.888	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CCO[C@@H](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000601385410	449901263	/nfs/dbraw/zinc/90/12/63/449901263.db2.gz	MYWXAQWTJDIQFS-UWVGGRQHSA-N	-1	3	332.353	1.888	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC[C@H]1CCCOC1	ZINC000599364548	449920617	/nfs/dbraw/zinc/92/06/17/449920617.db2.gz	LUFSDSGIUDXHRY-LLVKDONJSA-N	-1	3	344.389	1.698	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CO[C@H](C2CC2)C1	ZINC000599481221	450008436	/nfs/dbraw/zinc/00/84/36/450008436.db2.gz	BLBLTZRYFFVRFN-AAEUAGOBSA-N	-1	3	326.374	1.749	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2C[C@H](C)O[C@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000601499715	450019904	/nfs/dbraw/zinc/01/99/04/450019904.db2.gz	RLUIUAGVRLSPCH-ATZCPNFKSA-N	-1	3	332.353	1.887	20	5		EDBDHM
COc1ccnc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)c1	ZINC000595345551	450058458	/nfs/dbraw/zinc/05/84/58/450058458.db2.gz	CXHMNJBVWHXMCI-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@H]1CCOC1(C)C	ZINC000595391556	450105120	/nfs/dbraw/zinc/10/51/20/450105120.db2.gz	GCXPVOZQFGCLQD-LLVKDONJSA-N	-1	3	328.390	1.997	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1ccncc1C	ZINC000619498161	450492295	/nfs/dbraw/zinc/49/22/95/450492295.db2.gz	FINWELAYOBCNEW-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
COC(=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)n1	ZINC000616899837	450511168	/nfs/dbraw/zinc/51/11/68/450511168.db2.gz	AILYBWKPKWWCIN-UHFFFAOYSA-N	-1	3	332.272	1.058	20	5		EDBDHM
CO[C@H](C[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1)C(F)(F)F	ZINC000760565364	580033876	/nfs/dbraw/zinc/03/38/76/580033876.db2.gz	LPMZJYPRVXXBSD-SECBINFHSA-N	-1	3	328.268	1.450	20	5		EDBDHM
CS(=O)(=O)c1ccc(C(=O)[N-]c2ccc(F)c([N+](=O)[O-])c2)o1	ZINC000733094041	578741859	/nfs/dbraw/zinc/74/18/59/578741859.db2.gz	ZZEAIBPUFWQDKG-UHFFFAOYSA-N	-1	3	328.277	1.983	20	5		EDBDHM
CC(C)[C@@H]1CN(C)CCN1c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000735759257	578921159	/nfs/dbraw/zinc/92/11/59/578921159.db2.gz	QQGQFMKTUDYSJC-AWEZNQCLSA-N	-1	3	331.380	1.551	20	5		EDBDHM
CN(C)C[C@@H]1CN(c2ccc(/C=C/C(=O)[O-])cc2[N+](=O)[O-])CCO1	ZINC000737364255	579079065	/nfs/dbraw/zinc/07/90/65/579079065.db2.gz	AJSORONVOZOMPY-DIECRNLCSA-N	-1	3	335.360	1.459	20	5		EDBDHM
Cc1ccnc(NCCNc2ccc(-c3nnn[n-]3)cn2)c1[N+](=O)[O-]	ZINC000737435616	579090761	/nfs/dbraw/zinc/09/07/61/579090761.db2.gz	ASYLGUZMCFQGCY-UHFFFAOYSA-N	-1	3	341.335	1.397	20	5		EDBDHM
Cc1ccnc(NCCNc2ccc(-c3nn[n-]n3)cn2)c1[N+](=O)[O-]	ZINC000737435616	579090763	/nfs/dbraw/zinc/09/07/63/579090763.db2.gz	ASYLGUZMCFQGCY-UHFFFAOYSA-N	-1	3	341.335	1.397	20	5		EDBDHM
O=C([O-])/C=C\c1ccc(NC[C@@H]2CN3CCC[C@H]3CO2)c([N+](=O)[O-])c1	ZINC000739622365	579227500	/nfs/dbraw/zinc/22/75/00/579227500.db2.gz	AWSROUWYKRQCIT-PSVOHZHUSA-N	-1	3	347.371	1.968	20	5		EDBDHM
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)[C@H](C)CNC(=O)[O-]	ZINC000740099687	579289753	/nfs/dbraw/zinc/28/97/53/579289753.db2.gz	QQZJEHFFDXUEAA-LLVKDONJSA-N	-1	3	338.364	1.820	20	5		EDBDHM
Cc1c([O-])ccc2c(Cn3cccc([N+](=O)[O-])c3=O)cc(=O)oc12	ZINC000750553851	579770743	/nfs/dbraw/zinc/77/07/43/579770743.db2.gz	FTEGFDYXGMZVGX-UHFFFAOYSA-N	-1	3	328.280	1.925	20	5		EDBDHM
CC(C)=C(C)C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000751385727	579803973	/nfs/dbraw/zinc/80/39/73/579803973.db2.gz	SQUYIBRPIIEKEN-UHFFFAOYSA-N	-1	3	341.389	1.346	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H](C)CC(N)=O)cc1[N+](=O)[O-]	ZINC000752252651	579843001	/nfs/dbraw/zinc/84/30/01/579843001.db2.gz	AAILIKYRXHXNHO-SSDOTTSWSA-N	-1	3	335.769	1.099	20	5		EDBDHM
Cc1nonc1C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl	ZINC000752256497	579843482	/nfs/dbraw/zinc/84/34/82/579843482.db2.gz	WICNKIADNNLCFL-UHFFFAOYSA-N	-1	3	346.752	1.727	20	5		EDBDHM
Cc1cc(F)cc(C(=O)[N-]c2nc(CC(N)=O)cs2)c1[N+](=O)[O-]	ZINC000753100264	579872597	/nfs/dbraw/zinc/87/25/97/579872597.db2.gz	ZVTUJIRPTGEFPR-UHFFFAOYSA-N	-1	3	338.320	1.779	20	5		EDBDHM
O=C(CCc1cccc([N+](=O)[O-])c1)[N-]N1C(=O)c2ccccc2C1=O	ZINC000755080509	579919571	/nfs/dbraw/zinc/91/95/71/579919571.db2.gz	DTYHXDHTCMFIFI-UHFFFAOYSA-N	-1	3	339.307	1.855	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@@H](CO)c2ccccc2)cs1	ZINC000768855283	580222624	/nfs/dbraw/zinc/22/26/24/580222624.db2.gz	YIKZCLZMENBVPO-NSHDSACASA-N	-1	3	342.398	1.711	20	5		EDBDHM
C[C@]1([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CCO[C@@H]1C1CC1	ZINC000768889611	580223600	/nfs/dbraw/zinc/22/36/00/580223600.db2.gz	DKLOPXQAMPEYMG-NEPJUHHUSA-N	-1	3	332.403	1.892	20	5		EDBDHM
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000772983295	580324764	/nfs/dbraw/zinc/32/47/64/580324764.db2.gz	YQMLRWYZVJPQOR-AWEZNQCLSA-N	-1	3	349.387	1.674	20	5		EDBDHM
O=C([N-]C[C@@H](O)c1ccccn1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000778392069	580464068	/nfs/dbraw/zinc/46/40/68/580464068.db2.gz	RZJAFVGHBVVDJD-CYBMUJFWSA-N	-1	3	337.282	1.931	20	5		EDBDHM
O=C(CNC(=O)c1cccc([O-])c1)OCc1csc([N+](=O)[O-])c1	ZINC000785702494	580650612	/nfs/dbraw/zinc/65/06/12/580650612.db2.gz	OPSBRASIADLRLJ-UHFFFAOYSA-N	-1	3	336.325	1.835	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)[n-]1	ZINC000801962357	581089117	/nfs/dbraw/zinc/08/91/17/581089117.db2.gz	FMYCZPSSKXPKLD-UHFFFAOYSA-N	-1	3	337.267	1.468	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)c[n-]1	ZINC000801962357	581089118	/nfs/dbraw/zinc/08/91/18/581089118.db2.gz	FMYCZPSSKXPKLD-UHFFFAOYSA-N	-1	3	337.267	1.468	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12	ZINC000907765344	592782838	/nfs/dbraw/zinc/78/28/38/592782838.db2.gz	AJBJVHFGKBEABZ-LODQBSKSSA-N	-1	3	344.776	1.702	20	5		EDBDHM
Cc1cc(N[C@@H](C)[C@H]2CN(C)CCN2C)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000910364562	592844763	/nfs/dbraw/zinc/84/47/63/592844763.db2.gz	SEXZEYYQCVQMEP-XHDPSFHLSA-N	-1	3	336.392	1.648	20	5		EDBDHM
CC[S@](=O)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000735082624	592975349	/nfs/dbraw/zinc/97/53/49/592975349.db2.gz	ZWBSXKYSMHJCAO-IBGZPJMESA-N	-1	3	340.810	1.295	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2C[C@@H](C)OC2=O)c1[N+](=O)[O-]	ZINC000809383411	593335622	/nfs/dbraw/zinc/33/56/22/593335622.db2.gz	XIERPDFRBJSZJR-NXEZZACHSA-N	-1	3	328.346	1.194	20	5		EDBDHM
CC1=C([O-])N(C)S(=O)(=O)N1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000806571589	593458016	/nfs/dbraw/zinc/45/80/16/593458016.db2.gz	XAYOQZXODYVMNI-SSDOTTSWSA-N	-1	3	333.753	1.156	20	5		EDBDHM
CCOc1ccc(NC(=O)COC(=O)c2n[n-]nc2C)c([N+](=O)[O-])c1	ZINC000805548558	593465914	/nfs/dbraw/zinc/46/59/14/593465914.db2.gz	ZCNFHGMSUCJVGZ-UHFFFAOYSA-N	-1	3	349.303	1.216	20	5		EDBDHM
CC(C)N1C[C@H](Nc2ccc(-c3nnn[n-]3)c([N+](=O)[O-])c2)CC1=O	ZINC000820128654	593793425	/nfs/dbraw/zinc/79/34/25/593793425.db2.gz	SMMZKSPGPJSVLS-SNVBAGLBSA-N	-1	3	331.336	1.196	20	5		EDBDHM
C[C@@H](CCO)Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820248305	593802860	/nfs/dbraw/zinc/80/28/60/593802860.db2.gz	FDFAPRGVLHRIEE-QMMMGPOBSA-N	-1	3	329.320	1.506	20	5		EDBDHM
C[C@@H](CCO)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820248305	593802861	/nfs/dbraw/zinc/80/28/61/593802861.db2.gz	FDFAPRGVLHRIEE-QMMMGPOBSA-N	-1	3	329.320	1.506	20	5		EDBDHM
O=c1ccn(CCCOc2cccc(-c3nnn[n-]3)c2)cc1[N+](=O)[O-]	ZINC000823665556	593829296	/nfs/dbraw/zinc/82/92/96/593829296.db2.gz	PPPPMQHSJDYMCD-UHFFFAOYSA-N	-1	3	342.315	1.406	20	5		EDBDHM
O=c1ccn(CCCOc2cccc(-c3nn[n-]n3)c2)cc1[N+](=O)[O-]	ZINC000823665556	593829298	/nfs/dbraw/zinc/82/92/98/593829298.db2.gz	PPPPMQHSJDYMCD-UHFFFAOYSA-N	-1	3	342.315	1.406	20	5		EDBDHM
C[C@@H]1C[C@@H]1N1C[C@@H](Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1=O	ZINC000820678835	593860837	/nfs/dbraw/zinc/86/08/37/593860837.db2.gz	ZBCLMHHWKLRYBS-QRTLGDNMSA-N	-1	3	343.347	1.196	20	5		EDBDHM
C[C@@H]1C[C@@H]1N1C[C@@H](Nc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1=O	ZINC000820678835	593860839	/nfs/dbraw/zinc/86/08/39/593860839.db2.gz	ZBCLMHHWKLRYBS-QRTLGDNMSA-N	-1	3	343.347	1.196	20	5		EDBDHM
CN(C)c1nc(CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])cs1	ZINC000821591108	593872410	/nfs/dbraw/zinc/87/24/10/593872410.db2.gz	WIKJECMAASDXQL-UHFFFAOYSA-N	-1	3	346.376	1.910	20	5		EDBDHM
CN(C)c1nc(CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])cs1	ZINC000821591108	593872412	/nfs/dbraw/zinc/87/24/12/593872412.db2.gz	WIKJECMAASDXQL-UHFFFAOYSA-N	-1	3	346.376	1.910	20	5		EDBDHM
C[C@@H](CN(C)c1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)c1nccs1	ZINC000824413620	594005546	/nfs/dbraw/zinc/00/55/46/594005546.db2.gz	NSFPNAAUWVFCCK-QMMMGPOBSA-N	-1	3	346.376	1.866	20	5		EDBDHM
C[C@@H](CN(C)c1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)c1nccs1	ZINC000824413620	594005550	/nfs/dbraw/zinc/00/55/50/594005550.db2.gz	NSFPNAAUWVFCCK-QMMMGPOBSA-N	-1	3	346.376	1.866	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(Cc2ccc(F)c(-c3nnn[n-]3)c2)c1=O	ZINC000822213013	594010928	/nfs/dbraw/zinc/01/09/28/594010928.db2.gz	QULCOGNGHQUMTN-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(Cc2ccc(F)c(-c3nn[n-]n3)c2)c1=O	ZINC000822213013	594010929	/nfs/dbraw/zinc/01/09/29/594010929.db2.gz	QULCOGNGHQUMTN-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
CCOC(=O)N1CCN(c2ccc(-c3nnn[n-]3)c([N+](=O)[O-])c2)CC1	ZINC000821333834	594020625	/nfs/dbraw/zinc/02/06/25/594020625.db2.gz	ARNOFTXIMFFXMN-UHFFFAOYSA-N	-1	3	347.335	1.053	20	5		EDBDHM
C[C@](O)(CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)C(F)(F)F	ZINC000824677338	594054352	/nfs/dbraw/zinc/05/43/52/594054352.db2.gz	DMYKOWHLBNOBSR-JTQLQIEISA-N	-1	3	332.242	1.500	20	5		EDBDHM
C[C@](O)(CNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)C(F)(F)F	ZINC000824677338	594054353	/nfs/dbraw/zinc/05/43/53/594054353.db2.gz	DMYKOWHLBNOBSR-JTQLQIEISA-N	-1	3	332.242	1.500	20	5		EDBDHM
C[C@H](C[C@H](C)O)Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000824699465	594058390	/nfs/dbraw/zinc/05/83/90/594058390.db2.gz	SWPRCPCYRFIOMD-BDAKNGLRSA-N	-1	3	343.347	1.894	20	5		EDBDHM
C[C@H](C[C@H](C)O)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000824699465	594058391	/nfs/dbraw/zinc/05/83/91/594058391.db2.gz	SWPRCPCYRFIOMD-BDAKNGLRSA-N	-1	3	343.347	1.894	20	5		EDBDHM
Cn1c(C(=O)OCc2ccc(F)c(-c3nnn[n-]3)c2)ccc1[N+](=O)[O-]	ZINC000822596506	594071411	/nfs/dbraw/zinc/07/14/11/594071411.db2.gz	NAQIPDLLLLWMGW-UHFFFAOYSA-N	-1	3	346.278	1.610	20	5		EDBDHM
Cn1c(C(=O)OCc2ccc(F)c(-c3nn[n-]n3)c2)ccc1[N+](=O)[O-]	ZINC000822596506	594071412	/nfs/dbraw/zinc/07/14/12/594071412.db2.gz	NAQIPDLLLLWMGW-UHFFFAOYSA-N	-1	3	346.278	1.610	20	5		EDBDHM
CN(C(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(-c2nnn[n-]2)cc1	ZINC000825820709	594254617	/nfs/dbraw/zinc/25/46/17/594254617.db2.gz	PWTTYWLGBFAYRV-UHFFFAOYSA-N	-1	3	338.327	1.980	20	5		EDBDHM
CN(C(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(-c2nn[n-]n2)cc1	ZINC000825820709	594254618	/nfs/dbraw/zinc/25/46/18/594254618.db2.gz	PWTTYWLGBFAYRV-UHFFFAOYSA-N	-1	3	338.327	1.980	20	5		EDBDHM
Cn1nccc1C(=O)Nc1cc(-c2nnn[n-]2)cc([N+](=O)[O-])c1Cl	ZINC000826366838	594447477	/nfs/dbraw/zinc/44/74/77/594447477.db2.gz	ZTPFFLFCSXXEDJ-UHFFFAOYSA-N	-1	3	348.710	1.414	20	5		EDBDHM
Cn1nccc1C(=O)Nc1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl	ZINC000826366838	594447478	/nfs/dbraw/zinc/44/74/78/594447478.db2.gz	ZTPFFLFCSXXEDJ-UHFFFAOYSA-N	-1	3	348.710	1.414	20	5		EDBDHM
O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1CCc2c1cccc2[N+](=O)[O-]	ZINC000826469880	594489313	/nfs/dbraw/zinc/48/93/13/594489313.db2.gz	VFWBKRZCAFBUIO-UHFFFAOYSA-N	-1	3	325.288	1.306	20	5		EDBDHM
O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1CCc2c1cccc2[N+](=O)[O-]	ZINC000826469880	594489315	/nfs/dbraw/zinc/48/93/15/594489315.db2.gz	VFWBKRZCAFBUIO-UHFFFAOYSA-N	-1	3	325.288	1.306	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N[C@H]1CCO[C@@]2(CCOC2)C1	ZINC000826497868	594502980	/nfs/dbraw/zinc/50/29/80/594502980.db2.gz	XEEOELCNTXANGW-NHYWBVRUSA-N	-1	3	346.347	1.525	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N[C@H]1CCO[C@@]2(CCOC2)C1	ZINC000826497868	594502981	/nfs/dbraw/zinc/50/29/81/594502981.db2.gz	XEEOELCNTXANGW-NHYWBVRUSA-N	-1	3	346.347	1.525	20	5		EDBDHM
CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000830927937	594514670	/nfs/dbraw/zinc/51/46/70/594514670.db2.gz	FMUALUQJQCPCFB-XHDPSFHLSA-N	-1	3	347.371	1.849	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl)[C@@H](C)O	ZINC000832309660	594741869	/nfs/dbraw/zinc/74/18/69/594741869.db2.gz	JKGVRZHUUKGSHI-PSASIEDQSA-N	-1	3	336.797	1.994	20	5		EDBDHM
CCCCC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(=O)OC	ZINC000845890512	595089907	/nfs/dbraw/zinc/08/99/07/595089907.db2.gz	IUMOQAGHTNLQID-LLVKDONJSA-N	-1	3	345.377	1.390	20	5		EDBDHM
O=C([O-])/C=C\c1ccc(NC[C@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000844211965	595303550	/nfs/dbraw/zinc/30/35/50/595303550.db2.gz	MVDNIZPNKLAZSG-BRLPQQTGSA-N	-1	3	349.387	1.951	20	5		EDBDHM
COc1cc(CNC[C@H]2CN(C3CC3)C(=O)O2)c([N+](=O)[O-])cc1[O-]	ZINC000848577174	595407467	/nfs/dbraw/zinc/40/74/67/595407467.db2.gz	BCYXKUYPXMOIMH-NSHDSACASA-N	-1	3	337.332	1.382	20	5		EDBDHM
COC(=O)[C@@H](C)C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848581942	595408534	/nfs/dbraw/zinc/40/85/34/595408534.db2.gz	SUAZVQQAFGZRBX-QMMMGPOBSA-N	-1	3	332.259	1.492	20	5		EDBDHM
O=C([N-]CCCn1ccnn1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848585804	595410198	/nfs/dbraw/zinc/41/01/98/595410198.db2.gz	DNAFACHIWGYNFS-UHFFFAOYSA-N	-1	3	341.274	1.364	20	5		EDBDHM
O=C([N-]C[C@@H](O)C1CCC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848592655	595412578	/nfs/dbraw/zinc/41/25/78/595412578.db2.gz	WTHOIKRWVNAILF-GFCCVEGCSA-N	-1	3	330.287	1.844	20	5		EDBDHM
COC(=O)Cc1ccc(N2CCc3c(=O)[n-]cnc3C2)c([N+](=O)[O-])c1	ZINC000848720549	595435857	/nfs/dbraw/zinc/43/58/57/595435857.db2.gz	PVRXOJHDZJGOHT-UHFFFAOYSA-N	-1	3	344.327	1.369	20	5		EDBDHM
COC(=O)N(C)CC[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000849470034	595543695	/nfs/dbraw/zinc/54/36/95/595543695.db2.gz	GQCSQLSHFVCWEQ-UHFFFAOYSA-N	-1	3	345.377	1.188	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]CCOc2cccnc2)cs1	ZINC000119765261	596740897	/nfs/dbraw/zinc/74/08/97/596740897.db2.gz	OKFPCFADCKWEIE-UHFFFAOYSA-N	-1	3	329.359	1.409	20	5		EDBDHM
CO[C@H]1C[C@H](C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000882591803	598000499	/nfs/dbraw/zinc/00/04/99/598000499.db2.gz	RLADNWPPTYNALE-CZMCAQCFSA-N	-1	3	334.781	1.952	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCC[C@@H](c2ncc[nH]2)C1	ZINC000738357102	598523699	/nfs/dbraw/zinc/52/36/99/598523699.db2.gz	BHJNZSPNAFWTDE-LLVKDONJSA-N	-1	3	340.347	1.882	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2ccc(O)c(F)c2)c(-c2nnn[n-]2)c1	ZINC000738374301	599536183	/nfs/dbraw/zinc/53/61/83/599536183.db2.gz	MYUZMGMITHCEAR-UHFFFAOYSA-N	-1	3	331.267	1.627	20	5		EDBDHM
O=C(CCn1ccnn1)N=c1cc(-c2cccc([N+](=O)[O-])c2)[n-][nH]1	ZINC000352157795	707163689	/nfs/dbraw/zinc/16/36/89/707163689.db2.gz	ZDRGHKZIIIHVQT-UHFFFAOYSA-N	-1	3	327.304	1.027	20	5		EDBDHM
CC(C)(C)NC(=O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000055986430	214351786	/nfs/dbraw/zinc/35/17/86/214351786.db2.gz	OORJMZLRULOWBU-UHFFFAOYSA-N	-1	3	349.796	1.441	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2(O)CCCC2)c1C	ZINC000178566678	232260397	/nfs/dbraw/zinc/26/03/97/232260397.db2.gz	SLKDTIMKKVDPDO-UHFFFAOYSA-N	-1	3	328.390	1.795	20	5		EDBDHM
CCCC[C@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)OC	ZINC000354670411	282974253	/nfs/dbraw/zinc/97/42/53/282974253.db2.gz	JDLGGBGBKKYQJV-NSHDSACASA-N	-1	3	344.389	1.913	20	5		EDBDHM
Cc1nc(C)c(CCC(=O)NCCc2ccc([N+](=O)[O-])cc2)c(=O)[n-]1	ZINC000065124062	138172569	/nfs/dbraw/zinc/17/25/69/138172569.db2.gz	RJRHDSDQAYYTEA-UHFFFAOYSA-N	-1	3	344.371	1.586	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-])CN1CCCC1	ZINC000123737543	138320762	/nfs/dbraw/zinc/32/07/62/138320762.db2.gz	AHRWZNILLVTWOK-LLVKDONJSA-N	-1	3	345.396	1.744	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CC[C@H](C)[S@@](C)=O)cc1[N+](=O)[O-]	ZINC000125659634	138335395	/nfs/dbraw/zinc/33/53/95/138335395.db2.gz	PKVZNJKEUHESIX-IIYDVTGLSA-N	-1	3	340.448	1.400	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]3OCC[C@H]32)c(F)c1	ZINC000245980934	139091610	/nfs/dbraw/zinc/09/16/10/139091610.db2.gz	CZNRKGFUAFSFGU-UHTWSYAYSA-N	-1	3	344.364	1.970	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H](C)C(=O)NC(C)C)c([N+](=O)[O-])c1	ZINC000416622106	251087881	/nfs/dbraw/zinc/08/78/81/251087881.db2.gz	LOZPJVILGVYOIQ-JTQLQIEISA-N	-1	3	329.378	1.095	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@H]2CC[C@@H](C)O2)cc1[N+](=O)[O-]	ZINC000416536543	251074584	/nfs/dbraw/zinc/07/45/84/251074584.db2.gz	PYSSZIRJHVGCLE-RKDXNWHRSA-N	-1	3	348.352	1.588	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCOC[C@@H]2C)cc1C	ZINC000277947951	273237183	/nfs/dbraw/zinc/23/71/83/273237183.db2.gz	RINCLOGAPSADDU-RYUDHWBXSA-N	-1	3	328.390	1.915	20	5		EDBDHM
NC(=O)[N-]C(=O)OCCCn1cc(-c2cccc([N+](=O)[O-])c2)cn1	ZINC000494538262	255252997	/nfs/dbraw/zinc/25/29/97/255252997.db2.gz	GERIHIZXROMCGO-UHFFFAOYSA-N	-1	3	333.304	1.653	20	5		EDBDHM
COCCC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000152782626	533209594	/nfs/dbraw/zinc/20/95/94/533209594.db2.gz	AHANCVWPEAHMJP-UHFFFAOYSA-N	-1	3	332.353	1.829	20	5		EDBDHM
NC(=O)c1cc([N+](=O)[O-])cnc1[N-]c1cnn(CC(F)(F)F)c1	ZINC000118384180	221145212	/nfs/dbraw/zinc/14/52/12/221145212.db2.gz	VQQUDYOFAPUUOG-UHFFFAOYSA-N	-1	3	330.226	1.591	20	5		EDBDHM
CCC(CC)[C@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000119132358	221251160	/nfs/dbraw/zinc/25/11/60/221251160.db2.gz	VBBVWHGMYVHXJH-GFCCVEGCSA-N	-1	3	334.369	1.809	20	5		EDBDHM
Cc1ncc(CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c(=O)[n-]1	ZINC000345102569	143050574	/nfs/dbraw/zinc/05/05/74/143050574.db2.gz	RLHLVDRQJDHZFY-UHFFFAOYSA-N	-1	3	327.300	1.810	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC1(C)CC1	ZINC000345478642	143095979	/nfs/dbraw/zinc/09/59/79/143095979.db2.gz	OCGVQDOTEZFIDL-UHFFFAOYSA-N	-1	3	328.346	1.460	20	5		EDBDHM
Cc1ccc([O-])c(NC(=O)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)n1	ZINC000345925693	143147885	/nfs/dbraw/zinc/14/78/85/143147885.db2.gz	KMSRYZHOJJQKJU-UHFFFAOYSA-N	-1	3	345.311	1.956	20	5		EDBDHM
C[C@@H]1C[C@H]1N1CCN(C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)C[C@@H](C)C1	ZINC000346205707	143178741	/nfs/dbraw/zinc/17/87/41/143178741.db2.gz	VHNWLWXIKLGVCZ-DMDPSCGWSA-N	-1	3	334.376	1.498	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)[N-]c2cc3c(cc2F)CCC(=O)N3)n1	ZINC000355421877	150261849	/nfs/dbraw/zinc/26/18/49/150261849.db2.gz	PIVHQHIVSAEFDS-UHFFFAOYSA-N	-1	3	333.279	1.604	20	5		EDBDHM
COCCOC[C@H](C)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000360573042	152103931	/nfs/dbraw/zinc/10/39/31/152103931.db2.gz	ZFDXDLKRGJOVIZ-LBPRGKRZSA-N	-1	3	346.405	1.541	20	5		EDBDHM
CC(C)(O)CN1CCCN(C(=O)c2cccc([N+](=O)[O-])c2[O-])CC1	ZINC000364147471	153155622	/nfs/dbraw/zinc/15/56/22/153155622.db2.gz	VZFQTMAUADSCSK-UHFFFAOYSA-N	-1	3	337.376	1.219	20	5		EDBDHM
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])[C@H]1OC	ZINC000356221598	286393377	/nfs/dbraw/zinc/39/33/77/286393377.db2.gz	OWZUUPWHYYYFOQ-ZKYQVNSYSA-N	-1	3	344.389	1.374	20	5		EDBDHM
CCCN1CCC[C@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000352501221	162215905	/nfs/dbraw/zinc/21/59/05/162215905.db2.gz	SUPXIRJPPZLASJ-JTQLQIEISA-N	-1	3	333.435	1.809	20	5		EDBDHM
C[C@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000122844829	287383833	/nfs/dbraw/zinc/38/38/33/287383833.db2.gz	PIQXQHDVXLVLDE-ZCFIWIBFSA-N	-1	3	328.268	1.273	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CC(=O)NC(C)(C)C)cc1[N+](=O)[O-]	ZINC000122887614	222177584	/nfs/dbraw/zinc/17/75/84/222177584.db2.gz	GAUUYPUYACAZLD-UHFFFAOYSA-N	-1	3	335.407	1.158	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)C1CC1	ZINC000273155924	273030372	/nfs/dbraw/zinc/03/03/72/273030372.db2.gz	MTNXZIYKWKJTNK-MRVPVSSYSA-N	-1	3	328.346	1.458	20	5		EDBDHM
CCN1CC[C@@H]([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000359935730	276217190	/nfs/dbraw/zinc/21/71/90/276217190.db2.gz	CZFZENBBCSRVEP-SNVBAGLBSA-N	-1	3	333.797	1.621	20	5		EDBDHM
CN(C)c1n[nH]c([N-]C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)n1	ZINC000285984837	287907304	/nfs/dbraw/zinc/90/73/04/287907304.db2.gz	LHRCJWSSAIZYJR-UHFFFAOYSA-N	-1	3	342.262	1.633	20	5		EDBDHM
Cc1nnsc1C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000291857418	289198322	/nfs/dbraw/zinc/19/83/22/289198322.db2.gz	IMEZMYZJBPFOPG-UHFFFAOYSA-N	-1	3	342.402	1.850	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2C(=O)NCC[C@H]2C)cc1C	ZINC000195476194	301427446	/nfs/dbraw/zinc/42/74/46/301427446.db2.gz	ZUSBLSSTKQWJON-AMIZOPFISA-N	-1	3	341.389	1.015	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCc1nccnc1C	ZINC000293788032	303018851	/nfs/dbraw/zinc/01/88/51/303018851.db2.gz	MGXZDTVWBPFNSS-UHFFFAOYSA-N	-1	3	336.373	1.523	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@]2(O)CCC[C@H]2C)c([N+](=O)[O-])c1	ZINC000294422341	303104869	/nfs/dbraw/zinc/10/48/69/303104869.db2.gz	DMNCUDWPOYAFPB-QMTHXVAHSA-N	-1	3	344.389	1.433	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-]C1CCCCC1)OCCO2	ZINC000263970717	304801159	/nfs/dbraw/zinc/80/11/59/304801159.db2.gz	BEQFORIPDYDPBA-UHFFFAOYSA-N	-1	3	342.373	1.977	20	5		EDBDHM
CN(C(N)=O)c1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000427929660	305001396	/nfs/dbraw/zinc/00/13/96/305001396.db2.gz	HIUHWGKHVKULIA-UHFFFAOYSA-N	-1	3	331.288	1.463	20	5		EDBDHM
C[C@H]1COCC[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000432322714	305091244	/nfs/dbraw/zinc/09/12/44/305091244.db2.gz	BZXMKYOCMVDAAT-WPRPVWTQSA-N	-1	3	334.781	1.952	20	5		EDBDHM
CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCC[C@]2(C1)NC(=O)[N-]C2=O	ZINC000435042129	305135190	/nfs/dbraw/zinc/13/51/90/305135190.db2.gz	LTUZPTVXLCLXFZ-SAYIFAPPSA-N	-1	3	344.371	1.672	20	5		EDBDHM
CN(C)CCOC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC1	ZINC000436886130	305168776	/nfs/dbraw/zinc/16/87/76/305168776.db2.gz	QQDQOMXGGKPCTA-UHFFFAOYSA-N	-1	3	337.376	1.483	20	5		EDBDHM
NC(=O)c1ccc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)c(F)c1	ZINC000442326418	305228874	/nfs/dbraw/zinc/22/88/74/305228874.db2.gz	CNVJADFTNWPHFE-UHFFFAOYSA-N	-1	3	339.304	1.634	20	5		EDBDHM
CCOC(=O)C(C)(C)[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000443779133	305241245	/nfs/dbraw/zinc/24/12/45/305241245.db2.gz	KBSQUKOBXOJUNP-UHFFFAOYSA-N	-1	3	330.362	1.356	20	5		EDBDHM
CCC1(C[N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])COC1	ZINC000451954833	305373886	/nfs/dbraw/zinc/37/38/86/305373886.db2.gz	YJGHVYAJHCIAHK-UHFFFAOYSA-N	-1	3	328.390	1.917	20	5		EDBDHM
Cc1nnc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)s1	ZINC000542799875	306058730	/nfs/dbraw/zinc/05/87/30/306058730.db2.gz	HNOIZADNCJTJFI-UHFFFAOYSA-N	-1	3	328.375	1.542	20	5		EDBDHM
CNS(=O)(=O)c1cccc([N-]C(=O)c2ccc([N+](=O)[O-])o2)c1	ZINC000046701499	441119488	/nfs/dbraw/zinc/11/94/88/441119488.db2.gz	OGSUBGJKYPQSAK-UHFFFAOYSA-N	-1	3	325.302	1.348	20	5		EDBDHM
O=C(c1ccccc1[O-])N1CCN(c2ccc([N+](=O)[O-])cn2)CC1	ZINC000058773113	441210979	/nfs/dbraw/zinc/21/09/79/441210979.db2.gz	QCYWFTLWWWTTLD-UHFFFAOYSA-N	-1	3	328.328	1.658	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCN2CCCCC2)cc1C	ZINC000060443188	441244377	/nfs/dbraw/zinc/24/43/77/441244377.db2.gz	GLDQIVOCNCGXIH-UHFFFAOYSA-N	-1	3	341.433	1.976	20	5		EDBDHM
CC(C)(C)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(N)=O	ZINC000113290288	441598718	/nfs/dbraw/zinc/59/87/18/441598718.db2.gz	WYHAJKVZJXVQKX-JTQLQIEISA-N	-1	3	349.796	1.427	20	5		EDBDHM
CCC[C@@](C)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)OC	ZINC000056036814	441683818	/nfs/dbraw/zinc/68/38/18/441683818.db2.gz	IUMWFIBSCVSVGE-CYBMUJFWSA-N	-1	3	348.352	1.744	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nncn1C	ZINC000056069132	441685410	/nfs/dbraw/zinc/68/54/10/441685410.db2.gz	UTUHFOQCSYYBDA-ZETCQYMHSA-N	-1	3	345.768	1.416	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C)C(=O)NC(C)(C)C	ZINC000067717606	441672726	/nfs/dbraw/zinc/67/27/26/441672726.db2.gz	DBBXMQBMILYYNJ-JTQLQIEISA-N	-1	3	343.405	1.485	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000160235292	441867867	/nfs/dbraw/zinc/86/78/67/441867867.db2.gz	SACILFQRKLULFL-GHMZBOCLSA-N	-1	3	341.389	1.226	20	5		EDBDHM
CCN(CC)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000077687599	441830024	/nfs/dbraw/zinc/83/00/24/441830024.db2.gz	OSEGGASBOVRJKQ-UHFFFAOYSA-N	-1	3	335.813	1.868	20	5		EDBDHM
Cc1cc(=O)n(Cc2noc(-c3ccccc3[O-])n2)cc1[N+](=O)[O-]	ZINC000128721171	442284128	/nfs/dbraw/zinc/28/41/28/442284128.db2.gz	MBZMMWKCLWOOTE-UHFFFAOYSA-N	-1	3	328.284	1.869	20	5		EDBDHM
Cc1ccc([C@H](C)NC(=O)C(=O)[N-]c2cnns2)cc1[N+](=O)[O-]	ZINC000192045888	442578442	/nfs/dbraw/zinc/57/84/42/442578442.db2.gz	ORNWZSFFZQUOLS-QMMMGPOBSA-N	-1	3	335.345	1.571	20	5		EDBDHM
O=[N+]([O-])c1c(F)cccc1S(=O)(=O)[N-]C[C@H]1CCN(C2CC2)C1	ZINC000173024197	442588625	/nfs/dbraw/zinc/58/86/25/442588625.db2.gz	MNDVKCIJPLFSBX-SNVBAGLBSA-N	-1	3	343.380	1.497	20	5		EDBDHM
Cc1cc(=O)[n-]c(-c2cccc(NC(=O)c3n[nH]cc3[N+](=O)[O-])c2)n1	ZINC000136243350	442656682	/nfs/dbraw/zinc/65/66/82/442656682.db2.gz	GQFRRQYYNFDTJC-UHFFFAOYSA-N	-1	3	340.299	1.629	20	5		EDBDHM
CN1CC[C@H](NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)[C@@H]1c1ccccc1	ZINC000193763716	442782545	/nfs/dbraw/zinc/78/25/45/442782545.db2.gz	NQHTZBVGUVIPNH-ZFWWWQNUSA-N	-1	3	342.355	1.871	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCC[C@@H]2CCO)c(F)c1	ZINC000188933284	442844526	/nfs/dbraw/zinc/84/45/26/442844526.db2.gz	HAQBUXDCHPHRAF-SKDRFNHKSA-N	-1	3	332.353	1.563	20	5		EDBDHM
CN(C)c1ccc([N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])nc1	ZINC000183382455	442926464	/nfs/dbraw/zinc/92/64/64/442926464.db2.gz	CKSZGHXTHHLGNF-UHFFFAOYSA-N	-1	3	336.373	1.998	20	5		EDBDHM
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)[N-]C[C@H]1CCN(C2CC2)C1	ZINC000266079543	443010009	/nfs/dbraw/zinc/01/00/09/443010009.db2.gz	BPMPPECTFACWGL-SNVBAGLBSA-N	-1	3	343.380	1.497	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H](C)N(C)C2CC2)c1[N+](=O)[O-]	ZINC000189941761	443033604	/nfs/dbraw/zinc/03/36/04/443033604.db2.gz	ZFTZSVHCODMANB-LBPRGKRZSA-N	-1	3	341.433	1.973	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]C[C@@H](O)C1CCCCC1	ZINC000184534534	443035352	/nfs/dbraw/zinc/03/53/52/443035352.db2.gz	ICNLNGTXWVANKM-OAHLLOKOSA-N	-1	3	342.417	1.955	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-][C@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-]	ZINC000184852792	443086452	/nfs/dbraw/zinc/08/64/52/443086452.db2.gz	ZHEXMCZTYVFHTD-AAEUAGOBSA-N	-1	3	332.353	1.624	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)Cn2ccnc2)c1C	ZINC000268874371	443133437	/nfs/dbraw/zinc/13/34/37/443133437.db2.gz	PWQVDJFIBFPQNF-NSHDSACASA-N	-1	3	338.389	1.775	20	5		EDBDHM
CCN1CCN([C@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3[O-])C2)CC1	ZINC000185532183	443215276	/nfs/dbraw/zinc/21/52/76/443215276.db2.gz	IBOJPBUUIVJAGB-AWEZNQCLSA-N	-1	3	348.403	1.152	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)c2ccn(C)n2)cc1C	ZINC000416556648	319444102	/nfs/dbraw/zinc/44/41/02/319444102.db2.gz	GJEOMAHXHMCKGB-LLVKDONJSA-N	-1	3	338.389	1.985	20	5		EDBDHM
CC1(C)C[C@H]([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C(=O)O1	ZINC000272324426	443591806	/nfs/dbraw/zinc/59/18/06/443591806.db2.gz	KFZVRYYKEFOCLT-JTQLQIEISA-N	-1	3	328.271	1.897	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)CCC1	ZINC000272432344	443624095	/nfs/dbraw/zinc/62/40/95/443624095.db2.gz	GWDJBMHMRGQDJN-UHFFFAOYSA-N	-1	3	342.373	1.152	20	5		EDBDHM
CCC[C@](C)([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)C(=O)OC	ZINC000443707150	320109723	/nfs/dbraw/zinc/10/97/23/320109723.db2.gz	LGYJTQDXHSSDJP-AWEZNQCLSA-N	-1	3	344.389	1.746	20	5		EDBDHM
O=C([N-]CC1CCN(CCn2ccc([N+](=O)[O-])n2)CC1)C(F)(F)F	ZINC000281189515	443843179	/nfs/dbraw/zinc/84/31/79/443843179.db2.gz	BMONIHUXCBLLQI-UHFFFAOYSA-N	-1	3	349.313	1.182	20	5		EDBDHM
CCN1CCC([N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000299447364	444048625	/nfs/dbraw/zinc/04/86/25/444048625.db2.gz	RNQKYAFIEFLQEV-UHFFFAOYSA-N	-1	3	331.369	1.497	20	5		EDBDHM
Cc1nc([C@@H](C)[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)n[nH]1	ZINC000285500399	444008763	/nfs/dbraw/zinc/00/87/63/444008763.db2.gz	XOWVUTUBAQRGOW-SECBINFHSA-N	-1	3	339.377	1.678	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)c2nnc(C)[nH]2)c([N+](=O)[O-])c1	ZINC000285529238	444018369	/nfs/dbraw/zinc/01/83/69/444018369.db2.gz	ZSPLUPAPLBOLKO-ZETCQYMHSA-N	-1	3	341.349	1.069	20	5		EDBDHM
CCc1ccc(C(=O)N2CCC[C@H]2c2nc(=N)n(C)[n-]2)cc1[N+](=O)[O-]	ZINC000555532738	320969000	/nfs/dbraw/zinc/96/90/00/320969000.db2.gz	ASSULIRCJVEVHU-LBPRGKRZSA-N	-1	3	344.375	1.676	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1CCC(O)CC1	ZINC000323420017	444343226	/nfs/dbraw/zinc/34/32/26/444343226.db2.gz	OFKYUORZLBMWGX-UHFFFAOYSA-N	-1	3	344.389	1.433	20	5		EDBDHM
Cc1nn(C)c(C)c1C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000342529237	444733249	/nfs/dbraw/zinc/73/32/49/444733249.db2.gz	OARHPRODZRXFCU-UHFFFAOYSA-N	-1	3	344.418	1.794	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C2CCS(=O)CC2)cc1[N+](=O)[O-]	ZINC000342507131	444722171	/nfs/dbraw/zinc/72/21/71/444722171.db2.gz	TXWXAXVBSZZXEF-UHFFFAOYSA-N	-1	3	338.432	1.154	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H]2CCC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000341221305	444736282	/nfs/dbraw/zinc/73/62/82/444736282.db2.gz	USMQKDZYJULUJI-ZWNOBZJWSA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@@]2(O)CCC[C@H]2C)cc1[N+](=O)[O-]	ZINC000339093195	445029267	/nfs/dbraw/zinc/02/92/67/445029267.db2.gz	BCRINOOSZXVKPB-PELKAZGASA-N	-1	3	334.419	1.794	20	5		EDBDHM
Cc1nc([N-]C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)nn1C	ZINC000344536827	445042969	/nfs/dbraw/zinc/04/29/69/445042969.db2.gz	XVHVUHXRFKCIHZ-UHFFFAOYSA-N	-1	3	327.247	1.885	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCN3CCCC[C@H]23)cc1[N+](=O)[O-]	ZINC000343528576	445239090	/nfs/dbraw/zinc/23/90/90/445239090.db2.gz	ALUGBYLIMDEBFQ-GHMZBOCLSA-N	-1	3	345.446	1.870	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@]2(C)CCOC2)cc1C	ZINC000354517628	445275115	/nfs/dbraw/zinc/27/51/15/445275115.db2.gz	YMLJYOKZVROLFJ-CQSZACIVSA-N	-1	3	328.390	1.917	20	5		EDBDHM
COc1cc(S(=O)(=O)[N-]CC2(C(F)F)CC2)ccc1[N+](=O)[O-]	ZINC000359765817	445416387	/nfs/dbraw/zinc/41/63/87/445416387.db2.gz	IHKKKRCYLUWWEL-UHFFFAOYSA-N	-1	3	336.316	1.927	20	5		EDBDHM
Cc1ccc(NC(=O)CNC(=O)c2cccc([O-])c2)cc1[N+](=O)[O-]	ZINC000348932852	445445878	/nfs/dbraw/zinc/44/58/78/445445878.db2.gz	MDBMEZBFMDNYOD-UHFFFAOYSA-N	-1	3	329.312	1.977	20	5		EDBDHM
CC(C)N(C)C[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000349813578	445686737	/nfs/dbraw/zinc/68/67/37/445686737.db2.gz	RHVOMBCGWQAHPY-JTQLQIEISA-N	-1	3	333.385	1.741	20	5		EDBDHM
CCc1n[n-]c(S(=O)(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)n1	ZINC000350183542	445789017	/nfs/dbraw/zinc/78/90/17/445789017.db2.gz	HVZFWHPPUNCQFK-UHFFFAOYSA-N	-1	3	332.288	1.527	20	5		EDBDHM
CCc1nnc(S(=O)(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)[n-]1	ZINC000350183542	445789023	/nfs/dbraw/zinc/78/90/23/445789023.db2.gz	HVZFWHPPUNCQFK-UHFFFAOYSA-N	-1	3	332.288	1.527	20	5		EDBDHM
CN1CCC(n2ccc(NC(=O)c3ccc([O-])c([N+](=O)[O-])c3)n2)CC1	ZINC000365929578	445913157	/nfs/dbraw/zinc/91/31/57/445913157.db2.gz	UBMPTZWANWTXJY-UHFFFAOYSA-N	-1	3	345.359	2.016	20	5		EDBDHM
CC[C@@]1([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)CCOC1	ZINC000616461199	450428923	/nfs/dbraw/zinc/42/89/23/450428923.db2.gz	CMCBISBWPPMCEY-CYBMUJFWSA-N	-1	3	330.362	1.451	20	5		EDBDHM
CN1CCC(n2ccc([N-]c3nc4sccn4c3[N+](=O)[O-])n2)CC1	ZINC000369684166	446148414	/nfs/dbraw/zinc/14/84/14/446148414.db2.gz	YHIPEZPSEYLTFT-UHFFFAOYSA-N	-1	3	347.404	2.511	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2CNCCC2(F)F)ccc1[N+](=O)[O-]	ZINC000420441301	446616512	/nfs/dbraw/zinc/61/65/12/446616512.db2.gz	IEQIXAINTWDOOL-LLVKDONJSA-N	-1	3	335.332	1.179	20	5		EDBDHM
CC[C@@H](C[C@@H](C)CO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000443328615	447034277	/nfs/dbraw/zinc/03/42/77/447034277.db2.gz	QJTNNSDDBIKWPX-MNOVXSKESA-N	-1	3	346.405	1.679	20	5		EDBDHM
COC(=O)Cc1nnc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)[n-]1	ZINC000421770309	447245983	/nfs/dbraw/zinc/24/59/83/447245983.db2.gz	JSBHOTJEJFTTSA-UHFFFAOYSA-N	-1	3	333.304	1.298	20	5		EDBDHM
COC(=O)Cc1n[n-]c(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)n1	ZINC000421770309	447245989	/nfs/dbraw/zinc/24/59/89/447245989.db2.gz	JSBHOTJEJFTTSA-UHFFFAOYSA-N	-1	3	333.304	1.298	20	5		EDBDHM
COC(=O)Cc1nc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)n[n-]1	ZINC000421770309	447245997	/nfs/dbraw/zinc/24/59/97/447245997.db2.gz	JSBHOTJEJFTTSA-UHFFFAOYSA-N	-1	3	333.304	1.298	20	5		EDBDHM
CCn1ccc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)n1	ZINC000416595609	447657888	/nfs/dbraw/zinc/65/78/88/447657888.db2.gz	YGBWAEODGHZLKJ-UHFFFAOYSA-N	-1	3	330.391	1.660	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CC23CCOCC3)c(F)c1	ZINC000451886458	447773259	/nfs/dbraw/zinc/77/32/59/447773259.db2.gz	DEKLALIGGDESJC-LBPRGKRZSA-N	-1	3	330.337	1.581	20	5		EDBDHM
C[C@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)c2nccn21	ZINC000451934514	447790089	/nfs/dbraw/zinc/79/00/89/447790089.db2.gz	CUASCBZPTJJSIU-JGVFFNPUSA-N	-1	3	328.375	1.837	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]c2cc(C)ncc2C)cc1[N+](=O)[O-]	ZINC000532619762	448284090	/nfs/dbraw/zinc/28/40/90/448284090.db2.gz	DHGWUFGEHDQIMO-UHFFFAOYSA-N	-1	3	337.357	1.838	20	5		EDBDHM
CN1C(=O)COc2cc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)ccc21	ZINC000533209864	448375205	/nfs/dbraw/zinc/37/52/05/448375205.db2.gz	SJOOFDOGZQUOSS-UHFFFAOYSA-N	-1	3	344.283	1.303	20	5		EDBDHM
O=C([O-])Cc1ccc(NC[C@@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000578445593	448546632	/nfs/dbraw/zinc/54/66/32/448546632.db2.gz	JERXJDRWQIZRTA-ZDUSSCGKSA-N	-1	3	337.376	1.481	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-]	ZINC000538430122	448586896	/nfs/dbraw/zinc/58/68/96/448586896.db2.gz	UGZYEMXOTQDMRQ-GFCCVEGCSA-N	-1	3	348.359	1.300	20	5		EDBDHM
CCC[C@@]1([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2OC)CCOC1	ZINC000586773545	448807737	/nfs/dbraw/zinc/80/77/37/448807737.db2.gz	JPNARHNLXWWGDJ-CQSZACIVSA-N	-1	3	344.389	1.841	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2cccc([N+](=O)[O-])c2NC)n[n-]1	ZINC000545199514	448776697	/nfs/dbraw/zinc/77/66/97/448776697.db2.gz	JVIWWRIYJQDTNB-UHFFFAOYSA-N	-1	3	333.304	1.789	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2cccc([N+](=O)[O-])c2NC)[n-]n1	ZINC000545199514	448776700	/nfs/dbraw/zinc/77/67/00/448776700.db2.gz	JVIWWRIYJQDTNB-UHFFFAOYSA-N	-1	3	333.304	1.789	20	5		EDBDHM
CS[C@@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593624407	449114185	/nfs/dbraw/zinc/11/41/85/449114185.db2.gz	UUQBALHVZZBTSI-GHMZBOCLSA-N	-1	3	331.419	1.942	20	5		EDBDHM
CCO[C@@H](CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(C)C	ZINC000593554800	449345822	/nfs/dbraw/zinc/34/58/22/449345822.db2.gz	CILPFRSZXZXVEK-LBPRGKRZSA-N	-1	3	331.394	1.719	20	5		EDBDHM
CCN1C(=O)N=NC1C1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596230703	449429397	/nfs/dbraw/zinc/42/93/97/449429397.db2.gz	CXIFEPGCNKYXNV-UHFFFAOYSA-N	-1	3	334.336	1.396	20	5		EDBDHM
COCC1(C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000594475117	449539997	/nfs/dbraw/zinc/53/99/97/449539997.db2.gz	QMDDBXVMXLDCKN-UHFFFAOYSA-N	-1	3	334.781	1.953	20	5		EDBDHM
C[C@@H](CCO)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594761073	449675916	/nfs/dbraw/zinc/67/59/16/449675916.db2.gz	WQBCJMWBUHRFEC-VIFPVBQESA-N	-1	3	325.346	1.192	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2C[C@@H](O)C23CCC3)c(F)c1	ZINC000594865276	449779267	/nfs/dbraw/zinc/77/92/67/449779267.db2.gz	NWFRLTNBCQELEZ-VXGBXAGGSA-N	-1	3	330.337	1.316	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](CO)CC2CC2)c1C	ZINC000594866217	449780535	/nfs/dbraw/zinc/78/05/35/449780535.db2.gz	TYRKZOVGNIDUGX-ZDUSSCGKSA-N	-1	3	342.417	1.899	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H](CO)CC2CC2)c1[N+](=O)[O-]	ZINC000594866695	449781552	/nfs/dbraw/zinc/78/15/52/449781552.db2.gz	YLMKBAAYCMQBGK-ZDUSSCGKSA-N	-1	3	342.417	1.899	20	5		EDBDHM
COc1cc(CNc2ccn(C3CCOCC3)n2)c([N+](=O)[O-])cc1[O-]	ZINC000594980963	449827906	/nfs/dbraw/zinc/82/79/06/449827906.db2.gz	VTGXAFLFEYDGPO-UHFFFAOYSA-N	-1	3	348.359	2.469	20	5		EDBDHM
CCN1CC[C@H]([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)C1	ZINC000601359763	449872676	/nfs/dbraw/zinc/87/26/76/449872676.db2.gz	ZFASKTRQACDWIG-JTQLQIEISA-N	-1	3	331.369	1.415	20	5		EDBDHM
O=C(CNC(=O)c1ccc([O-])cc1)NCc1ccc([N+](=O)[O-])cc1	ZINC000608984974	449954946	/nfs/dbraw/zinc/95/49/46/449954946.db2.gz	FDXSOYXUNBOCHC-UHFFFAOYSA-N	-1	3	329.312	1.347	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CC2=CCOCC2)c(F)cc1[N+](=O)[O-]	ZINC000601425703	449944866	/nfs/dbraw/zinc/94/48/66/449944866.db2.gz	UOZZDQVEOAHFEJ-UHFFFAOYSA-N	-1	3	330.337	1.667	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]CC(=O)C1CCCC1	ZINC000599472018	450001447	/nfs/dbraw/zinc/00/14/47/450001447.db2.gz	LNUZUJUDTQEMRT-UHFFFAOYSA-N	-1	3	342.373	1.641	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CO[C@@H](C2CC2)C1	ZINC000599483201	450011046	/nfs/dbraw/zinc/01/10/46/450011046.db2.gz	SRGQPPNYRQHMEH-CMPLNLGQSA-N	-1	3	342.373	1.449	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCOC[C@H]2CCCO2)c([N+](=O)[O-])c1	ZINC000609675231	450083494	/nfs/dbraw/zinc/08/34/94/450083494.db2.gz	FOPIAQQPWCQQSH-GFCCVEGCSA-N	-1	3	344.389	1.377	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)c2nccn2C)c1C	ZINC000595382946	450097766	/nfs/dbraw/zinc/09/77/66/450097766.db2.gz	MBXFRHDGTRYDNX-NSHDSACASA-N	-1	3	338.389	1.985	20	5		EDBDHM
CCCN(CC)CC[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000175361740	527979480	/nfs/dbraw/zinc/97/94/80/527979480.db2.gz	WXHFURJPHPXVIU-UHFFFAOYSA-N	-1	3	333.385	1.744	20	5		EDBDHM
CC(C)[C@@H](O)C(C)(C)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000154990439	528608008	/nfs/dbraw/zinc/60/80/08/528608008.db2.gz	DQSAXTOPGZAEGV-CYBMUJFWSA-N	-1	3	330.406	1.916	20	5		EDBDHM
CO[C@@H](C)CC[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000264020864	536872643	/nfs/dbraw/zinc/87/26/43/536872643.db2.gz	WGQJSVZVSJSTSD-VIFPVBQESA-N	-1	3	346.361	1.069	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCOC1CCC1	ZINC000742336463	578277453	/nfs/dbraw/zinc/27/74/53/578277453.db2.gz	MCUMEYKPFOROQM-UHFFFAOYSA-N	-1	3	330.362	1.451	20	5		EDBDHM
O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(-c2nnn[n-]2)cn1	ZINC000737975288	578279001	/nfs/dbraw/zinc/27/90/01/578279001.db2.gz	YBLJUIRRWOSGPQ-UHFFFAOYSA-N	-1	3	325.288	1.351	20	5		EDBDHM
O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(-c2nn[n-]n2)cn1	ZINC000737975288	578279002	/nfs/dbraw/zinc/27/90/02/578279002.db2.gz	YBLJUIRRWOSGPQ-UHFFFAOYSA-N	-1	3	325.288	1.351	20	5		EDBDHM
O=C(OCc1ccc([N+](=O)[O-])cc1)c1ccc(-c2nnn[n-]2)cn1	ZINC000738231454	578328914	/nfs/dbraw/zinc/32/89/14/578328914.db2.gz	AFYUKJUGCYJMKV-UHFFFAOYSA-N	-1	3	326.272	1.527	20	5		EDBDHM
O=C(OCc1ccc([N+](=O)[O-])cc1)c1ccc(-c2nn[n-]n2)cn1	ZINC000738231454	578328915	/nfs/dbraw/zinc/32/89/15/578328915.db2.gz	AFYUKJUGCYJMKV-UHFFFAOYSA-N	-1	3	326.272	1.527	20	5		EDBDHM
CCC/C=C/C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000735060346	578854219	/nfs/dbraw/zinc/85/42/19/578854219.db2.gz	QXRKPQYHMPELHB-RUDMXATFSA-N	-1	3	341.389	1.346	20	5		EDBDHM
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)OCc1cc(=O)c([O-])co1	ZINC000735969356	578943781	/nfs/dbraw/zinc/94/37/81/578943781.db2.gz	QZGLGDJEVRNONS-UHFFFAOYSA-N	-1	3	334.284	1.677	20	5		EDBDHM
CO[C@@H](CNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C(F)(F)F	ZINC000736962285	579035965	/nfs/dbraw/zinc/03/59/65/579035965.db2.gz	NYACXWSVJSNBKM-VIFPVBQESA-N	-1	3	332.242	1.764	20	5		EDBDHM
CO[C@@H](CNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])C(F)(F)F	ZINC000736962285	579035966	/nfs/dbraw/zinc/03/59/66/579035966.db2.gz	NYACXWSVJSNBKM-VIFPVBQESA-N	-1	3	332.242	1.764	20	5		EDBDHM
Cc1ccc(NC(=O)c2ccc(-c3nnn[n-]3)cn2)cc1[N+](=O)[O-]	ZINC000737360486	579078574	/nfs/dbraw/zinc/07/85/74/579078574.db2.gz	OQKJSAVPWFXWON-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cc1ccc(NC(=O)c2ccc(-c3nn[n-]n3)cn2)cc1[N+](=O)[O-]	ZINC000737360486	579078576	/nfs/dbraw/zinc/07/85/76/579078576.db2.gz	OQKJSAVPWFXWON-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
O=C(Nc1ccc([N+](=O)[O-])cc1F)c1ccc(-c2nnn[n-]2)cn1	ZINC000738175952	579168005	/nfs/dbraw/zinc/16/80/05/579168005.db2.gz	QZLBTFNLRJWOFH-UHFFFAOYSA-N	-1	3	329.251	1.561	20	5		EDBDHM
O=C(Nc1ccc([N+](=O)[O-])cc1F)c1ccc(-c2nn[n-]n2)cn1	ZINC000738175952	579168008	/nfs/dbraw/zinc/16/80/08/579168008.db2.gz	QZLBTFNLRJWOFH-UHFFFAOYSA-N	-1	3	329.251	1.561	20	5		EDBDHM
O=C([O-])/C=C/c1ccc(N2CCCN(CCO)CC2)c([N+](=O)[O-])c1	ZINC000739625690	579227930	/nfs/dbraw/zinc/22/79/30/579227930.db2.gz	RADVBPGGMRGEHL-HWKANZROSA-N	-1	3	335.360	1.197	20	5		EDBDHM
NC(=O)CON=C([O-])Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1	ZINC000756607455	579953473	/nfs/dbraw/zinc/95/34/73/579953473.db2.gz	FGKRNUIKOUKGMV-UHFFFAOYSA-N	-1	3	346.299	1.926	20	5		EDBDHM
NC(=O)CO[N-]C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1	ZINC000756607455	579953474	/nfs/dbraw/zinc/95/34/74/579953474.db2.gz	FGKRNUIKOUKGMV-UHFFFAOYSA-N	-1	3	346.299	1.926	20	5		EDBDHM
CCO[C@H]1COCC[C@H]1[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000759181447	580000323	/nfs/dbraw/zinc/00/03/23/580000323.db2.gz	WMIYZIWEAJIAMK-OLZOCXBDSA-N	-1	3	344.314	1.997	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]Cc2cccnn2)cc1[N+](=O)[O-]	ZINC000767580641	580193503	/nfs/dbraw/zinc/19/35/03/580193503.db2.gz	WWSCOCJABRNVOC-UHFFFAOYSA-N	-1	3	342.764	1.825	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H](C)C[C@H](C)O)cc1[N+](=O)[O-]	ZINC000783000808	580591012	/nfs/dbraw/zinc/59/10/12/580591012.db2.gz	ZVBPTSVIVCBOPB-BDAKNGLRSA-N	-1	3	336.797	1.994	20	5		EDBDHM
CN(C)[C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000784724858	580627250	/nfs/dbraw/zinc/62/72/50/580627250.db2.gz	SQKNECQPFCUATB-GHMZBOCLSA-N	-1	3	331.369	1.495	20	5		EDBDHM
Cc1cccc(CC[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)n1	ZINC000795205512	580915633	/nfs/dbraw/zinc/91/56/33/580915633.db2.gz	JEOZLSVMYHMEQX-UHFFFAOYSA-N	-1	3	327.387	1.881	20	5		EDBDHM
CC(=O)N1CCC[C@H](C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000795263588	580916940	/nfs/dbraw/zinc/91/69/40/580916940.db2.gz	IARBREAPVIUBAF-SNVBAGLBSA-N	-1	3	347.418	1.193	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@H]2CCc3n[nH]cc3C2)c(-c2nnn[n-]2)c1	ZINC000738370098	598896094	/nfs/dbraw/zinc/89/60/94/598896094.db2.gz	NJDQQXCYIIZOJU-VIFPVBQESA-N	-1	3	326.320	1.467	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@H]2CCc3n[nH]cc3C2)c(-c2nn[n-]n2)c1	ZINC000738370098	598896095	/nfs/dbraw/zinc/89/60/95/598896095.db2.gz	NJDQQXCYIIZOJU-VIFPVBQESA-N	-1	3	326.320	1.467	20	5		EDBDHM
CN(C(=O)c1cc([N+](=O)[O-])cn1C)c1ccc(-c2nnn[n-]2)cc1F	ZINC000736748637	593027548	/nfs/dbraw/zinc/02/75/48/593027548.db2.gz	JEIUSROCJXVLSE-UHFFFAOYSA-N	-1	3	345.294	1.529	20	5		EDBDHM
CN(C(=O)c1cc([N+](=O)[O-])cn1C)c1ccc(-c2nn[n-]n2)cc1F	ZINC000736748637	593027551	/nfs/dbraw/zinc/02/75/51/593027551.db2.gz	JEIUSROCJXVLSE-UHFFFAOYSA-N	-1	3	345.294	1.529	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H]2C[C@H](C)OC2=O)cc1[N+](=O)[O-]	ZINC000841523115	593163787	/nfs/dbraw/zinc/16/37/87/593163787.db2.gz	LBVGUGLIOQSSDR-CBAPKCEASA-N	-1	3	348.764	1.539	20	5		EDBDHM
COC(=O)c1cc(C(=O)Oc2ccc(C(=O)OC)c([N+](=O)[O-])c2)c[n-]1	ZINC000816021377	593668909	/nfs/dbraw/zinc/66/89/09/593668909.db2.gz	MIPJFTQHGVAJOB-UHFFFAOYSA-N	-1	3	348.267	1.715	20	5		EDBDHM
C[C@@](O)(CNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])c1ccco1	ZINC000820467800	593820896	/nfs/dbraw/zinc/82/08/96/593820896.db2.gz	MUEPITKXOZYWLV-CQSZACIVSA-N	-1	3	330.304	1.688	20	5		EDBDHM
C[C@@](O)(CNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])c1ccco1	ZINC000820467800	593820897	/nfs/dbraw/zinc/82/08/97/593820897.db2.gz	MUEPITKXOZYWLV-CQSZACIVSA-N	-1	3	330.304	1.688	20	5		EDBDHM
CC(C)[C@H](O)C(C)(C)CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000824198325	593953602	/nfs/dbraw/zinc/95/36/02/593953602.db2.gz	BKQKXBZZHOKEOV-NSHDSACASA-N	-1	3	335.368	1.625	20	5		EDBDHM
CC(C)[C@H](O)C(C)(C)CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000824198325	593953604	/nfs/dbraw/zinc/95/36/04/593953604.db2.gz	BKQKXBZZHOKEOV-NSHDSACASA-N	-1	3	335.368	1.625	20	5		EDBDHM
Nc1ccc([N-]S(=O)(=O)N=S2(=O)CCCC2)cc1[N+](=O)[O-]	ZINC000821132155	593974027	/nfs/dbraw/zinc/97/40/27/593974027.db2.gz	JSJVRSQSQQVRIS-UHFFFAOYSA-N	-1	3	334.379	1.096	20	5		EDBDHM
CCO[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)C12CCC2	ZINC000821361428	594027856	/nfs/dbraw/zinc/02/78/56/594027856.db2.gz	USWIONWONJYILS-NEPJUHHUSA-N	-1	3	345.363	1.930	20	5		EDBDHM
CCO[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)C12CCC2	ZINC000821361428	594027859	/nfs/dbraw/zinc/02/78/59/594027859.db2.gz	USWIONWONJYILS-NEPJUHHUSA-N	-1	3	345.363	1.930	20	5		EDBDHM
Cn1cc(-c2nnn[n-]2)cc1C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000822641661	594078309	/nfs/dbraw/zinc/07/83/09/594078309.db2.gz	WADURHRQNPHGQD-UHFFFAOYSA-N	-1	3	327.304	1.043	20	5		EDBDHM
Cn1cc(-c2nn[n-]n2)cc1C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000822641661	594078311	/nfs/dbraw/zinc/07/83/11/594078311.db2.gz	WADURHRQNPHGQD-UHFFFAOYSA-N	-1	3	327.304	1.043	20	5		EDBDHM
NC(=O)[C@H]1CCCCC[C@H]1Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000822860411	594112617	/nfs/dbraw/zinc/11/26/17/594112617.db2.gz	UGXRQDFXTJBQOJ-WDEREUQCSA-N	-1	3	345.363	1.621	20	5		EDBDHM
NC(=O)[C@H]1CCCCC[C@H]1Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000822860411	594112618	/nfs/dbraw/zinc/11/26/18/594112618.db2.gz	UGXRQDFXTJBQOJ-WDEREUQCSA-N	-1	3	345.363	1.621	20	5		EDBDHM
CC[C@@H](OC)C(=O)Nc1cc(-c2nnn[n-]2)cc([N+](=O)[O-])c1Cl	ZINC000825154982	594137391	/nfs/dbraw/zinc/13/73/91/594137391.db2.gz	WTMDSJDQXDNZHU-SECBINFHSA-N	-1	3	340.727	1.792	20	5		EDBDHM
CC[C@@H](OC)C(=O)Nc1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl	ZINC000825154982	594137392	/nfs/dbraw/zinc/13/73/92/594137392.db2.gz	WTMDSJDQXDNZHU-SECBINFHSA-N	-1	3	340.727	1.792	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@H]2CCc3c2cccc3O)c(-c2nnn[n-]2)c1	ZINC000823651215	594224753	/nfs/dbraw/zinc/22/47/53/594224753.db2.gz	INFDQNSMFGWTTL-LBPRGKRZSA-N	-1	3	339.315	1.975	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@H]2CCc3c2cccc3O)c(-c2nn[n-]n2)c1	ZINC000823651215	594224754	/nfs/dbraw/zinc/22/47/54/594224754.db2.gz	INFDQNSMFGWTTL-LBPRGKRZSA-N	-1	3	339.315	1.975	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCNc2ccccn2)c(-c2nnn[n-]2)c1	ZINC000823651786	594224946	/nfs/dbraw/zinc/22/49/46/594224946.db2.gz	QJHVWHTTYAFNHZ-UHFFFAOYSA-N	-1	3	327.308	1.089	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCNc2ccccn2)c(-c2nn[n-]n2)c1	ZINC000823651786	594224947	/nfs/dbraw/zinc/22/49/47/594224947.db2.gz	QJHVWHTTYAFNHZ-UHFFFAOYSA-N	-1	3	327.308	1.089	20	5		EDBDHM
CNC(=O)[C@H]1CCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000826060192	594321139	/nfs/dbraw/zinc/32/11/39/594321139.db2.gz	IKROKTKBDJUFDC-ONGXEEELSA-N	-1	3	331.336	1.102	20	5		EDBDHM
CNC(=O)[C@H]1CCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000826060192	594321142	/nfs/dbraw/zinc/32/11/42/594321142.db2.gz	IKROKTKBDJUFDC-ONGXEEELSA-N	-1	3	331.336	1.102	20	5		EDBDHM
Cc1nn([C@H](C)C(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1[N+](=O)[O-]	ZINC000826333010	594430220	/nfs/dbraw/zinc/43/02/20/594430220.db2.gz	QIFUVASWKOFPQZ-SECBINFHSA-N	-1	3	342.319	1.480	20	5		EDBDHM
Cc1nn([C@H](C)C(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1[N+](=O)[O-]	ZINC000826333010	594430221	/nfs/dbraw/zinc/43/02/21/594430221.db2.gz	QIFUVASWKOFPQZ-SECBINFHSA-N	-1	3	342.319	1.480	20	5		EDBDHM
O=[N+]([O-])c1ccccc1OC[C@H](O)c1ccc(-c2nnn[n-]2)cc1	ZINC000826500657	594503317	/nfs/dbraw/zinc/50/33/17/594503317.db2.gz	GZVVGLNNGMBYKN-ZDUSSCGKSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1ccccc1OC[C@H](O)c1ccc(-c2nn[n-]n2)cc1	ZINC000826500657	594503319	/nfs/dbraw/zinc/50/33/19/594503319.db2.gz	GZVVGLNNGMBYKN-ZDUSSCGKSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=C([O-])N1CCC[C@H](CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1	ZINC000831981007	594716217	/nfs/dbraw/zinc/71/62/17/594716217.db2.gz	SGECUDYHLGJNQA-OLZOCXBDSA-N	-1	3	349.391	1.866	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl)[C@@H](C)O	ZINC000832309661	594741913	/nfs/dbraw/zinc/74/19/13/594741913.db2.gz	JKGVRZHUUKGSHI-SCZZXKLOSA-N	-1	3	336.797	1.994	20	5		EDBDHM
C[C@H]1CN(CCC(=O)[O-])CCN1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000833628450	594891978	/nfs/dbraw/zinc/89/19/78/594891978.db2.gz	IKPZKTYOVMEQKX-SWLSCSKDSA-N	-1	3	337.376	1.109	20	5		EDBDHM
COc1ccc(CN2C[C@H]3COCC[C@@]3(C(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000846281576	595196268	/nfs/dbraw/zinc/19/62/68/595196268.db2.gz	FPOFNCBGNQSNQZ-BLLLJJGKSA-N	-1	3	336.344	1.527	20	5		EDBDHM
O=C([O-])Cc1ccc(N2CCN(c3ccncc3)CC2)c([N+](=O)[O-])c1	ZINC000844206895	595302172	/nfs/dbraw/zinc/30/21/72/595302172.db2.gz	NVNWKJBWBCKVKL-UHFFFAOYSA-N	-1	3	342.355	1.944	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2F)nc1=N	ZINC000847180047	595371950	/nfs/dbraw/zinc/37/19/50/595371950.db2.gz	DRAQSRWSTWCAJW-NSHDSACASA-N	-1	3	334.311	1.252	20	5		EDBDHM
Cc1nn(C)cc1C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848587152	595410368	/nfs/dbraw/zinc/41/03/68/595410368.db2.gz	ROGXOIALAABZBO-UHFFFAOYSA-N	-1	3	340.286	1.925	20	5		EDBDHM
NC(=O)[C@@H]1CC[C@H]([N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000848590511	595411489	/nfs/dbraw/zinc/41/14/89/595411489.db2.gz	DTABWMGVYBWGMI-BDAKNGLRSA-N	-1	3	343.286	1.337	20	5		EDBDHM
CO[C@](C)(CO)C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848596850	595413910	/nfs/dbraw/zinc/41/39/10/595413910.db2.gz	ZJXAFWVJHKLHDN-LBPRGKRZSA-N	-1	3	334.275	1.080	20	5		EDBDHM
O=c1[n-]ccc(N2CCn3c(Br)cnc3C2)c1[N+](=O)[O-]	ZINC000853533541	595788877	/nfs/dbraw/zinc/78/88/77/595788877.db2.gz	BWKHHRDHSZGWME-UHFFFAOYSA-N	-1	3	340.137	1.675	20	5		EDBDHM
C[C@H]([N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)C1(CO)CC1	ZINC000853829572	595894264	/nfs/dbraw/zinc/89/42/64/595894264.db2.gz	GBQKCKBFPHDALR-VIFPVBQESA-N	-1	3	330.287	1.844	20	5		EDBDHM
COC(=O)[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000851882306	595961904	/nfs/dbraw/zinc/96/19/04/595961904.db2.gz	YIMJHZYBUBICPF-BDAKNGLRSA-N	-1	3	334.375	1.276	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C[C@H]2C[C@@H](O)C2)cc1[N+](=O)[O-]	ZINC000859363514	596067499	/nfs/dbraw/zinc/06/74/99/596067499.db2.gz	NMYGPCYHXLXSCD-DTORHVGOSA-N	-1	3	334.781	1.606	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCN(C3CC3)C2)cc1F	ZINC000866596517	596264404	/nfs/dbraw/zinc/26/44/04/596264404.db2.gz	GPZVVSMOUJYQCG-JTQLQIEISA-N	-1	3	343.380	1.557	20	5		EDBDHM
O=C([N-]OCCN1CCCC1=O)c1cccc([N+](=O)[O-])c1Cl	ZINC000862217671	596278074	/nfs/dbraw/zinc/27/80/74/596278074.db2.gz	NQVBAPXAYCGKIM-UHFFFAOYSA-N	-1	3	327.724	1.532	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](C)N(C)C2CC2)cc1F	ZINC000866724097	596311014	/nfs/dbraw/zinc/31/10/14/596311014.db2.gz	IABZTHYNJUIKQP-SNVBAGLBSA-N	-1	3	345.396	1.803	20	5		EDBDHM
C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)[N-]N1CCOC1=O	ZINC000862700096	596390727	/nfs/dbraw/zinc/39/07/27/596390727.db2.gz	ZWWWEKXGPZHGNH-ZETCQYMHSA-N	-1	3	329.696	1.499	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H]2CCCN(CCF)C2)cs1	ZINC000867711170	596509186	/nfs/dbraw/zinc/50/91/86/596509186.db2.gz	OSCQTSTULPFSML-SECBINFHSA-N	-1	3	337.398	1.369	20	5		EDBDHM
O=C(CC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)N1CCCCC1	ZINC000119605369	596670265	/nfs/dbraw/zinc/67/02/65/596670265.db2.gz	YZCCZQRFVGJQRP-UHFFFAOYSA-N	-1	3	347.418	1.337	20	5		EDBDHM
CC(C)[C@@](C)(CNC(=O)[O-])NCc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000738773676	603079983	/nfs/dbraw/zinc/07/99/83/603079983.db2.gz	UKEBFPSIZKJPCI-OAHLLOKOSA-N	-1	3	338.364	1.466	20	5		EDBDHM
CC(C)(C(=O)Nc1cccc(-c2nnn[n-]2)c1)n1cc([N+](=O)[O-])cn1	ZINC000102325209	219194180	/nfs/dbraw/zinc/19/41/80/219194180.db2.gz	PRPNUBOMSZXUEJ-UHFFFAOYSA-N	-1	3	342.319	1.345	20	5		EDBDHM
CC(C)(C(=O)Nc1cccc(-c2nn[n-]n2)c1)n1cc([N+](=O)[O-])cn1	ZINC000102325209	219194183	/nfs/dbraw/zinc/19/41/83/219194183.db2.gz	PRPNUBOMSZXUEJ-UHFFFAOYSA-N	-1	3	342.319	1.345	20	5		EDBDHM
O=c1cc(Cn2cc(Br)c([N+](=O)[O-])n2)nc(C2CC2)[n-]1	ZINC000412997800	304048961	/nfs/dbraw/zinc/04/89/61/304048961.db2.gz	XSBUCSOPDUNTNP-UHFFFAOYSA-N	-1	3	340.137	1.975	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCc2cscn2)cc1[N+](=O)[O-]	ZINC000124558479	138327820	/nfs/dbraw/zinc/32/78/20/138327820.db2.gz	AAKGFRJOMUDHEF-UHFFFAOYSA-N	-1	3	333.416	1.942	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@@H](C)[S@@](C)=O)c1C	ZINC000124004994	138322979	/nfs/dbraw/zinc/32/29/79/138322979.db2.gz	GAKVOMZFTZPQEQ-UZJPJQLHSA-N	-1	3	348.446	1.647	20	5		EDBDHM
CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000186991277	236088699	/nfs/dbraw/zinc/08/86/99/236088699.db2.gz	MVWUYXWWYQASGT-CQSZACIVSA-N	-1	3	344.371	1.598	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-][C@H](CO)C(C)(C)C)cc1[N+](=O)[O-]	ZINC000190127985	238236721	/nfs/dbraw/zinc/23/67/21/238236721.db2.gz	SRWOWAOHJIXOKI-GFCCVEGCSA-N	-1	3	334.369	1.728	20	5		EDBDHM
CCN1CCCC[C@H]1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000111353043	220144232	/nfs/dbraw/zinc/14/42/32/220144232.db2.gz	CHEJGNHYBKNQGS-LBPRGKRZSA-N	-1	3	327.406	1.748	20	5		EDBDHM
C[C@H](CNC(=O)c1cc([N+](=O)[O-])c[n-]c1=O)N(C)Cc1ccccc1	ZINC000111631035	220172795	/nfs/dbraw/zinc/17/27/95/220172795.db2.gz	BIHOBMKEYKIHRD-GFCCVEGCSA-N	-1	3	344.371	1.946	20	5		EDBDHM
CCOC(=O)Cn1cnc([N-]C(=O)c2ccc(OC)c([N+](=O)[O-])c2)n1	ZINC000425105596	252300571	/nfs/dbraw/zinc/30/05/71/252300571.db2.gz	ZFKFKOZCBWJMMF-UHFFFAOYSA-N	-1	3	349.303	1.010	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]c2cn(C)c(=O)cc2C)cc1[N+](=O)[O-]	ZINC000119307332	221290220	/nfs/dbraw/zinc/29/02/20/221290220.db2.gz	DDFHARCFTXIGQK-UHFFFAOYSA-N	-1	3	343.386	1.773	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2(C)OCCO2)c1C	ZINC000271073489	140231207	/nfs/dbraw/zinc/23/12/07/140231207.db2.gz	PMPCNIWEFDFBDM-UHFFFAOYSA-N	-1	3	330.362	1.253	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)[C@H]2CCCCO2)c([N+](=O)[O-])c1	ZINC000272089145	140398790	/nfs/dbraw/zinc/39/87/90/140398790.db2.gz	UVIDIGFQELWSLT-ZWNOBZJWSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CC(C)[C@@H](CO)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000344832841	143017552	/nfs/dbraw/zinc/01/75/52/143017552.db2.gz	QVFCOPAPOVTOTQ-SECBINFHSA-N	-1	3	336.797	1.791	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CCCCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000344966042	143032195	/nfs/dbraw/zinc/03/21/95/143032195.db2.gz	INUBCTNTPCOANH-DGCLKSJQSA-N	-1	3	328.390	1.875	20	5		EDBDHM
CO[C@@H](CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(F)(F)F	ZINC000345361556	143082470	/nfs/dbraw/zinc/08/24/70/143082470.db2.gz	YPKDLHMJUAOOSH-JTQLQIEISA-N	-1	3	342.295	1.841	20	5		EDBDHM
Cc1noc([C@H](C)[N-]S(=O)(=O)CCc2ccccc2[N+](=O)[O-])n1	ZINC000347025285	143273168	/nfs/dbraw/zinc/27/31/68/143273168.db2.gz	PANIRDJRWOYUJP-VIFPVBQESA-N	-1	3	340.361	1.509	20	5		EDBDHM
CCn1ccc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)n1	ZINC000416582404	304334047	/nfs/dbraw/zinc/33/40/47/304334047.db2.gz	LBXFTZAFKABYFY-UHFFFAOYSA-N	-1	3	338.389	1.907	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CN(C3CC3)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000331416882	292184854	/nfs/dbraw/zinc/18/48/54/292184854.db2.gz	AGCMNJRLXIBXTL-AAEUAGOBSA-N	-1	3	339.417	1.664	20	5		EDBDHM
Cn1c2ccc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)cc2n(C)c1=O	ZINC000352805192	149174519	/nfs/dbraw/zinc/17/45/19/149174519.db2.gz	KAGYWVJBZDWUOG-UHFFFAOYSA-N	-1	3	343.299	1.138	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H](CO)c1cccc(F)c1	ZINC000352880837	149202175	/nfs/dbraw/zinc/20/21/75/149202175.db2.gz	ILMVPJCWYIIJKN-GFCCVEGCSA-N	-1	3	340.332	1.746	20	5		EDBDHM
COC(=O)[C@H]([N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000355620283	150340250	/nfs/dbraw/zinc/34/02/50/150340250.db2.gz	PEEFDPUWYCLMRT-CYBMUJFWSA-N	-1	3	344.389	1.254	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CSC[C@H]1C	ZINC000352347145	162133018	/nfs/dbraw/zinc/13/30/18/162133018.db2.gz	VGKVTMUONUVWEI-SCZZXKLOSA-N	-1	3	332.403	1.633	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCOC(C)C	ZINC000273393395	268041424	/nfs/dbraw/zinc/04/14/24/268041424.db2.gz	DVJLVOOIHGTISQ-UHFFFAOYSA-N	-1	3	346.361	1.085	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CCOCC2CC2)cc1[N+](=O)[O-]	ZINC000275084597	268278447	/nfs/dbraw/zinc/27/84/47/268278447.db2.gz	OWNIOEUKNKTTAU-UHFFFAOYSA-N	-1	3	348.352	1.447	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCO[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000275360456	268329563	/nfs/dbraw/zinc/32/95/63/268329563.db2.gz	IPNQHFSRDRUFMP-DTWKUNHWSA-N	-1	3	348.352	1.588	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CC(=O)C(C)(C)C)cc1[N+](=O)[O-]	ZINC000275380538	268333456	/nfs/dbraw/zinc/33/34/56/268333456.db2.gz	MFFFKEZCCPKNLH-UHFFFAOYSA-N	-1	3	348.352	1.636	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CC(=O)[N-]c1nncn1-c1ccccc1	ZINC000181115328	272944114	/nfs/dbraw/zinc/94/41/14/272944114.db2.gz	DZWXJTCSEKBBHV-UHFFFAOYSA-N	-1	3	327.304	1.319	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCC1(C)CC1	ZINC000280516560	273365982	/nfs/dbraw/zinc/36/59/82/273365982.db2.gz	QKKTXUHFLIARQV-UHFFFAOYSA-N	-1	3	342.373	1.850	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]CCCCCO)cc1[N+](=O)[O-]	ZINC000289090485	288627994	/nfs/dbraw/zinc/62/79/94/288627994.db2.gz	GSSZYIDPLORRFN-UHFFFAOYSA-N	-1	3	336.797	1.998	20	5		EDBDHM
CC(C)C1([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000293825963	303024951	/nfs/dbraw/zinc/02/49/51/303024951.db2.gz	PJHRKYAKMFHTSY-UHFFFAOYSA-N	-1	3	342.373	1.833	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(Sc3nnnn3C[C@H]3CCCO3)[n-]c2c1	ZINC000295005025	303161893	/nfs/dbraw/zinc/16/18/93/303161893.db2.gz	AKFFMLDXPDERSH-SECBINFHSA-N	-1	3	347.360	1.788	20	5		EDBDHM
O=[N+]([O-])c1ccc2[n-]c(Sc3nnnn3C[C@H]3CCCO3)nc2c1	ZINC000295005025	303161895	/nfs/dbraw/zinc/16/18/95/303161895.db2.gz	AKFFMLDXPDERSH-SECBINFHSA-N	-1	3	347.360	1.788	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCC(C)(C)CO)c1[N+](=O)[O-]	ZINC000295364195	303209458	/nfs/dbraw/zinc/20/94/58/303209458.db2.gz	SDJOQKQPKOEZBW-UHFFFAOYSA-N	-1	3	330.406	1.899	20	5		EDBDHM
C[C@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)c2nccn21	ZINC000451948455	305373279	/nfs/dbraw/zinc/37/32/79/305373279.db2.gz	UKIPWGRFLBQSMS-GZMMTYOYSA-N	-1	3	340.336	1.915	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCCCn2ccnc2)cc1[N+](=O)[O-]	ZINC000545226582	306082700	/nfs/dbraw/zinc/08/27/00/306082700.db2.gz	RIPFBOSDTFFRJU-UHFFFAOYSA-N	-1	3	344.418	1.920	20	5		EDBDHM
NC(=O)c1cc([N-]C(=O)c2ccc([N+](=O)[O-])s2)cc(C(N)=O)c1	ZINC000015927143	441213784	/nfs/dbraw/zinc/21/37/84/441213784.db2.gz	BZEIJTVKBZRLFT-UHFFFAOYSA-N	-1	3	334.313	1.106	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCO[C@@H]1CCCCO1	ZINC000059582600	441228835	/nfs/dbraw/zinc/22/88/35/441228835.db2.gz	NWMWEERKZIDGLT-CYBMUJFWSA-N	-1	3	330.362	1.416	20	5		EDBDHM
CCOC(=O)Cc1csc([N-]C(=O)c2n[nH]c(C)c2[N+](=O)[O-])n1	ZINC000064354483	441375837	/nfs/dbraw/zinc/37/58/37/441375837.db2.gz	AQTSEGZZLDKKDV-UHFFFAOYSA-N	-1	3	339.333	1.441	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)[C@H]1CCCO1	ZINC000032433336	441556200	/nfs/dbraw/zinc/55/62/00/441556200.db2.gz	WWFHWAJNRXHFEO-MWLCHTKSSA-N	-1	3	330.362	1.449	20	5		EDBDHM
COCc1nsc([N-]C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)n1	ZINC000133761026	442432465	/nfs/dbraw/zinc/43/24/65/442432465.db2.gz	BBNDVTMIUUSQTE-UHFFFAOYSA-N	-1	3	334.317	1.721	20	5		EDBDHM
CCN1CCC[C@H]([N-]S(=O)(=O)c2cc(F)c(C)c([N+](=O)[O-])c2)C1	ZINC000186388486	442523574	/nfs/dbraw/zinc/52/35/74/442523574.db2.gz	JPGGVAMOOHZIKN-NSHDSACASA-N	-1	3	345.396	1.805	20	5		EDBDHM
O=C(c1c[n-]c(=O)c([N+](=O)[O-])c1)N1CCN(C2CCCCC2)CC1	ZINC000193729555	442774963	/nfs/dbraw/zinc/77/49/63/442774963.db2.gz	YPUOELXGOQOESQ-UHFFFAOYSA-N	-1	3	334.376	1.786	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H](CCO)c2ccco2)c(F)c1	ZINC000184269929	443006953	/nfs/dbraw/zinc/00/69/53/443006953.db2.gz	WICDCPIUMKDAHR-NSHDSACASA-N	-1	3	344.320	1.729	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-][C@@H]1Cc2ccccc2[C@H]1O	ZINC000184548837	443038615	/nfs/dbraw/zinc/03/86/15/443038615.db2.gz	YQJHNAJQVAMMMG-GDBMZVCRSA-N	-1	3	348.380	1.673	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]C[C@@]2(C)CCCO2)cc1[N+](=O)[O-]	ZINC000185121826	443141959	/nfs/dbraw/zinc/14/19/59/443141959.db2.gz	FIKWYEWBDIHGCM-CYBMUJFWSA-N	-1	3	332.353	1.890	20	5		EDBDHM
C[C@H]1CN(C2CC2)C[C@H]1[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000268816955	443117489	/nfs/dbraw/zinc/11/74/89/443117489.db2.gz	WCRQFZUCILVWHA-JOYOIKCWSA-N	-1	3	343.380	1.495	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H](OC)C(C)C)c([N+](=O)[O-])c1	ZINC000266722439	443219839	/nfs/dbraw/zinc/21/98/39/443219839.db2.gz	JUFXGBZPJACMDH-LBPRGKRZSA-N	-1	3	332.378	1.553	20	5		EDBDHM
CSC[C@@](C)(O)C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000269769513	443433761	/nfs/dbraw/zinc/43/37/61/443433761.db2.gz	MDALTLIJSNDTHZ-ZDUSSCGKSA-N	-1	3	348.446	1.604	20	5		EDBDHM
CCC(O)(CC)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000269802092	443447499	/nfs/dbraw/zinc/44/74/99/443447499.db2.gz	PFGMZXUOGRWWPN-UHFFFAOYSA-N	-1	3	332.378	1.433	20	5		EDBDHM
CCOC(=O)[C@H](C)[C@@H](C)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000273051022	443528065	/nfs/dbraw/zinc/52/80/65/443528065.db2.gz	GGXIOTZVIZSDEX-NXEZZACHSA-N	-1	3	330.362	1.461	20	5		EDBDHM
COCCOCC[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276778518	443823516	/nfs/dbraw/zinc/82/35/16/443823516.db2.gz	HXTQBLFHNKFNCY-UHFFFAOYSA-N	-1	3	332.378	1.153	20	5		EDBDHM
CCC[C@@]1([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)CCOC1	ZINC000285154031	443875977	/nfs/dbraw/zinc/87/59/77/443875977.db2.gz	ADGTZZCCLBWGBH-CQSZACIVSA-N	-1	3	344.389	1.841	20	5		EDBDHM
COc1ccc(C(=O)N2CCC[C@H]2c2nc(=N)n(C)[n-]2)cc1[N+](=O)[O-]	ZINC000555530451	320968693	/nfs/dbraw/zinc/96/86/93/320968693.db2.gz	OGPQZLYWOJPMBZ-JTQLQIEISA-N	-1	3	346.347	1.122	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CCCCCO)cc1[N+](=O)[O-]	ZINC000289217257	444079611	/nfs/dbraw/zinc/07/96/11/444079611.db2.gz	QPTQBYPZLKNRTF-UHFFFAOYSA-N	-1	3	336.341	1.183	20	5		EDBDHM
CN1CCN(c2nccc3cc([N+](=O)[O-])ccc32)C[C@H](C(=O)[O-])C1	ZINC000565367706	321184124	/nfs/dbraw/zinc/18/41/24/321184124.db2.gz	NOCPOIIMIZPVQI-GFCCVEGCSA-N	-1	3	330.344	1.596	20	5		EDBDHM
O=C(NCc1ccc([O-])c(Br)c1)c1c[nH]nc1[N+](=O)[O-]	ZINC000574620599	321492090	/nfs/dbraw/zinc/49/20/90/321492090.db2.gz	YZTPUHQJVQJBML-UHFFFAOYSA-N	-1	3	341.121	1.716	20	5		EDBDHM
CC(C)N(C)C[C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000289618432	444181638	/nfs/dbraw/zinc/18/16/38/444181638.db2.gz	RHVOMBCGWQAHPY-SNVBAGLBSA-N	-1	3	333.385	1.741	20	5		EDBDHM
CC[C@H](C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC	ZINC000316878653	444312796	/nfs/dbraw/zinc/31/27/96/444312796.db2.gz	LNBYKGHXTZQSKX-VIFPVBQESA-N	-1	3	330.362	1.706	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CC[C@H](O)CC2)c([N+](=O)[O-])c1	ZINC000318304347	444318919	/nfs/dbraw/zinc/31/89/19/444318919.db2.gz	MMJFHUZZQZZQRR-MGCOHNPYSA-N	-1	3	330.362	1.185	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@](C)(O)C(C)C	ZINC000319815015	444325987	/nfs/dbraw/zinc/32/59/87/444325987.db2.gz	DSNVAVLDLSOEGS-CYBMUJFWSA-N	-1	3	332.378	1.289	20	5		EDBDHM
COC(=O)c1cc(C(=O)Nc2cc(C(=O)OC)cc([N+](=O)[O-])c2)c[n-]1	ZINC000340512878	444419856	/nfs/dbraw/zinc/41/98/56/444419856.db2.gz	WXLRIDQCDQPMDL-UHFFFAOYSA-N	-1	3	347.283	1.748	20	5		EDBDHM
Cc1noc([C@@H](C)[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])n1	ZINC000338901139	444921767	/nfs/dbraw/zinc/92/17/67/444921767.db2.gz	GWZVNLOFAVDOFM-MRVPVSSYSA-N	-1	3	326.334	1.634	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-][C@H]1CCC[C@@H]1F)OCCO2	ZINC000339118041	445039669	/nfs/dbraw/zinc/03/96/69/445039669.db2.gz	DLGCNEXSEJKQLV-IUCAKERBSA-N	-1	3	346.336	1.535	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCC(=O)NC(C)(C)C)c([N+](=O)[O-])c1	ZINC000341866820	445042212	/nfs/dbraw/zinc/04/22/12/445042212.db2.gz	MWESDKZWTMOASI-UHFFFAOYSA-N	-1	3	343.405	1.486	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCc1ccncc1	ZINC000355794632	445481809	/nfs/dbraw/zinc/48/18/09/445481809.db2.gz	NMENRIKGCTVOFG-UHFFFAOYSA-N	-1	3	337.357	1.519	20	5		EDBDHM
CN1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@H](C(=O)[O-])C1	ZINC000583207558	326026851	/nfs/dbraw/zinc/02/68/51/326026851.db2.gz	SLEFHZJVLSJOMC-GFCCVEGCSA-N	-1	3	330.344	1.596	20	5		EDBDHM
O=C(NC1CCN([C@@H]2CCOC2)CC1)c1cccc([N+](=O)[O-])c1[O-]	ZINC000362220010	446269560	/nfs/dbraw/zinc/26/95/60/446269560.db2.gz	LFWXVOBUNXBSFC-GFCCVEGCSA-N	-1	3	335.360	1.284	20	5		EDBDHM
COC(=O)[C@H](CC1CC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000416594005	447655975	/nfs/dbraw/zinc/65/59/75/447655975.db2.gz	VZIYNOAOEITYTL-NSHDSACASA-N	-1	3	346.336	1.354	20	5		EDBDHM
O=C([N-]c1nc2cc3c(cc2s1)OCCO3)c1c[nH]nc1[N+](=O)[O-]	ZINC000576092938	447969924	/nfs/dbraw/zinc/96/99/24/447969924.db2.gz	UPAURANMQXCCSU-UHFFFAOYSA-N	-1	3	347.312	1.951	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1[N-]c1ccn(CCO)n1	ZINC000566601144	448515163	/nfs/dbraw/zinc/51/51/63/448515163.db2.gz	ZIECBEHFKUCWHV-UHFFFAOYSA-N	-1	3	340.723	1.967	20	5		EDBDHM
O=C([O-])CN1CCCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1	ZINC000578893230	448664785	/nfs/dbraw/zinc/66/47/85/448664785.db2.gz	BKYYMWAWPDPNBZ-UHFFFAOYSA-N	-1	3	330.344	1.740	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)c1nccs1	ZINC000593574999	449083770	/nfs/dbraw/zinc/08/37/70/449083770.db2.gz	BXTOACNYTBHZSH-QMMMGPOBSA-N	-1	3	328.375	1.528	20	5		EDBDHM
CN1CCC2(CC1)CN(C(=O)c1ccc([N+](=O)[O-])cc1[O-])CCO2	ZINC000592898608	449042816	/nfs/dbraw/zinc/04/28/16/449042816.db2.gz	JHKFEFFOATXONQ-UHFFFAOYSA-N	-1	3	335.360	1.237	20	5		EDBDHM
CC(C)(CO)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C1CC1	ZINC000593596494	449096811	/nfs/dbraw/zinc/09/68/11/449096811.db2.gz	CJZNWXGEUSKGQJ-LBPRGKRZSA-N	-1	3	329.378	1.065	20	5		EDBDHM
CCO[C@@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593604095	449102116	/nfs/dbraw/zinc/10/21/16/449102116.db2.gz	GULNMXCDHVITMO-VXGBXAGGSA-N	-1	3	329.378	1.616	20	5		EDBDHM
CN1CCN(c2ccncc2NC(=O)c2ccc([N+](=O)[O-])[n-]2)CC1	ZINC000604342281	449209734	/nfs/dbraw/zinc/20/97/34/449209734.db2.gz	HXZLRGQIAREOPV-UHFFFAOYSA-N	-1	3	330.348	1.322	20	5		EDBDHM
C[C@H](NCc1nc2c(cnn2C)c(=O)[n-]1)c1cccc([N+](=O)[O-])c1	ZINC000611383725	449277550	/nfs/dbraw/zinc/27/75/50/449277550.db2.gz	PZVVNYJWUJGPDM-VIFPVBQESA-N	-1	3	328.332	1.828	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](C)C(=O)OC(C)C	ZINC000590764210	449284460	/nfs/dbraw/zinc/28/44/60/449284460.db2.gz	UCCGAFPSOVIPLN-VIFPVBQESA-N	-1	3	346.361	1.222	20	5		EDBDHM
C[C@H](COCC(F)(F)F)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593536955	449332514	/nfs/dbraw/zinc/33/25/14/449332514.db2.gz	YRGGYRXLEPOHQU-SSDOTTSWSA-N	-1	3	343.283	1.236	20	5		EDBDHM
CC(C)(C)N1CC[C@H]1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000594792449	449702436	/nfs/dbraw/zinc/70/24/36/449702436.db2.gz	QVXIKLLMYRKCQT-NSHDSACASA-N	-1	3	327.406	1.746	20	5		EDBDHM
CCN1CC[C@@H]([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)C1	ZINC000601359764	449872949	/nfs/dbraw/zinc/87/29/49/449872949.db2.gz	ZFASKTRQACDWIG-SNVBAGLBSA-N	-1	3	331.369	1.415	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2C[C@H](C)N(C3CC3)C2)c([N+](=O)[O-])s1	ZINC000601368643	449882492	/nfs/dbraw/zinc/88/24/92/449882492.db2.gz	ZPJFUPAXLWGDHS-WPRPVWTQSA-N	-1	3	345.446	1.868	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1[C@@H](C)[C@@H](C)O[C@H]1C	ZINC000599460162	449993299	/nfs/dbraw/zinc/99/32/99/449993299.db2.gz	UDGMIOINBICJCM-NOHGZBONSA-N	-1	3	328.390	1.993	20	5		EDBDHM
CCCN1CC[C@H]([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C1	ZINC000595353653	450067788	/nfs/dbraw/zinc/06/77/88/450067788.db2.gz	JEIUWRVTMIJZMN-JTQLQIEISA-N	-1	3	333.435	1.727	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2nnc3[n-][nH+]c(C)c(C)c2-3)n1	ZINC000597637491	450162380	/nfs/dbraw/zinc/16/23/80/450162380.db2.gz	IMJWYZLVNPFRLI-UHFFFAOYSA-N	-1	3	330.308	1.347	20	5		EDBDHM
CC1CCN(CCC[N-]S(=O)(=O)c2cccnc2[N+](=O)[O-])CC1	ZINC000610260384	450172432	/nfs/dbraw/zinc/17/24/32/450172432.db2.gz	XVUKYZBQYYMGIK-UHFFFAOYSA-N	-1	3	342.421	1.390	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](C)C1(CO)CC1	ZINC000594825829	486637185	/nfs/dbraw/zinc/63/71/85/486637185.db2.gz	CKLFEWYMGPRBEV-SECBINFHSA-N	-1	3	330.362	1.043	20	5		EDBDHM
COC(=O)c1ccc(S(=O)(=O)[N-][C@H]2CCC[C@H]2F)cc1[N+](=O)[O-]	ZINC000416491265	491008971	/nfs/dbraw/zinc/00/89/71/491008971.db2.gz	XLRMDVCHXONYDM-MNOVXSKESA-N	-1	3	346.336	1.550	20	5		EDBDHM
C[C@H](CN(C)c1ncc(Br)cc1[N+](=O)[O-])c1nnn[n-]1	ZINC000132892245	534032623	/nfs/dbraw/zinc/03/26/23/534032623.db2.gz	RHTILMYNVWSHHS-ZCFIWIBFSA-N	-1	3	342.157	1.505	20	5		EDBDHM
C[C@H](CN(C)c1ncc(Br)cc1[N+](=O)[O-])c1nn[n-]n1	ZINC000132892245	534032627	/nfs/dbraw/zinc/03/26/27/534032627.db2.gz	RHTILMYNVWSHHS-ZCFIWIBFSA-N	-1	3	342.157	1.505	20	5		EDBDHM
O=C(NCc1ccc(-c2nnn[n-]2)cc1F)c1ccc([N+](=O)[O-])[nH]1	ZINC000738102470	578548914	/nfs/dbraw/zinc/54/89/14/578548914.db2.gz	PDPURYMZLGDETF-UHFFFAOYSA-N	-1	3	331.267	1.172	20	5		EDBDHM
O=C(NCc1ccc(-c2nn[n-]n2)cc1F)c1ccc([N+](=O)[O-])[nH]1	ZINC000738102470	578548915	/nfs/dbraw/zinc/54/89/15/578548915.db2.gz	PDPURYMZLGDETF-UHFFFAOYSA-N	-1	3	331.267	1.172	20	5		EDBDHM
C[C@@](O)(CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)c1ccsc1	ZINC000736142891	578957116	/nfs/dbraw/zinc/95/71/16/578957116.db2.gz	PUIBVHPJOYAWDE-CYBMUJFWSA-N	-1	3	347.360	1.551	20	5		EDBDHM
C[C@@](O)(CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)c1ccsc1	ZINC000736142891	578957117	/nfs/dbraw/zinc/95/71/17/578957117.db2.gz	PUIBVHPJOYAWDE-CYBMUJFWSA-N	-1	3	347.360	1.551	20	5		EDBDHM
C[C@H]1CN(c2cc(-c3nnn[n-]3)c3cc([N+](=O)[O-])ccc3n2)CCO1	ZINC000736290158	578974001	/nfs/dbraw/zinc/97/40/01/578974001.db2.gz	PBHXJALIIZOOHM-VIFPVBQESA-N	-1	3	341.331	1.548	20	5		EDBDHM
C[C@H]1CN(c2cc(-c3nn[n-]n3)c3cc([N+](=O)[O-])ccc3n2)CCO1	ZINC000736290158	578974002	/nfs/dbraw/zinc/97/40/02/578974002.db2.gz	PBHXJALIIZOOHM-VIFPVBQESA-N	-1	3	341.331	1.548	20	5		EDBDHM
COc1cc(-c2nnn[n-]2)ccc1OCCn1nccc1[N+](=O)[O-]	ZINC000737031901	579041950	/nfs/dbraw/zinc/04/19/50/579041950.db2.gz	HLOOSLYHESXJJY-UHFFFAOYSA-N	-1	3	331.292	1.059	20	5		EDBDHM
COc1cc(-c2nn[n-]n2)ccc1OCCn1nccc1[N+](=O)[O-]	ZINC000737031901	579041951	/nfs/dbraw/zinc/04/19/51/579041951.db2.gz	HLOOSLYHESXJJY-UHFFFAOYSA-N	-1	3	331.292	1.059	20	5		EDBDHM
CN1CCC2(CCN2C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC1	ZINC000737515157	579102986	/nfs/dbraw/zinc/10/29/86/579102986.db2.gz	QJWZHPPJIVLMCQ-UHFFFAOYSA-N	-1	3	333.344	1.603	20	5		EDBDHM
Cc1c(CO)cc([N+](=O)[O-])c([N-]CC(=O)NCC2CC2)c1[N+](=O)[O-]	ZINC000778009814	580454869	/nfs/dbraw/zinc/45/48/69/580454869.db2.gz	LRFYQKDBSTWWQN-UHFFFAOYSA-N	-1	3	338.320	1.242	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](CCO)C1CC1	ZINC000751442865	579807178	/nfs/dbraw/zinc/80/71/78/579807178.db2.gz	NHEYPDBUVJOMDN-NSHDSACASA-N	-1	3	330.362	1.043	20	5		EDBDHM
O=[N+]([O-])c1ccc[n-]c1=NNS(=O)(=O)c1cccc2cccnc21	ZINC000759169646	580000089	/nfs/dbraw/zinc/00/00/89/580000089.db2.gz	UEXFTKGERSLSST-UHFFFAOYSA-N	-1	3	345.340	1.843	20	5		EDBDHM
Cc1noc(CCC[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)n1	ZINC000768839339	580221903	/nfs/dbraw/zinc/22/19/03/580221903.db2.gz	QDISAKSCDFFQBK-UHFFFAOYSA-N	-1	3	332.363	1.259	20	5		EDBDHM
CCO[C@@H]1COCC[C@@H]1[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768890997	580223679	/nfs/dbraw/zinc/22/36/79/580223679.db2.gz	KOXLIJAGZZKXQP-VHSXEESVSA-N	-1	3	336.391	1.129	20	5		EDBDHM
CN1CCC(O[N-]C(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)CC1	ZINC000773540229	580340188	/nfs/dbraw/zinc/34/01/88/580340188.db2.gz	FXPYTDQNKKGMEE-OAHLLOKOSA-N	-1	3	348.359	1.230	20	5		EDBDHM
Nc1ccc(N2CCN(C(=O)c3ccccc3[O-])CC2)c([N+](=O)[O-])c1	ZINC000786574922	580674115	/nfs/dbraw/zinc/67/41/15/580674115.db2.gz	GVXXLIQNAZTIRS-UHFFFAOYSA-N	-1	3	342.355	1.845	20	5		EDBDHM
O=C1[N-]C(=O)[C@]2(CCCN(c3nc4ccc([N+](=O)[O-])cc4s3)C2)N1	ZINC000788579350	580724979	/nfs/dbraw/zinc/72/49/79/580724979.db2.gz	YLWCYEJKQWRVLP-CQSZACIVSA-N	-1	3	347.356	1.383	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1cccnc1F	ZINC000795264524	580917024	/nfs/dbraw/zinc/91/70/24/580917024.db2.gz	BYRCOBBTBVKCSZ-UHFFFAOYSA-N	-1	3	341.320	1.616	20	5		EDBDHM
COc1c([O-])ccc(CN(C)C[C@@H]2CCN(C(C)=O)C2)c1[N+](=O)[O-]	ZINC000892240793	590881628	/nfs/dbraw/zinc/88/16/28/590881628.db2.gz	HNYSROVKRFOPDJ-LBPRGKRZSA-N	-1	3	337.376	1.609	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@H]2CC[C@H](C3CC3)O2)cs1	ZINC000907468128	592650321	/nfs/dbraw/zinc/65/03/21/592650321.db2.gz	CWZBABQWLLTJNR-MWLCHTKSSA-N	-1	3	332.403	1.892	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)OCc1cccc(-c2nnn[n-]2)c1	ZINC000737497794	593074399	/nfs/dbraw/zinc/07/43/99/593074399.db2.gz	GSPDDVLBSWSDQH-UHFFFAOYSA-N	-1	3	340.299	1.835	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)OCc1cccc(-c2nn[n-]n2)c1	ZINC000737497794	593074401	/nfs/dbraw/zinc/07/44/01/593074401.db2.gz	GSPDDVLBSWSDQH-UHFFFAOYSA-N	-1	3	340.299	1.835	20	5		EDBDHM
C[C@@H](OC(=O)c1cnn[n-]1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000805605513	593111218	/nfs/dbraw/zinc/11/12/18/593111218.db2.gz	JEFCQHMVJOUMLB-SSDOTTSWSA-N	-1	3	330.260	1.681	20	5		EDBDHM
C[C@@H](OC(=O)c1c[n-]nn1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000805605513	593111220	/nfs/dbraw/zinc/11/12/20/593111220.db2.gz	JEFCQHMVJOUMLB-SSDOTTSWSA-N	-1	3	330.260	1.681	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@@H](C)OC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)on1	ZINC000838280737	593149046	/nfs/dbraw/zinc/14/90/46/593149046.db2.gz	GNOMMLRJBKFWFA-NOZJJQNGSA-N	-1	3	349.299	1.495	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NCCOC[C@H]1CCCO1	ZINC000738357153	599059265	/nfs/dbraw/zinc/05/92/65/599059265.db2.gz	DEFKZWWKZJEGAH-LLVKDONJSA-N	-1	3	334.336	1.382	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NCCOC[C@H]1CCCO1	ZINC000738357153	599059268	/nfs/dbraw/zinc/05/92/68/599059268.db2.gz	DEFKZWWKZJEGAH-LLVKDONJSA-N	-1	3	334.336	1.382	20	5		EDBDHM
CC(=O)OC1CCN(c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000824009970	593907115	/nfs/dbraw/zinc/90/71/15/593907115.db2.gz	GVYMTXRXGDHRGI-UHFFFAOYSA-N	-1	3	332.320	1.307	20	5		EDBDHM
CC(=O)OC1CCN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000824009970	593907116	/nfs/dbraw/zinc/90/71/16/593907116.db2.gz	GVYMTXRXGDHRGI-UHFFFAOYSA-N	-1	3	332.320	1.307	20	5		EDBDHM
CCC(CC)(CCO)CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820887744	593915496	/nfs/dbraw/zinc/91/54/96/593915496.db2.gz	OPNZLSXIGYOTHW-UHFFFAOYSA-N	-1	3	335.368	1.771	20	5		EDBDHM
CCC(CC)(CCO)CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820887744	593915499	/nfs/dbraw/zinc/91/54/99/593915499.db2.gz	OPNZLSXIGYOTHW-UHFFFAOYSA-N	-1	3	335.368	1.771	20	5		EDBDHM
Cc1cc(C)n(CCCNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)n1	ZINC000822198750	594007601	/nfs/dbraw/zinc/00/76/01/594007601.db2.gz	IXDQUQPIHMXZLG-UHFFFAOYSA-N	-1	3	343.351	1.485	20	5		EDBDHM
Cc1cc(C)n(CCCNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)n1	ZINC000822198750	594007605	/nfs/dbraw/zinc/00/76/05/594007605.db2.gz	IXDQUQPIHMXZLG-UHFFFAOYSA-N	-1	3	343.351	1.485	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(Cc2ccc(-c3nnn[n-]3)cc2F)c1=O	ZINC000822212838	594010907	/nfs/dbraw/zinc/01/09/07/594010907.db2.gz	JGHDGOLSNAYNMH-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(Cc2ccc(-c3nn[n-]n3)cc2F)c1=O	ZINC000822212838	594010908	/nfs/dbraw/zinc/01/09/08/594010908.db2.gz	JGHDGOLSNAYNMH-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cn1c(C(=O)NCc2cc(-c3nnn[n-]3)ccc2F)ccc1[N+](=O)[O-]	ZINC000822595661	594071282	/nfs/dbraw/zinc/07/12/82/594071282.db2.gz	BFBVHTJNBQAOAJ-UHFFFAOYSA-N	-1	3	345.294	1.183	20	5		EDBDHM
Cn1c(C(=O)NCc2cc(-c3nn[n-]n3)ccc2F)ccc1[N+](=O)[O-]	ZINC000822595661	594071284	/nfs/dbraw/zinc/07/12/84/594071284.db2.gz	BFBVHTJNBQAOAJ-UHFFFAOYSA-N	-1	3	345.294	1.183	20	5		EDBDHM
CCC1(O)CCC(Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000825176557	594142634	/nfs/dbraw/zinc/14/26/34/594142634.db2.gz	XRYLKFGGODOQLI-UHFFFAOYSA-N	-1	3	333.352	1.666	20	5		EDBDHM
CCC1(O)CCC(Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000825176557	594142635	/nfs/dbraw/zinc/14/26/35/594142635.db2.gz	XRYLKFGGODOQLI-UHFFFAOYSA-N	-1	3	333.352	1.666	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NC[C@H](O)c1cccnc1	ZINC000823630119	594222993	/nfs/dbraw/zinc/22/29/93/594222993.db2.gz	SCNBKWTWBAGMPR-ZDUSSCGKSA-N	-1	3	327.304	1.315	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NC[C@H](O)c1cccnc1	ZINC000823630119	594222994	/nfs/dbraw/zinc/22/29/94/594222994.db2.gz	SCNBKWTWBAGMPR-ZDUSSCGKSA-N	-1	3	327.304	1.315	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCO[C@@H]([C@@H]3CCCO3)C2)c(-c2nnn[n-]2)c1	ZINC000823639952	594223832	/nfs/dbraw/zinc/22/38/32/594223832.db2.gz	NGOIIUXVWJYINR-UONOGXRCSA-N	-1	3	346.347	1.159	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCO[C@@H]([C@@H]3CCCO3)C2)c(-c2nn[n-]n2)c1	ZINC000823639952	594223833	/nfs/dbraw/zinc/22/38/33/594223833.db2.gz	NGOIIUXVWJYINR-UONOGXRCSA-N	-1	3	346.347	1.159	20	5		EDBDHM
C[C@@]1(C(=O)[O-])CCN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000828020827	594323810	/nfs/dbraw/zinc/32/38/10/594323810.db2.gz	XLBFDUQMSKQONP-XJKSGUPXSA-N	-1	3	333.344	1.497	20	5		EDBDHM
Cc1cc(-c2nnn[n-]2)ccc1COC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000826254079	594400518	/nfs/dbraw/zinc/40/05/18/594400518.db2.gz	STCIMQRMEUAXQM-UHFFFAOYSA-N	-1	3	342.315	1.779	20	5		EDBDHM
Cc1cc(-c2nn[n-]n2)ccc1COC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000826254079	594400519	/nfs/dbraw/zinc/40/05/19/594400519.db2.gz	STCIMQRMEUAXQM-UHFFFAOYSA-N	-1	3	342.315	1.779	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)OCc2ccc(F)cc2-c2nnn[n-]2)n1	ZINC000826363107	594445413	/nfs/dbraw/zinc/44/54/13/594445413.db2.gz	XOPNXNUNGWUEGD-UHFFFAOYSA-N	-1	3	347.266	1.005	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)OCc2ccc(F)cc2-c2nn[n-]n2)n1	ZINC000826363107	594445415	/nfs/dbraw/zinc/44/54/15/594445415.db2.gz	XOPNXNUNGWUEGD-UHFFFAOYSA-N	-1	3	347.266	1.005	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC[C@@H](C3CCOCC3)C2)c(-c2nnn[n-]2)c1	ZINC000826500789	594503398	/nfs/dbraw/zinc/50/33/98/594503398.db2.gz	MHZGJBZTFVNHEO-LLVKDONJSA-N	-1	3	345.363	1.423	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC[C@@H](C3CCOCC3)C2)c(-c2nn[n-]n2)c1	ZINC000826500789	594503400	/nfs/dbraw/zinc/50/34/00/594503400.db2.gz	MHZGJBZTFVNHEO-LLVKDONJSA-N	-1	3	345.363	1.423	20	5		EDBDHM
C[C@H]1CN(CCC(=O)[O-])CCN1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000833628293	594891386	/nfs/dbraw/zinc/89/13/86/594891386.db2.gz	FOKAHUCXYNULEB-WFASDCNBSA-N	-1	3	337.376	1.109	20	5		EDBDHM
C[C@H]1CN(CCC(=O)[O-])CCN1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000833628292	594891576	/nfs/dbraw/zinc/89/15/76/594891576.db2.gz	FOKAHUCXYNULEB-SWLSCSKDSA-N	-1	3	337.376	1.109	20	5		EDBDHM
C[C@@H]1CN(CCC(=O)[O-])CCN1CCOc1ccccc1[N+](=O)[O-]	ZINC000833629438	594891799	/nfs/dbraw/zinc/89/17/99/594891799.db2.gz	WLYJVIKSBAGKRK-CYBMUJFWSA-N	-1	3	337.376	1.454	20	5		EDBDHM
CCN(OC)C(=O)C[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000844069066	595265068	/nfs/dbraw/zinc/26/50/68/595265068.db2.gz	SQQPLXDDQWZKJR-UHFFFAOYSA-N	-1	3	331.275	1.213	20	5		EDBDHM
CN1CCC(ONC(=O)c2cc(Cl)cc([N+](=O)[O-])c2[O-])CC1	ZINC000846650511	595293379	/nfs/dbraw/zinc/29/33/79/595293379.db2.gz	AQYTTXCTSXYANG-UHFFFAOYSA-N	-1	3	329.740	1.709	20	5		EDBDHM
Cn1nncc1C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848591130	595411589	/nfs/dbraw/zinc/41/15/89/595411589.db2.gz	YXRUCWJPSUPHHT-UHFFFAOYSA-N	-1	3	327.247	1.011	20	5		EDBDHM
CCOc1nc2ccc(C(=O)OCc3cn(C)nc3[N+](=O)[O-])cc2[n-]1	ZINC000847785526	595483365	/nfs/dbraw/zinc/48/33/65/595483365.db2.gz	ALTRVNQAGBQXOK-UHFFFAOYSA-N	-1	3	345.315	1.960	20	5		EDBDHM
CCOc1nc2cc(C(=O)OCc3cn(C)nc3[N+](=O)[O-])ccc2[n-]1	ZINC000847785526	595483367	/nfs/dbraw/zinc/48/33/67/595483367.db2.gz	ALTRVNQAGBQXOK-UHFFFAOYSA-N	-1	3	345.315	1.960	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(OC)OC	ZINC000849406521	595521526	/nfs/dbraw/zinc/52/15/26/595521526.db2.gz	KXJSRYMWVGIVKR-JTQLQIEISA-N	-1	3	348.377	1.279	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]Cc2cn3ccccc3n2)cs1	ZINC000119350335	596522624	/nfs/dbraw/zinc/52/26/24/596522624.db2.gz	DLUAEUJPJXWVRP-UHFFFAOYSA-N	-1	3	338.370	1.783	20	5		EDBDHM
COCC1CC([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000867841699	596581308	/nfs/dbraw/zinc/58/13/08/596581308.db2.gz	MOCUGRWNUHWFKE-UHFFFAOYSA-N	-1	3	334.781	1.952	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)N1CCC[C@H](C)C1	ZINC000078234518	138256610	/nfs/dbraw/zinc/25/66/10/138256610.db2.gz	PVLDIGOCVBGVJR-JTQLQIEISA-N	-1	3	329.378	1.992	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H]1c2ccccc2C[C@@H]1O	ZINC000097271785	138296829	/nfs/dbraw/zinc/29/68/29/138296829.db2.gz	OADASWXOICLAMV-ZFWWWQNUSA-N	-1	3	334.353	1.531	20	5		EDBDHM
NC(=O)[C@H]([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000130001736	138339582	/nfs/dbraw/zinc/33/95/82/138339582.db2.gz	JLTYLCAERGDWHW-CQSZACIVSA-N	-1	3	349.368	1.241	20	5		EDBDHM
Cc1cc(C(=O)N2CCOc3cc(O)ccc3C2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000367355870	291717982	/nfs/dbraw/zinc/71/79/82/291717982.db2.gz	HLKHEFQFVAKVHQ-UHFFFAOYSA-N	-1	3	345.311	1.744	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2C[C@@H](C)O[C@@H]2C)c([N+](=O)[O-])c1	ZINC000416613048	251082872	/nfs/dbraw/zinc/08/28/72/251082872.db2.gz	ZQIXGFLEJONNIO-MXWKQRLJSA-N	-1	3	344.389	1.695	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000416633163	251091857	/nfs/dbraw/zinc/09/18/57/251091857.db2.gz	GQFWXKPGZSKMRA-VXGBXAGGSA-N	-1	3	328.390	1.733	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]Cc1nc(CC2CC2)no1	ZINC000417271417	251151580	/nfs/dbraw/zinc/15/15/80/251151580.db2.gz	QLNJRHWTHBWMOS-UHFFFAOYSA-N	-1	3	338.345	1.409	20	5		EDBDHM
C[C@@H]1C[C@@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCO1	ZINC000271297717	140272963	/nfs/dbraw/zinc/27/29/63/140272963.db2.gz	VEINAGHDXOHGFU-ZJUUUORDSA-N	-1	3	332.353	1.827	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@]2(C)CCCO2)c([N+](=O)[O-])c1	ZINC000331354700	141010902	/nfs/dbraw/zinc/01/09/02/141010902.db2.gz	ZYEBPTZCMDHNHH-CYBMUJFWSA-N	-1	3	330.362	1.451	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@H]2CCC[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000344949822	143029973	/nfs/dbraw/zinc/02/99/73/143029973.db2.gz	AIZDZXKMFOUQGC-QWHCGFSZSA-N	-1	3	342.417	1.980	20	5		EDBDHM
Cc1ncc(CNC(=O)CN(C)c2ccccc2[N+](=O)[O-])c(=O)[n-]1	ZINC000345109205	143051588	/nfs/dbraw/zinc/05/15/88/143051588.db2.gz	YZKPQQYDGZMGGY-UHFFFAOYSA-N	-1	3	331.332	1.151	20	5		EDBDHM
O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCc2c(=O)[n-]cnc2C1	ZINC000345206295	143064463	/nfs/dbraw/zinc/06/44/63/143064463.db2.gz	VIYUXJVHCHNROQ-UHFFFAOYSA-N	-1	3	339.311	1.770	20	5		EDBDHM
COC(=O)c1cc([N-]C(=O)c2cc(C(N)=O)cs2)cc([N+](=O)[O-])c1	ZINC000346230707	143181415	/nfs/dbraw/zinc/18/14/15/143181415.db2.gz	BLNVYCXBWSLQES-UHFFFAOYSA-N	-1	3	349.324	1.794	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H](C2CC2)C(C)(C)CO)c([N+](=O)[O-])c1	ZINC000352574196	149070411	/nfs/dbraw/zinc/07/04/11/149070411.db2.gz	DGRRRIZEDFFAHT-AWEZNQCLSA-N	-1	3	342.417	1.979	20	5		EDBDHM
COc1nnc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)[n-]1	ZINC000352643002	149099382	/nfs/dbraw/zinc/09/93/82/149099382.db2.gz	HJHHVKLTVOJISR-UHFFFAOYSA-N	-1	3	343.303	1.374	20	5		EDBDHM
COc1nc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)n[n-]1	ZINC000352643002	149099385	/nfs/dbraw/zinc/09/93/85/149099385.db2.gz	HJHHVKLTVOJISR-UHFFFAOYSA-N	-1	3	343.303	1.374	20	5		EDBDHM
COc1n[n-]c(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)n1	ZINC000352643002	149099386	/nfs/dbraw/zinc/09/93/86/149099386.db2.gz	HJHHVKLTVOJISR-UHFFFAOYSA-N	-1	3	343.303	1.374	20	5		EDBDHM
CCn1ncnc1C[N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1C	ZINC000360369176	152009194	/nfs/dbraw/zinc/00/91/94/152009194.db2.gz	JSOMQVCVMCYICB-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
COCCOC[C@H](C)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000360566677	152099831	/nfs/dbraw/zinc/09/98/31/152099831.db2.gz	AKZBJWRXPBFROA-NSHDSACASA-N	-1	3	332.378	1.233	20	5		EDBDHM
CC(C)(O)CN1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])CC1	ZINC000364590530	153279546	/nfs/dbraw/zinc/27/95/46/153279546.db2.gz	IAOJVSHINKRXNF-UHFFFAOYSA-N	-1	3	337.376	1.219	20	5		EDBDHM
CCCN1CCCN(C(=O)c2cc(C)[n-]c(=O)c2[N+](=O)[O-])CC1=O	ZINC000367387896	154099326	/nfs/dbraw/zinc/09/93/26/154099326.db2.gz	JZJOTZNVBKCSLS-UHFFFAOYSA-N	-1	3	336.348	1.088	20	5		EDBDHM
Cc1nc(C)c(CC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)c(=O)[n-]1	ZINC000119409743	287352019	/nfs/dbraw/zinc/35/20/19/287352019.db2.gz	DCYWAOAYAVORHR-UHFFFAOYSA-N	-1	3	342.355	1.422	20	5		EDBDHM
CS[C@H]1CN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)C[C@H]1N(C)C	ZINC000273305678	268020354	/nfs/dbraw/zinc/02/03/54/268020354.db2.gz	GLXDVFBCLDIGTR-YPMHNXCESA-N	-1	3	325.390	1.418	20	5		EDBDHM
CCCCCS(=O)(=O)[N-][C@@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000273590134	268060615	/nfs/dbraw/zinc/06/06/15/268060615.db2.gz	ISPKBWWGUIMTCX-UONOGXRCSA-N	-1	3	346.405	1.099	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CCCSC)cc1[N+](=O)[O-]	ZINC000275027240	268267414	/nfs/dbraw/zinc/26/74/14/268267414.db2.gz	BPWMXPIBCLNEFX-UHFFFAOYSA-N	-1	3	338.382	1.774	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-]	ZINC000275039984	268270138	/nfs/dbraw/zinc/27/01/38/268270138.db2.gz	FHOJHHGNSAAUJV-PWSUYJOCSA-N	-1	3	348.352	1.324	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CCC[C@H]1CCO	ZINC000275154968	273103939	/nfs/dbraw/zinc/10/39/39/273103939.db2.gz	HLIQFNNRBWYEPY-JQWIXIFHSA-N	-1	3	344.389	1.433	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@H]1CCCCN1C1CC1	ZINC000277430096	273196286	/nfs/dbraw/zinc/19/62/86/273196286.db2.gz	BZPAHCHSKCAMNL-CYBMUJFWSA-N	-1	3	339.417	1.890	20	5		EDBDHM
C[S@@](=O)C1(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCC1	ZINC000280749741	273393732	/nfs/dbraw/zinc/39/37/32/273393732.db2.gz	MFRMLFJXALGVGQ-HXUWFJFHSA-N	-1	3	332.403	1.174	20	5		EDBDHM
O=C1CC[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C2(CCC2)N1	ZINC000283285815	273818506	/nfs/dbraw/zinc/81/85/06/273818506.db2.gz	USBQPTUNLQWQGR-GFCCVEGCSA-N	-1	3	339.373	1.074	20	5		EDBDHM
Cc1cc(C(=O)N[C@@H]2COc3ccccc3[C@@H]2O)c([N+](=O)[O-])c(=O)[n-]1	ZINC000366521773	280356250	/nfs/dbraw/zinc/35/62/50/280356250.db2.gz	PUQCEAVNONCYKS-RISCZKNCSA-N	-1	3	345.311	1.228	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCN1CCCCC1	ZINC000046034743	281261928	/nfs/dbraw/zinc/26/19/28/281261928.db2.gz	GFBAARKXKWVPFD-UHFFFAOYSA-N	-1	3	327.406	1.667	20	5		EDBDHM
O=[N+]([O-])c1cccc(S(=O)(=O)[N-]CC[C@H](O)C(F)(F)F)c1	ZINC000350005180	303812543	/nfs/dbraw/zinc/81/25/43/303812543.db2.gz	DWTPHADUNCSWMM-VIFPVBQESA-N	-1	3	328.268	1.186	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F	ZINC000544562816	306076605	/nfs/dbraw/zinc/07/66/05/306076605.db2.gz	OCUCQBLLKFORGA-PRHODGIISA-N	-1	3	336.323	1.466	20	5		EDBDHM
CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1c(C)[n-][nH]c1=O	ZINC000547322004	306098968	/nfs/dbraw/zinc/09/89/68/306098968.db2.gz	HLINSSUHMNKZDP-HIFRSBDPSA-N	-1	3	346.387	1.792	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]CCn1ccnc1	ZINC000029938569	441478944	/nfs/dbraw/zinc/47/89/44/441478944.db2.gz	GCFJNNVEKFOQJP-UHFFFAOYSA-N	-1	3	330.753	1.423	20	5		EDBDHM
CC(C)(C)OC(=O)CCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000033881663	441598587	/nfs/dbraw/zinc/59/85/87/441598587.db2.gz	RWWBFZBNKAAWKO-UHFFFAOYSA-N	-1	3	344.389	1.995	20	5		EDBDHM
C[C@H](Cn1cccn1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000055220491	441631330	/nfs/dbraw/zinc/63/13/30/441631330.db2.gz	RPTCRWJRNKBIPZ-SECBINFHSA-N	-1	3	328.325	1.297	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)N(C)C	ZINC000056060004	441684833	/nfs/dbraw/zinc/68/48/33/441684833.db2.gz	YCZLFQUIFDWIRR-SSDOTTSWSA-N	-1	3	335.769	1.003	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1csc(C)n1	ZINC000042114432	441707067	/nfs/dbraw/zinc/70/70/67/441707067.db2.gz	DFUSLPQXKPYEAI-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CC[C@@H](CO)CC2)c([N+](=O)[O-])c1	ZINC000119459991	441936772	/nfs/dbraw/zinc/93/67/72/441936772.db2.gz	OGCGIHVYBSVHEB-HAQNSBGRSA-N	-1	3	328.390	1.733	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2C[C@H](C)N(C3CC3)C2)cc1[N+](=O)[O-]	ZINC000125322610	442010406	/nfs/dbraw/zinc/01/04/06/442010406.db2.gz	JQVTYURFNKNIJP-WPRPVWTQSA-N	-1	3	345.446	1.868	20	5		EDBDHM
O=C(CC[C@H]1NC(=O)[N-]C1=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000269177090	443223801	/nfs/dbraw/zinc/22/38/01/443223801.db2.gz	IWDUNAVKDYXHRG-CYBMUJFWSA-N	-1	3	346.343	1.074	20	5		EDBDHM
COCCCN1CCC(NC(=O)c2cc([O-])cc([N+](=O)[O-])c2)CC1	ZINC000269269696	443259412	/nfs/dbraw/zinc/25/94/12/443259412.db2.gz	FPKNBOBDTPSSSN-UHFFFAOYSA-N	-1	3	337.376	1.531	20	5		EDBDHM
C[C@@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br	ZINC000269488759	443323066	/nfs/dbraw/zinc/32/30/66/443323066.db2.gz	NOKGMKXJVAIQCO-LURJTMIESA-N	-1	3	339.167	1.016	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])CCC1	ZINC000269495200	443326079	/nfs/dbraw/zinc/32/60/79/443326079.db2.gz	OUUGWVMJVIWWKN-UHFFFAOYSA-N	-1	3	328.346	1.277	20	5		EDBDHM
CCOC(=O)c1csc([N-]C(=O)c2n[nH]c(CC)c2[N+](=O)[O-])n1	ZINC000278621453	443381026	/nfs/dbraw/zinc/38/10/26/443381026.db2.gz	OXTQYKMASWHBHT-UHFFFAOYSA-N	-1	3	339.333	1.766	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H](C)C[C@H](C)O	ZINC000269781361	443438221	/nfs/dbraw/zinc/43/82/21/443438221.db2.gz	OVCGMDMMRFXLEX-UWVGGRQHSA-N	-1	3	332.378	1.289	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H](C)C[C@@H](C)O	ZINC000269781359	443438498	/nfs/dbraw/zinc/43/84/98/443438498.db2.gz	OVCGMDMMRFXLEX-NXEZZACHSA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](O)C(F)(F)F)c1C	ZINC000269685026	443395428	/nfs/dbraw/zinc/39/54/28/443395428.db2.gz	HDAFMBDFFODMHM-VIFPVBQESA-N	-1	3	342.295	1.413	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@]2(O)CCO[C@@H]2C)c1[N+](=O)[O-]	ZINC000278859786	443464982	/nfs/dbraw/zinc/46/49/82/443464982.db2.gz	XMKFDDPYTQNGMG-RISCZKNCSA-N	-1	3	344.389	1.030	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](C)CO[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000441530622	320098039	/nfs/dbraw/zinc/09/80/39/320098039.db2.gz	BANXMJNOXSOHCR-VXGBXAGGSA-N	-1	3	344.389	1.376	20	5		EDBDHM
COC(=O)[C@@H](CC(C)C)[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000443718219	320110458	/nfs/dbraw/zinc/11/04/58/320110458.db2.gz	OISHRTOULBQJON-CYBMUJFWSA-N	-1	3	344.389	1.602	20	5		EDBDHM
C[C@]1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)NC(=O)[N-]C1=O	ZINC000518248426	320455285	/nfs/dbraw/zinc/45/52/85/320455285.db2.gz	QKABTHNJVVJYHN-OAHLLOKOSA-N	-1	3	344.283	1.495	20	5		EDBDHM
CCCN(C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(C)C	ZINC000518396921	320456767	/nfs/dbraw/zinc/45/67/67/320456767.db2.gz	JQLFUHIZTRWYCI-UHFFFAOYSA-N	-1	3	343.405	1.520	20	5		EDBDHM
CN1CCN(CCNC(=O)c2cc([N+](=O)[O-])ccc2[O-])CC1(C)C	ZINC000281672050	443974839	/nfs/dbraw/zinc/97/48/39/443974839.db2.gz	DKSAKMGAFHDWPZ-UHFFFAOYSA-N	-1	3	336.392	1.056	20	5		EDBDHM
O=C(Cc1cncc([O-])c1)N1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000561066092	321032404	/nfs/dbraw/zinc/03/24/04/321032404.db2.gz	NLTKQWFQFOJYEI-UHFFFAOYSA-N	-1	3	342.355	1.587	20	5		EDBDHM
COc1cc(C(=O)N(CCN(C)C)CC(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000564968867	321161229	/nfs/dbraw/zinc/16/12/29/321161229.db2.gz	JQMPLPWYPUBGFO-UHFFFAOYSA-N	-1	3	339.348	1.000	20	5		EDBDHM
O=C([O-])[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)C[C@H]1c1ccccc1	ZINC000565595345	321192251	/nfs/dbraw/zinc/19/22/51/321192251.db2.gz	CCKPKEOBYNHZCS-LSDHHAIUSA-N	-1	3	330.344	1.592	20	5		EDBDHM
CN1CCN(CCNc2ncc(C(=O)[O-])cc2[N+](=O)[O-])CC1(C)C	ZINC000567978588	321270507	/nfs/dbraw/zinc/27/05/07/321270507.db2.gz	LGQXPDINOOTTQB-UHFFFAOYSA-N	-1	3	337.380	1.126	20	5		EDBDHM
Cc1nnc([C@@H](C)[N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)o1	ZINC000572454453	321429829	/nfs/dbraw/zinc/42/98/29/321429829.db2.gz	QEEIJQAEOQXWHA-MRVPVSSYSA-N	-1	3	326.334	1.467	20	5		EDBDHM
Cc1nnc([C@H](C)[N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)o1	ZINC000572454454	321429860	/nfs/dbraw/zinc/42/98/60/321429860.db2.gz	QEEIJQAEOQXWHA-QMMMGPOBSA-N	-1	3	326.334	1.467	20	5		EDBDHM
O=C([N-]C[C@@H]1CCCN(CCn2cc([N+](=O)[O-])cn2)C1)C(F)(F)F	ZINC000289553615	444170033	/nfs/dbraw/zinc/17/00/33/444170033.db2.gz	UONHKHRXVYAROR-JTQLQIEISA-N	-1	3	349.313	1.182	20	5		EDBDHM
O=[N+]([O-])c1ccc2[nH]cc(CC[N-]S(=O)(=O)c3ccccn3)c2c1	ZINC000574839491	321504307	/nfs/dbraw/zinc/50/43/07/321504307.db2.gz	KNTYVUVCBUELSC-UHFFFAOYSA-N	-1	3	346.368	1.992	20	5		EDBDHM
CCc1nnc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)s1	ZINC000289615667	444181422	/nfs/dbraw/zinc/18/14/22/444181422.db2.gz	SLCJCDGEBUQELD-UHFFFAOYSA-N	-1	3	342.402	1.796	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CCC[C@]1(C)CO	ZINC000331164958	444426356	/nfs/dbraw/zinc/42/63/56/444426356.db2.gz	HLDLQPKDJSVRNB-UONOGXRCSA-N	-1	3	344.389	1.433	20	5		EDBDHM
O=[N+]([O-])c1cccc(F)c1[N-]c1ccn(CCN2CCOCC2)n1	ZINC000342216136	444569986	/nfs/dbraw/zinc/56/99/86/444569986.db2.gz	BUAWWJHACMXIIX-UHFFFAOYSA-N	-1	3	335.339	2.006	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)c2ccon2)c([N+](=O)[O-])c1	ZINC000342365309	444657408	/nfs/dbraw/zinc/65/74/08/444657408.db2.gz	VHIMFXKFHAHOJH-MRVPVSSYSA-N	-1	3	327.318	1.631	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@]1(C)CCO[C@@H]1C	ZINC000343994839	444716374	/nfs/dbraw/zinc/71/63/74/444716374.db2.gz	WOLGBIMCPUJPRX-RNCFNFMXSA-N	-1	3	330.362	1.449	20	5		EDBDHM
CNC(=O)[C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000342574290	444750524	/nfs/dbraw/zinc/75/05/24/444750524.db2.gz	URUSGNMUDFDWJO-RKDXNWHRSA-N	-1	3	347.418	1.158	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)C[C@H]1CCCO1	ZINC000338726444	444822554	/nfs/dbraw/zinc/82/25/54/444822554.db2.gz	OELZABKPGYSRSO-ZYHUDNBSSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CCN3CCCC[C@H]23)cc1[N+](=O)[O-]	ZINC000343528590	445239006	/nfs/dbraw/zinc/23/90/06/445239006.db2.gz	ALUGBYLIMDEBFQ-WDEREUQCSA-N	-1	3	345.446	1.870	20	5		EDBDHM
COc1n[n-]c(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])n1	ZINC000352647859	445544839	/nfs/dbraw/zinc/54/48/39/445544839.db2.gz	ZSIWSFDBILBNCK-UHFFFAOYSA-N	-1	3	342.109	1.736	20	5		EDBDHM
COc1nc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])n[n-]1	ZINC000352647859	445544841	/nfs/dbraw/zinc/54/48/41/445544841.db2.gz	ZSIWSFDBILBNCK-UHFFFAOYSA-N	-1	3	342.109	1.736	20	5		EDBDHM
Cc1ccc(-c2[nH]nc([N-]C(=O)c3nn(C)cc3[N+](=O)[O-])c2C)o1	ZINC000357940544	445595155	/nfs/dbraw/zinc/59/51/55/445595155.db2.gz	IFGWNJXAAZUAPA-UHFFFAOYSA-N	-1	3	330.304	2.181	20	5		EDBDHM
CO[C@]1(C[N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])CCOC1	ZINC000359244046	446077982	/nfs/dbraw/zinc/07/79/82/446077982.db2.gz	YYXCVRGOQFTGTN-AWEZNQCLSA-N	-1	3	344.389	1.295	20	5		EDBDHM
Cc1cncn1C1CCN(C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)CC1	ZINC000366398117	446192767	/nfs/dbraw/zinc/19/27/67/446192767.db2.gz	HMHCBLQALPSNPG-UHFFFAOYSA-N	-1	3	331.332	1.678	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H](CO)c1ccsc1	ZINC000351577904	446174443	/nfs/dbraw/zinc/17/44/43/446174443.db2.gz	VYIKTSLURZHWCF-JTQLQIEISA-N	-1	3	328.371	1.668	20	5		EDBDHM
Cc1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc1-n1cnnn1	ZINC000370430506	446275383	/nfs/dbraw/zinc/27/53/83/446275383.db2.gz	LUDOCTPXTPFBEF-UHFFFAOYSA-N	-1	3	341.287	1.232	20	5		EDBDHM
Cc1cc(C(=O)N2CCC(c3cc[nH]n3)CC2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375085867	446570169	/nfs/dbraw/zinc/57/01/69/446570169.db2.gz	WEVROJYPYXYCIX-UHFFFAOYSA-N	-1	3	331.332	1.747	20	5		EDBDHM
COc1ccc(NC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)c([O-])c1	ZINC000442699887	446937348	/nfs/dbraw/zinc/93/73/48/446937348.db2.gz	NEQCSOVIQGSERY-UHFFFAOYSA-N	-1	3	345.311	1.678	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2[C@H]3COC[C@H]32)c(Cl)c1	ZINC000375664062	446959667	/nfs/dbraw/zinc/95/96/67/446959667.db2.gz	MFXFMSVSKROLFX-OWUUHHOZSA-N	-1	3	332.765	1.419	20	5		EDBDHM
O=C(Nc1ccc(OC2COC2)cc1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000444846209	447143154	/nfs/dbraw/zinc/14/31/54/447143154.db2.gz	HGUCHVKGYRWVHA-UHFFFAOYSA-N	-1	3	331.284	1.725	20	5		EDBDHM
COC(=O)[C@](C)([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C1CC1	ZINC000522971952	447866766	/nfs/dbraw/zinc/86/67/66/447866766.db2.gz	IQKDKAHDBJXJNH-CQSZACIVSA-N	-1	3	342.373	1.523	20	5		EDBDHM
CCOC(=O)c1[n-]c(C)nc1NC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000525350333	447995997	/nfs/dbraw/zinc/99/59/97/447995997.db2.gz	NCRQBUVSQZQCCS-UHFFFAOYSA-N	-1	3	336.308	1.028	20	5		EDBDHM
CCOC(=O)c1nc(C)[n-]c1NC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000525350333	447996001	/nfs/dbraw/zinc/99/60/01/447996001.db2.gz	NCRQBUVSQZQCCS-UHFFFAOYSA-N	-1	3	336.308	1.028	20	5		EDBDHM
CCOC(=O)c1[n-]c(C)nc1NC(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000525643376	448006442	/nfs/dbraw/zinc/00/64/42/448006442.db2.gz	SSQQEQPGNSDONS-UHFFFAOYSA-N	-1	3	333.304	1.759	20	5		EDBDHM
CCOC(=O)c1nc(C)[n-]c1NC(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000525643376	448006446	/nfs/dbraw/zinc/00/64/46/448006446.db2.gz	SSQQEQPGNSDONS-UHFFFAOYSA-N	-1	3	333.304	1.759	20	5		EDBDHM
O=C(c1csc(=O)[n-]1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000527156303	448172156	/nfs/dbraw/zinc/17/21/56/448172156.db2.gz	HRUBUIFAIPPLHQ-UHFFFAOYSA-N	-1	3	335.345	1.114	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc(=O)[n-]c(C2CC2)n1	ZINC000577122127	448215430	/nfs/dbraw/zinc/21/54/30/448215430.db2.gz	NGTXXZBVWNABHJ-UHFFFAOYSA-N	-1	3	344.327	1.906	20	5		EDBDHM
CCOC(=O)c1nc(C)[n-]c1NC(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000515029553	448243352	/nfs/dbraw/zinc/24/33/52/448243352.db2.gz	GUYDMPFNSFPOJQ-UHFFFAOYSA-N	-1	3	336.308	1.272	20	5		EDBDHM
CCOC(=O)c1[n-]c(C)nc1NC(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000515029553	448243358	/nfs/dbraw/zinc/24/33/58/448243358.db2.gz	GUYDMPFNSFPOJQ-UHFFFAOYSA-N	-1	3	336.308	1.272	20	5		EDBDHM
CNc1ccc(C(=O)Nc2cc(-c3nccn3C)[n-]n2)cc1[N+](=O)[O-]	ZINC000533261687	448380284	/nfs/dbraw/zinc/38/02/84/448380284.db2.gz	GMJBRDFFJWKHHD-UHFFFAOYSA-N	-1	3	341.331	2.012	20	5		EDBDHM
CNc1ccc(C(=O)Nc2cc(-c3nccn3C)n[n-]2)cc1[N+](=O)[O-]	ZINC000533261687	448380289	/nfs/dbraw/zinc/38/02/89/448380289.db2.gz	GMJBRDFFJWKHHD-UHFFFAOYSA-N	-1	3	341.331	2.012	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1CCS[C@@H]1C	ZINC000592117593	448694684	/nfs/dbraw/zinc/69/46/84/448694684.db2.gz	ZBPQITRKTWEAPY-BDAKNGLRSA-N	-1	3	332.403	1.776	20	5		EDBDHM
O=C(NCCCc1cc(=O)[nH][n-]1)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000588875881	448943994	/nfs/dbraw/zinc/94/39/94/448943994.db2.gz	KPQSFKSXMMDHIL-UHFFFAOYSA-N	-1	3	329.316	1.462	20	5		EDBDHM
CN1CCC[C@H](N2CCN(c3cc(C(=O)[O-])ccc3[N+](=O)[O-])CC2)C1	ZINC000592975216	449091457	/nfs/dbraw/zinc/09/14/57/449091457.db2.gz	QWDQSXQUPNJPMH-AWEZNQCLSA-N	-1	3	348.403	1.509	20	5		EDBDHM
CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000590398950	449146846	/nfs/dbraw/zinc/14/68/46/449146846.db2.gz	AXQGFDWOLLKIKD-GXTWGEPZSA-N	-1	3	335.360	1.236	20	5		EDBDHM
CC1(C)[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)[C@H]2CCCO[C@H]21	ZINC000593552556	449342952	/nfs/dbraw/zinc/34/29/52/449342952.db2.gz	LYPJSLYYOIIPGY-RAIGVLPGSA-N	-1	3	341.389	1.472	20	5		EDBDHM
CC(C)C[C@@H](CCO)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593558897	449349252	/nfs/dbraw/zinc/34/92/52/449349252.db2.gz	UEQGOIXFMIEVQO-LLVKDONJSA-N	-1	3	331.394	1.313	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCCOC2CCCC2)nc1	ZINC000593539614	449333438	/nfs/dbraw/zinc/33/34/38/449333438.db2.gz	YLWZFJQYMVFCCI-UHFFFAOYSA-N	-1	3	329.378	1.617	20	5		EDBDHM
Cn1[n-]c([C@H]2CCCN2c2nc3cc([N+](=O)[O-])ccc3[nH]2)nc1=N	ZINC000596252018	449439961	/nfs/dbraw/zinc/43/99/61/449439961.db2.gz	DAEAFKATIILCFQ-LLVKDONJSA-N	-1	3	328.336	1.354	20	5		EDBDHM
O=C(c1cc(F)c[n-]c1=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000598686045	449543644	/nfs/dbraw/zinc/54/36/44/449543644.db2.gz	HKQZWOJWWXSMBD-JTQLQIEISA-N	-1	3	347.306	1.556	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCCN3CCCC[C@H]23)nc1	ZINC000594484591	449548675	/nfs/dbraw/zinc/54/86/75/449548675.db2.gz	VHYLLRPHRPWSNT-QWHCGFSZSA-N	-1	3	340.405	1.285	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCCN3CCCC[C@@H]23)s1	ZINC000594485122	449549365	/nfs/dbraw/zinc/54/93/65/449549365.db2.gz	WTWRJSZAEKIUCX-QWRGUYRKSA-N	-1	3	345.446	1.952	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2CCC3(CCCC3)O2)nc1	ZINC000594486987	449551684	/nfs/dbraw/zinc/55/16/84/449551684.db2.gz	GPVQYXQJZNRBMV-GFCCVEGCSA-N	-1	3	341.389	1.760	20	5		EDBDHM
Cc1ccnc([C@@H](C)[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])n1	ZINC000598735328	449569799	/nfs/dbraw/zinc/56/97/99/449569799.db2.gz	NXNBCSFQHVGEPO-LLVKDONJSA-N	-1	3	336.373	1.874	20	5		EDBDHM
CC1CCN(CCC[N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])CC1	ZINC000594746229	449663343	/nfs/dbraw/zinc/66/33/43/449663343.db2.gz	MTNWJJDDDZDQOE-UHFFFAOYSA-N	-1	3	342.421	1.390	20	5		EDBDHM
O=[N+]([O-])c1cccnc1S(=O)(=O)[N-]C1CCN(CC2CC2)CC1	ZINC000594755950	449670626	/nfs/dbraw/zinc/67/06/26/449670626.db2.gz	QZQJOSCETKCRBB-UHFFFAOYSA-N	-1	3	340.405	1.143	20	5		EDBDHM
CCC(CC)[C@@H](C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])N(C)C	ZINC000594770532	449683606	/nfs/dbraw/zinc/68/36/06/449683606.db2.gz	JTPAVOGMPJNQFM-CYBMUJFWSA-N	-1	3	344.437	1.635	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-][C@@H](CO)CCF	ZINC000594795744	449706867	/nfs/dbraw/zinc/70/68/67/449706867.db2.gz	PUOSVXJUCFVKFN-SECBINFHSA-N	-1	3	343.336	1.142	20	5		EDBDHM
Cc1nc(C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])cs1	ZINC000612669434	449824332	/nfs/dbraw/zinc/82/43/32/449824332.db2.gz	FSKUGRRPGKQRRO-UHFFFAOYSA-N	-1	3	327.387	1.979	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CCN(C3CC3)C2)c([N+](=O)[O-])s1	ZINC000601318715	449827452	/nfs/dbraw/zinc/82/74/52/449827452.db2.gz	QDDCVUJBZUXWOK-VIFPVBQESA-N	-1	3	331.419	1.480	20	5		EDBDHM
Cc1nc(C)c(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)o1	ZINC000599316398	449886946	/nfs/dbraw/zinc/88/69/46/449886946.db2.gz	GUGUWENGQCUJDT-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
Cc1cccc2c1C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)CO2	ZINC000599374632	449928555	/nfs/dbraw/zinc/92/85/55/449928555.db2.gz	JROYEXPOEXSIAV-LLVKDONJSA-N	-1	3	349.368	1.580	20	5		EDBDHM
CCn1nncc1C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000599360881	449918737	/nfs/dbraw/zinc/91/87/37/449918737.db2.gz	XJLWOPQDLZJMHU-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C2(CN(C)C)CCC2)c(F)cc1[N+](=O)[O-]	ZINC000601409035	449924785	/nfs/dbraw/zinc/92/47/85/449924785.db2.gz	HSKBOSZGVJQAIZ-UHFFFAOYSA-N	-1	3	345.396	1.805	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1[C@H](C)O[C@H](C)[C@H]1C	ZINC000599459993	449993755	/nfs/dbraw/zinc/99/37/55/449993755.db2.gz	PDFACLCMONMMSM-RBQUTUCGSA-N	-1	3	344.389	1.694	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CO[C@@H](C3CC3)C2)c(F)c1	ZINC000599483788	450012932	/nfs/dbraw/zinc/01/29/32/450012932.db2.gz	WHZJIJAIHUDUDU-BXKDBHETSA-N	-1	3	330.337	1.580	20	5		EDBDHM
CCCCS(=O)(=O)[N-][C@@](C)(C(=O)OC)c1cccc([N+](=O)[O-])c1	ZINC000599487511	450015595	/nfs/dbraw/zinc/01/55/95/450015595.db2.gz	RUWQHSFBFKHDRH-CQSZACIVSA-N	-1	3	344.389	1.703	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](C)c1nccn1C	ZINC000595384265	450099875	/nfs/dbraw/zinc/09/98/75/450099875.db2.gz	VIMLYABGGMMZKD-SECBINFHSA-N	-1	3	340.361	1.376	20	5		EDBDHM
O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(Br)cc1[O-]	ZINC000603626493	450336739	/nfs/dbraw/zinc/33/67/39/450336739.db2.gz	HJLBVLNNSKPMCD-UHFFFAOYSA-N	-1	3	341.121	1.898	20	5		EDBDHM
Cc1ccc([O-])c(C(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c1	ZINC000603572435	450325868	/nfs/dbraw/zinc/32/58/68/450325868.db2.gz	PKSSMLBDILJFQX-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1nccs1	ZINC000619476955	450484800	/nfs/dbraw/zinc/48/48/00/450484800.db2.gz	IDVVHYWPHCMJDS-UHFFFAOYSA-N	-1	3	329.359	1.538	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](C)c1nc(C)no1	ZINC000619480581	450485814	/nfs/dbraw/zinc/48/58/14/450485814.db2.gz	AKUJPDODYFOKOU-ZETCQYMHSA-N	-1	3	342.333	1.334	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]C1(C)CCOCC1	ZINC000619493240	450490236	/nfs/dbraw/zinc/49/02/36/450490236.db2.gz	PNWUJYKTLONETJ-UHFFFAOYSA-N	-1	3	330.362	1.451	20	5		EDBDHM
Cc1[nH]nc(C(=O)[N-]c2ccc(-c3nc[nH]n3)cc2F)c1[N+](=O)[O-]	ZINC000619573906	450508716	/nfs/dbraw/zinc/50/87/16/450508716.db2.gz	ANCUQUOZAMCEMV-UHFFFAOYSA-N	-1	3	331.267	1.803	20	5		EDBDHM
CC1(C)[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@@H]2CCO[C@@H]21	ZINC000153379503	527874616	/nfs/dbraw/zinc/87/46/16/527874616.db2.gz	LSACVFNFIKQYOF-BIMULSAOSA-N	-1	3	326.374	1.687	20	5		EDBDHM
CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2cnc(C)[n-]c2=O)c1	ZINC000338540495	535428735	/nfs/dbraw/zinc/42/87/35/535428735.db2.gz	NNGFZQYATBQSNA-UHFFFAOYSA-N	-1	3	332.316	1.728	20	5		EDBDHM
CN(C(=O)CN1C[C@@H]2CCC[C@@]2(C(=O)[O-])C1)c1ccc([N+](=O)[O-])cc1	ZINC000262249477	535992163	/nfs/dbraw/zinc/99/21/63/535992163.db2.gz	ZECGJWUKBXGPIJ-YVEFUNNKSA-N	-1	3	347.371	1.744	20	5		EDBDHM
CC(C)(C)[S@](=O)CCNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000735644088	578907593	/nfs/dbraw/zinc/90/75/93/578907593.db2.gz	UHTOEFSVAFTGTG-HSZRJFAPSA-N	-1	3	338.393	1.734	20	5		EDBDHM
CC(C)(C)[S@](=O)CCNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000735644088	578907595	/nfs/dbraw/zinc/90/75/95/578907595.db2.gz	UHTOEFSVAFTGTG-HSZRJFAPSA-N	-1	3	338.393	1.734	20	5		EDBDHM
CC(C)CC[C@](C)(O)CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000735796729	578924020	/nfs/dbraw/zinc/92/40/20/578924020.db2.gz	HGYWUONNVUIOPI-AWEZNQCLSA-N	-1	3	335.368	1.769	20	5		EDBDHM
CC(C)CC[C@](C)(O)CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000735796729	578924021	/nfs/dbraw/zinc/92/40/21/578924021.db2.gz	HGYWUONNVUIOPI-AWEZNQCLSA-N	-1	3	335.368	1.769	20	5		EDBDHM
CN(C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)[C@@H]1CCN(C2CC2)C1	ZINC000737332749	579073882	/nfs/dbraw/zinc/07/38/82/579073882.db2.gz	BHNWCMKZXCHMOW-CYBMUJFWSA-N	-1	3	333.344	1.602	20	5		EDBDHM
CN(C)C[C@@H]1CCCCN1C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000737361329	579078695	/nfs/dbraw/zinc/07/86/95/579078695.db2.gz	SBJHBKATTHRMJW-ZDUSSCGKSA-N	-1	3	335.360	1.849	20	5		EDBDHM
O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc(F)c(-c2nnn[n-]2)c1	ZINC000737861195	579135138	/nfs/dbraw/zinc/13/51/38/579135138.db2.gz	CXPBXZBOVZUOHU-UHFFFAOYSA-N	-1	3	346.282	1.139	20	5		EDBDHM
O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc(F)c(-c2nn[n-]n2)c1	ZINC000737861195	579135139	/nfs/dbraw/zinc/13/51/39/579135139.db2.gz	CXPBXZBOVZUOHU-UHFFFAOYSA-N	-1	3	346.282	1.139	20	5		EDBDHM
O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000738165954	579167075	/nfs/dbraw/zinc/16/70/75/579167075.db2.gz	IJIAPBNIBGULIC-UHFFFAOYSA-N	-1	3	345.250	1.267	20	5		EDBDHM
O=C(Nc1ccncc1-c1nnn[n-]1)c1cc(Cl)cc([N+](=O)[O-])c1	ZINC000738196546	579170499	/nfs/dbraw/zinc/17/04/99/579170499.db2.gz	LMWOIQQXPWQCNT-UHFFFAOYSA-N	-1	3	345.706	1.498	20	5		EDBDHM
O=C(Nc1ccncc1-c1nn[n-]n1)c1cc(Cl)cc([N+](=O)[O-])c1	ZINC000738196546	579170500	/nfs/dbraw/zinc/17/05/00/579170500.db2.gz	LMWOIQQXPWQCNT-UHFFFAOYSA-N	-1	3	345.706	1.498	20	5		EDBDHM
CNC(=O)c1ccc(C(=O)[N-]c2cc([N+](=O)[O-])c(F)cc2F)cn1	ZINC000747295728	579637768	/nfs/dbraw/zinc/63/77/68/579637768.db2.gz	XPIQXMWFJOOFBW-UHFFFAOYSA-N	-1	3	336.254	1.880	20	5		EDBDHM
Cc1ccc([C@H](O)C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)o1	ZINC000751446034	579807433	/nfs/dbraw/zinc/80/74/33/579807433.db2.gz	KZEYETXAGUKKAM-LLVKDONJSA-N	-1	3	344.320	1.647	20	5		EDBDHM
COC(=O)C[C@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C1CC1	ZINC000754240805	579899135	/nfs/dbraw/zinc/89/91/35/579899135.db2.gz	YKBYEAVDBCKXHO-NSHDSACASA-N	-1	3	342.373	1.523	20	5		EDBDHM
CCOC(=O)[C@H](C)[C@@H](C)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768892505	580223639	/nfs/dbraw/zinc/22/36/39/580223639.db2.gz	RAQQAUQUIHZGBB-HTQZYQBOSA-N	-1	3	336.391	1.522	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC2OCCCO2)c1[N+](=O)[O-]	ZINC000798222952	580991339	/nfs/dbraw/zinc/99/13/39/580991339.db2.gz	YHKVAKWQMMZXLR-UHFFFAOYSA-N	-1	3	330.362	1.253	20	5		EDBDHM
COc1c([O-])ccc(CN2CCN(C[C@@H](C)O)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000894158943	591211475	/nfs/dbraw/zinc/21/14/75/591211475.db2.gz	RCCISRCJBLDDBM-NWDGAFQWSA-N	-1	3	339.392	1.196	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@H]1COC[C@H]1C1CC1	ZINC000908415214	592487172	/nfs/dbraw/zinc/48/71/72/592487172.db2.gz	RQKNDSXHRMLGME-QWRGUYRKSA-N	-1	3	346.792	1.952	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H]1CC[C@@H](C2CC2)O1	ZINC000907468733	592650827	/nfs/dbraw/zinc/65/08/27/592650827.db2.gz	KNHJEACJKAAITL-AAEUAGOBSA-N	-1	3	326.374	1.831	20	5		EDBDHM
CCOc1nc2ccc(C(=O)OCCn3cc([N+](=O)[O-])cn3)cc2[n-]1	ZINC000815441838	593635427	/nfs/dbraw/zinc/63/54/27/593635427.db2.gz	LTYVNCFUHNKOEF-UHFFFAOYSA-N	-1	3	345.315	1.923	20	5		EDBDHM
CCOc1nc2cc(C(=O)OCCn3cc([N+](=O)[O-])cn3)ccc2[n-]1	ZINC000815441838	593635428	/nfs/dbraw/zinc/63/54/28/593635428.db2.gz	LTYVNCFUHNKOEF-UHFFFAOYSA-N	-1	3	345.315	1.923	20	5		EDBDHM
CNc1nc(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cs1	ZINC000821637341	593890903	/nfs/dbraw/zinc/89/09/03/593890903.db2.gz	BVMJJIYBAGWHHQ-UHFFFAOYSA-N	-1	3	333.337	1.280	20	5		EDBDHM
CNc1nc(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)cs1	ZINC000821637341	593890904	/nfs/dbraw/zinc/89/09/04/593890904.db2.gz	BVMJJIYBAGWHHQ-UHFFFAOYSA-N	-1	3	333.337	1.280	20	5		EDBDHM
CO[C@@]1(C)C[C@@H](Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)C1(C)C	ZINC000821679199	593909153	/nfs/dbraw/zinc/90/91/53/593909153.db2.gz	YIVRGHUNDOZXSZ-YGRLFVJLSA-N	-1	3	333.352	1.785	20	5		EDBDHM
CO[C@@]1(C)C[C@@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)C1(C)C	ZINC000821679199	593909155	/nfs/dbraw/zinc/90/91/55/593909155.db2.gz	YIVRGHUNDOZXSZ-YGRLFVJLSA-N	-1	3	333.352	1.785	20	5		EDBDHM
Cc1c(NC(=O)c2cc(-c3nnn[n-]3)cn2C)cccc1[N+](=O)[O-]	ZINC000822103627	593994131	/nfs/dbraw/zinc/99/41/31/593994131.db2.gz	IYRTYLPTSYRINA-UHFFFAOYSA-N	-1	3	327.304	1.674	20	5		EDBDHM
Cc1c(NC(=O)c2cc(-c3nn[n-]n3)cn2C)cccc1[N+](=O)[O-]	ZINC000822103627	593994132	/nfs/dbraw/zinc/99/41/32/593994132.db2.gz	IYRTYLPTSYRINA-UHFFFAOYSA-N	-1	3	327.304	1.674	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cc(-c2nnn[n-]2)cn1C	ZINC000822271032	594022056	/nfs/dbraw/zinc/02/20/56/594022056.db2.gz	JEIBBAKQLWKXLF-UHFFFAOYSA-N	-1	3	341.331	1.983	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cc(-c2nn[n-]n2)cn1C	ZINC000822271032	594022058	/nfs/dbraw/zinc/02/20/58/594022058.db2.gz	JEIBBAKQLWKXLF-UHFFFAOYSA-N	-1	3	341.331	1.983	20	5		EDBDHM
C[C@@H](OC(=O)c1nn(C)cc1[N+](=O)[O-])c1cccc(-c2nnn[n-]2)c1	ZINC000824731716	594064195	/nfs/dbraw/zinc/06/41/95/594064195.db2.gz	XUZHCPUOUFNZRA-MRVPVSSYSA-N	-1	3	343.303	1.426	20	5		EDBDHM
C[C@@H](OC(=O)c1nn(C)cc1[N+](=O)[O-])c1cccc(-c2nn[n-]n2)c1	ZINC000824731716	594064196	/nfs/dbraw/zinc/06/41/96/594064196.db2.gz	XUZHCPUOUFNZRA-MRVPVSSYSA-N	-1	3	343.303	1.426	20	5		EDBDHM
CCCCCN(CC(N)=O)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000825271193	594159430	/nfs/dbraw/zinc/15/94/30/594159430.db2.gz	IDHIHLNWRGCMAN-UHFFFAOYSA-N	-1	3	333.352	1.257	20	5		EDBDHM
CCCCCN(CC(N)=O)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000825271193	594159432	/nfs/dbraw/zinc/15/94/32/594159432.db2.gz	IDHIHLNWRGCMAN-UHFFFAOYSA-N	-1	3	333.352	1.257	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCCO[C@H]2CCOC2)c(-c2nnn[n-]2)c1	ZINC000823640085	594223956	/nfs/dbraw/zinc/22/39/56/594223956.db2.gz	RLIZJGGOWGDFEI-NSHDSACASA-N	-1	3	334.336	1.382	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCCO[C@H]2CCOC2)c(-c2nn[n-]n2)c1	ZINC000823640085	594223957	/nfs/dbraw/zinc/22/39/57/594223957.db2.gz	RLIZJGGOWGDFEI-NSHDSACASA-N	-1	3	334.336	1.382	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC[C@]3(O)CCCC[C@@H]3C2)c(-c2nnn[n-]2)c1	ZINC000823647155	594224580	/nfs/dbraw/zinc/22/45/80/594224580.db2.gz	HDTSGQDMHFTAJZ-MEBBXXQBSA-N	-1	3	345.363	1.301	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC[C@]3(O)CCCC[C@@H]3C2)c(-c2nn[n-]n2)c1	ZINC000823647155	594224581	/nfs/dbraw/zinc/22/45/81/594224581.db2.gz	HDTSGQDMHFTAJZ-MEBBXXQBSA-N	-1	3	345.363	1.301	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H](CO)c2ccccc2)c(-c2nnn[n-]2)c1	ZINC000823651708	594224639	/nfs/dbraw/zinc/22/46/39/594224639.db2.gz	OCCJOZFQVVMRLB-LLVKDONJSA-N	-1	3	341.331	1.358	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H](CO)c2ccccc2)c(-c2nn[n-]n2)c1	ZINC000823651708	594224640	/nfs/dbraw/zinc/22/46/40/594224640.db2.gz	OCCJOZFQVVMRLB-LLVKDONJSA-N	-1	3	341.331	1.358	20	5		EDBDHM
O=[N+]([O-])c1cnn(CCNc2ccc(Cl)cc2-c2nnn[n-]2)c1	ZINC000823651745	594224930	/nfs/dbraw/zinc/22/49/30/594224930.db2.gz	OGVHQJLDXQGQGP-UHFFFAOYSA-N	-1	3	334.727	1.737	20	5		EDBDHM
O=[N+]([O-])c1cnn(CCNc2ccc(Cl)cc2-c2nn[n-]n2)c1	ZINC000823651745	594224931	/nfs/dbraw/zinc/22/49/31/594224931.db2.gz	OGVHQJLDXQGQGP-UHFFFAOYSA-N	-1	3	334.727	1.737	20	5		EDBDHM
CSc1cc(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)ccn1	ZINC000826230277	594388854	/nfs/dbraw/zinc/38/88/54/594388854.db2.gz	MEBLDEXEYFMPFC-UHFFFAOYSA-N	-1	3	344.360	1.899	20	5		EDBDHM
CSc1cc(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)ccn1	ZINC000826230277	594388855	/nfs/dbraw/zinc/38/88/55/594388855.db2.gz	MEBLDEXEYFMPFC-UHFFFAOYSA-N	-1	3	344.360	1.899	20	5		EDBDHM
CC[C@H](C)N(OC)C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000830475847	594402744	/nfs/dbraw/zinc/40/27/44/594402744.db2.gz	ZLHBTABARUCMPP-JTQLQIEISA-N	-1	3	345.377	1.062	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC(c3cc[nH]n3)CC2)cc1-c1nnn[n-]1	ZINC000826498938	594502876	/nfs/dbraw/zinc/50/28/76/594502876.db2.gz	PFHNEVFQNXWUET-UHFFFAOYSA-N	-1	3	340.347	1.882	20	5		EDBDHM
CC[C@@H](NCCN1CCN(C(=O)[O-])CC1)c1cccc([N+](=O)[O-])c1	ZINC000826618425	594541304	/nfs/dbraw/zinc/54/13/04/594541304.db2.gz	DNPWYPVUAPYCLN-OAHLLOKOSA-N	-1	3	336.392	1.931	20	5		EDBDHM
C[C@@H](C(=O)[O-])[C@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1ccccc1	ZINC000833407153	594842371	/nfs/dbraw/zinc/84/23/71/594842371.db2.gz	LFPWBAJKEKSKLP-WBMJQRKESA-N	-1	3	345.355	1.808	20	5		EDBDHM
CC[C@H](NCCc1cn(CC(=O)[O-])nn1)c1cccc([N+](=O)[O-])c1	ZINC000833643943	594895721	/nfs/dbraw/zinc/89/57/21/594895721.db2.gz	JFJYUMRNBYAUIG-AWEZNQCLSA-N	-1	3	333.348	1.554	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H]2C[C@@](C)(O)C2)cc1[N+](=O)[O-]	ZINC000841574092	594925744	/nfs/dbraw/zinc/92/57/44/594925744.db2.gz	TUTSNZKTICSXTM-LYWQIFSTSA-N	-1	3	334.781	1.748	20	5		EDBDHM
Cc1ncc(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)s1	ZINC000845903278	595092661	/nfs/dbraw/zinc/09/26/61/595092661.db2.gz	YGFDKFSAWSAJQD-UHFFFAOYSA-N	-1	3	328.375	1.276	20	5		EDBDHM
COC1(CS(=O)(=O)[N-]c2ccc(N)c([N+](=O)[O-])c2)CCOCC1	ZINC000844644238	595366766	/nfs/dbraw/zinc/36/67/66/595366766.db2.gz	IPFJKLXSVPYYLP-UHFFFAOYSA-N	-1	3	345.377	1.114	20	5		EDBDHM
COC[C@H](C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1)OC	ZINC000848587869	595410550	/nfs/dbraw/zinc/41/05/50/595410550.db2.gz	YSBJDOMZRARENH-NSHDSACASA-N	-1	3	334.275	1.344	20	5		EDBDHM
O=C([N-][C@@H]1CCNC(=O)CC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848590617	595411577	/nfs/dbraw/zinc/41/15/77/595411577.db2.gz	FZNRZYPDQDKXLV-VIFPVBQESA-N	-1	3	343.286	1.351	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]CCO[C@@H]2CC2(F)F)cs1	ZINC000849443530	595526546	/nfs/dbraw/zinc/52/65/46/595526546.db2.gz	DZGMHIWSFQIKRU-SSDOTTSWSA-N	-1	3	328.318	1.359	20	5		EDBDHM
COC(=O)C1=CC[C@H]([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000859288519	596035615	/nfs/dbraw/zinc/03/56/15/596035615.db2.gz	ZALVCVVSOGIRCM-NSHDSACASA-N	-1	3	340.357	1.443	20	5		EDBDHM
Cc1c([N+](=O)[O-])cc(C(=O)NCCCc2cc(=O)[nH][n-]2)cc1[N+](=O)[O-]	ZINC000854488784	596095851	/nfs/dbraw/zinc/09/58/51/596095851.db2.gz	XDXPDWOMAZKHQA-UHFFFAOYSA-N	-1	3	349.303	1.197	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C)CN1CCCC1=O	ZINC000055280273	214300132	/nfs/dbraw/zinc/30/01/32/214300132.db2.gz	NRAVDGVBPFUIGJ-NSHDSACASA-N	-1	3	341.389	1.192	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCCc2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000102661837	219220556	/nfs/dbraw/zinc/22/05/56/219220556.db2.gz	PXLXFEPVGAUTHM-UHFFFAOYSA-N	-1	3	338.389	1.548	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H](C)[C@@H](C)CO)c1	ZINC000183716246	235205640	/nfs/dbraw/zinc/20/56/40/235205640.db2.gz	LOVGKHXOUBZOAZ-DTWKUNHWSA-N	-1	3	336.797	1.852	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]CC2CCOCC2)cc1[N+](=O)[O-]	ZINC000184283890	235355249	/nfs/dbraw/zinc/35/52/49/235355249.db2.gz	UDFKECYDHDTRCL-UHFFFAOYSA-N	-1	3	332.353	1.747	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]Cc1cnn2ccccc12	ZINC000077193898	138251873	/nfs/dbraw/zinc/25/18/73/138251873.db2.gz	SDRYYKFYAOJPCT-UHFFFAOYSA-N	-1	3	332.341	1.721	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]Cc2ccc(C(N)=O)o2)cc1[N+](=O)[O-]	ZINC000124987112	138331166	/nfs/dbraw/zinc/33/11/66/138331166.db2.gz	OJMFVSYTASKJOS-UHFFFAOYSA-N	-1	3	345.358	1.135	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CC[C@H](C)[S@](C)=O)cc1[N+](=O)[O-]	ZINC000125659142	138335432	/nfs/dbraw/zinc/33/54/32/138335432.db2.gz	PKVZNJKEUHESIX-ZDVLTJLQSA-N	-1	3	340.448	1.400	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCCN2CCOC2=O)c([N+](=O)[O-])c1	ZINC000491066583	255117530	/nfs/dbraw/zinc/11/75/30/255117530.db2.gz	WDRZNQXTILJEDM-UHFFFAOYSA-N	-1	3	343.361	1.024	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CCn3ccnc3C2)c([N+](=O)[O-])c1	ZINC000492298055	255168532	/nfs/dbraw/zinc/16/85/32/255168532.db2.gz	WOKBMCCVNYBEPS-LLVKDONJSA-N	-1	3	336.373	1.393	20	5		EDBDHM
C/C=C/C[C@H](CO)[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	ZINC000493910137	255225856	/nfs/dbraw/zinc/22/58/56/255225856.db2.gz	YZNHNXJBTBMLMN-CDAZIORVSA-N	-1	3	348.352	1.348	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C1CC1	ZINC000263980748	139373629	/nfs/dbraw/zinc/37/36/29/139373629.db2.gz	FWJSWPGDKJWZIW-QMMMGPOBSA-N	-1	3	328.346	1.443	20	5		EDBDHM
Cc1ccc(CNCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])o1	ZINC000116922598	221011795	/nfs/dbraw/zinc/01/17/95/221011795.db2.gz	MAHNMGZMORQKID-UHFFFAOYSA-N	-1	3	339.373	1.564	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](O)C(C)(C)C)c1C	ZINC000119071796	221236635	/nfs/dbraw/zinc/23/66/35/221236635.db2.gz	HASIRXMUBHQQGJ-GFCCVEGCSA-N	-1	3	330.406	1.897	20	5		EDBDHM
CC[C@@H](C)[C@@H](O)C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000119358909	221303568	/nfs/dbraw/zinc/30/35/68/221303568.db2.gz	VBXJVJYZLJHFGE-RNCFNFMXSA-N	-1	3	330.406	1.897	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C1CCOCC1	ZINC000132971296	533482746	/nfs/dbraw/zinc/48/27/46/533482746.db2.gz	WMDLFWJLVCMJFI-SECBINFHSA-N	-1	3	332.353	1.827	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CCCC[C@@H]1O	ZINC000269835121	140003258	/nfs/dbraw/zinc/00/32/58/140003258.db2.gz	XWLUTUOEOFZNGZ-PWSUYJOCSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COC(=O)[C@@H]([N-]S(=O)(=O)CCc1ccccc1[N+](=O)[O-])C(C)C	ZINC000270968441	140210527	/nfs/dbraw/zinc/21/05/27/140210527.db2.gz	ZFXGNNYFYUDSCY-ZDUSSCGKSA-N	-1	3	344.389	1.254	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)on1	ZINC000416388268	304313971	/nfs/dbraw/zinc/31/39/71/304313971.db2.gz	KCIXUYFUXGVDGQ-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
Cn1c(C(=O)NCc2ccc(-c3nnn[n-]3)cc2)ccc1[N+](=O)[O-]	ZINC000345498386	143098564	/nfs/dbraw/zinc/09/85/64/143098564.db2.gz	PSINVJLYBHZUHQ-UHFFFAOYSA-N	-1	3	327.304	1.043	20	5		EDBDHM
Cn1c(C(=O)NCc2ccc(-c3nn[n-]n3)cc2)ccc1[N+](=O)[O-]	ZINC000345498386	143098565	/nfs/dbraw/zinc/09/85/65/143098565.db2.gz	PSINVJLYBHZUHQ-UHFFFAOYSA-N	-1	3	327.304	1.043	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC[C@@H](O)C(F)(F)F)c([N+](=O)[O-])c1	ZINC000349961621	143523391	/nfs/dbraw/zinc/52/33/91/143523391.db2.gz	BJULPBLROWDWNJ-SNVBAGLBSA-N	-1	3	342.295	1.495	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCC[C@@H](CO)C2)cc1[N+](=O)[O-]	ZINC000416645953	304341007	/nfs/dbraw/zinc/34/10/07/304341007.db2.gz	GJTJDVADQLXZGI-NXEZZACHSA-N	-1	3	334.419	1.794	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2ccc(F)cn2)c(F)c1	ZINC000357171639	150946358	/nfs/dbraw/zinc/94/63/58/150946358.db2.gz	OYWLDQBRUHHMSV-UHFFFAOYSA-N	-1	3	329.284	1.747	20	5		EDBDHM
CCO[C@@H]1COCC[C@H]1[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000352983969	286229082	/nfs/dbraw/zinc/22/90/82/286229082.db2.gz	PGMNHTFCOZYOOE-DGCLKSJQSA-N	-1	3	344.389	1.376	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1cccn(C)c1=O	ZINC000357546013	151063383	/nfs/dbraw/zinc/06/33/83/151063383.db2.gz	FFUJDHBNRDRIHF-UHFFFAOYSA-N	-1	3	339.329	1.103	20	5		EDBDHM
COC(=O)c1c(C)nc(=O)[n-]c1SCCn1ccc([N+](=O)[O-])n1	ZINC000360384731	152015065	/nfs/dbraw/zinc/01/50/65/152015065.db2.gz	NAVOYNSKOZKQAN-UHFFFAOYSA-N	-1	3	339.333	1.174	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CCN(C)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000360654678	152141508	/nfs/dbraw/zinc/14/15/08/152141508.db2.gz	VPKJNSRUGBKCRL-NEPJUHHUSA-N	-1	3	327.406	1.664	20	5		EDBDHM
Cc1cc(=O)[n-]c([C@@H](C)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)n1	ZINC000363966282	153110082	/nfs/dbraw/zinc/11/00/82/153110082.db2.gz	FZAZUHFGQHJPPD-LLVKDONJSA-N	-1	3	332.364	1.993	20	5		EDBDHM
Cc1cc(=O)[n-]c([C@@H](C)N2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)n1	ZINC000364273643	153193531	/nfs/dbraw/zinc/19/35/31/153193531.db2.gz	QEJBXHYTSGFDNK-NEPJUHHUSA-N	-1	3	332.364	1.993	20	5		EDBDHM
O=C(Nc1ccc(-c2cncnc2)cn1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000374099076	157142397	/nfs/dbraw/zinc/14/23/97/157142397.db2.gz	JUPFTVXPIMVKBI-UHFFFAOYSA-N	-1	3	338.283	1.800	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCO[C@H]2C2CC2)c(F)c1	ZINC000378324095	158141730	/nfs/dbraw/zinc/14/17/30/158141730.db2.gz	RHQIUIIZJXNULS-YPMHNXCESA-N	-1	3	330.337	1.580	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCO[C@H]2C2CC2)c(F)c1	ZINC000378324092	158141846	/nfs/dbraw/zinc/14/18/46/158141846.db2.gz	RHQIUIIZJXNULS-AAEUAGOBSA-N	-1	3	330.337	1.580	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CSC[C@@H]1C	ZINC000352345982	162131584	/nfs/dbraw/zinc/13/15/84/162131584.db2.gz	PAFNHMVBTPEWNR-WCBMZHEXSA-N	-1	3	332.403	1.633	20	5		EDBDHM
C[C@@H](O)C[C@H](C)C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000120789858	287364827	/nfs/dbraw/zinc/36/48/27/287364827.db2.gz	OFJWPOOJFORTID-DTWKUNHWSA-N	-1	3	336.797	1.934	20	5		EDBDHM
CCC(CC)([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C(N)=O	ZINC000123486236	222285830	/nfs/dbraw/zinc/28/58/30/222285830.db2.gz	CIWRQCORBDTWHK-UHFFFAOYSA-N	-1	3	335.407	1.287	20	5		EDBDHM
C[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CN1C1CC1	ZINC000124085541	222373812	/nfs/dbraw/zinc/37/38/12/222373812.db2.gz	PZWWNXJCVOHQCM-NXEZZACHSA-N	-1	3	343.380	1.637	20	5		EDBDHM
CC(C)N1CCC[C@H]([N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1	ZINC000274647375	268175557	/nfs/dbraw/zinc/17/55/57/268175557.db2.gz	DPLAPAMXNFURFZ-NSHDSACASA-N	-1	3	345.396	1.885	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C(C)C)C(C)(C)O	ZINC000360130770	302047888	/nfs/dbraw/zinc/04/78/88/302047888.db2.gz	JMVYCIFWEZVIKE-ZDUSSCGKSA-N	-1	3	330.406	1.977	20	5		EDBDHM
O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)[N-][C@@H]1CC[C@H]1O	ZINC000425208400	304954777	/nfs/dbraw/zinc/95/47/77/304954777.db2.gz	OMOPQKWTWJGMIJ-VXNVDRBHSA-N	-1	3	340.279	1.415	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H](CCO)C(C)(C)C)c([N+](=O)[O-])c1	ZINC000443126664	305235523	/nfs/dbraw/zinc/23/55/23/305235523.db2.gz	HJIMNBMUNXXQGL-ZDUSSCGKSA-N	-1	3	330.406	1.979	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1(CCO)CCC1	ZINC000443509356	305239039	/nfs/dbraw/zinc/23/90/39/305239039.db2.gz	MXEBKBKEPXPKCV-UHFFFAOYSA-N	-1	3	344.389	1.434	20	5		EDBDHM
CO[C@@H]1COCC[C@@H]1C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000451771000	305368261	/nfs/dbraw/zinc/36/82/61/305368261.db2.gz	GQTPJTXYPPHVAP-DGCLKSJQSA-N	-1	3	344.389	1.233	20	5		EDBDHM
Cc1ncc(CNC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)c(=O)[n-]1	ZINC000544264402	306073384	/nfs/dbraw/zinc/07/33/84/306073384.db2.gz	OBPVBYLRWDLKTO-UHFFFAOYSA-N	-1	3	346.299	1.100	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2)nc1=N	ZINC000549719210	306147792	/nfs/dbraw/zinc/14/77/92/306147792.db2.gz	URCCDPNKOGUKCY-LBPRGKRZSA-N	-1	3	330.348	1.042	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C1CCN(C2CC2)CC1	ZINC000046033873	441070089	/nfs/dbraw/zinc/07/00/89/441070089.db2.gz	IMUYQFVZQVFJNN-UHFFFAOYSA-N	-1	3	339.417	1.808	20	5		EDBDHM
CC[C@H](C)N(C)CC[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000104103838	441190121	/nfs/dbraw/zinc/19/01/21/441190121.db2.gz	RFKJICNXCRBTSZ-JTQLQIEISA-N	-1	3	333.385	1.743	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H]1CCCN(C)C1	ZINC000108406785	441452085	/nfs/dbraw/zinc/45/20/85/441452085.db2.gz	DBQXUAHZZGVZJP-LBPRGKRZSA-N	-1	3	327.406	1.523	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)N1CCCCC1	ZINC000055240081	441633008	/nfs/dbraw/zinc/63/30/08/441633008.db2.gz	CEWNPPFZQYJKDG-UHFFFAOYSA-N	-1	3	345.352	1.025	20	5		EDBDHM
CNC(=O)C(C)(C)C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000119848856	441963273	/nfs/dbraw/zinc/96/32/73/441963273.db2.gz	HXOYNAWRZWAQIO-UHFFFAOYSA-N	-1	3	343.405	1.262	20	5		EDBDHM
CCCc1[nH]nc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)c1[N+](=O)[O-]	ZINC000158090507	442645260	/nfs/dbraw/zinc/64/52/60/442645260.db2.gz	NNAVNALEVDTLFG-UHFFFAOYSA-N	-1	3	342.319	1.703	20	5		EDBDHM
CCCc1[nH]nc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)c1[N+](=O)[O-]	ZINC000158090507	442645265	/nfs/dbraw/zinc/64/52/65/442645265.db2.gz	NNAVNALEVDTLFG-UHFFFAOYSA-N	-1	3	342.319	1.703	20	5		EDBDHM
CN(C)Cc1cccc(CNC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000188165215	442719344	/nfs/dbraw/zinc/71/93/44/442719344.db2.gz	XAKSSEWDWMGTHE-UHFFFAOYSA-N	-1	3	330.344	1.687	20	5		EDBDHM
CN(C)CCN(Cc1ccccn1)C(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000193733616	442776482	/nfs/dbraw/zinc/77/64/82/442776482.db2.gz	VELVPUHOICSUFR-UHFFFAOYSA-N	-1	3	345.359	1.294	20	5		EDBDHM
CC[C@@H](CCO)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000268558979	443034211	/nfs/dbraw/zinc/03/42/11/443034211.db2.gz	DCXKKJNOPMZMAU-JTQLQIEISA-N	-1	3	332.378	1.290	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H](CO)C(C)C)c1	ZINC000272574839	443368525	/nfs/dbraw/zinc/36/85/25/443368525.db2.gz	XHHZKDCJYSKUNR-SECBINFHSA-N	-1	3	336.797	1.852	20	5		EDBDHM
COC(=O)[C@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C1CC1	ZINC000267684269	443539921	/nfs/dbraw/zinc/53/99/21/443539921.db2.gz	FCHCVQDGAJADAL-LLVKDONJSA-N	-1	3	328.346	1.133	20	5		EDBDHM
CCOC(=O)[C@@H](C)[C@H](C)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000273051028	443528352	/nfs/dbraw/zinc/52/83/52/443528352.db2.gz	GGXIOTZVIZSDEX-UWVGGRQHSA-N	-1	3	330.362	1.461	20	5		EDBDHM
Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H](O)C(F)(F)F	ZINC000272141896	443539695	/nfs/dbraw/zinc/53/96/95/443539695.db2.gz	BCAXRUMAZHWTQU-VIFPVBQESA-N	-1	3	346.258	1.244	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1C[C@H]2CC[C@@H]1O2	ZINC000265236685	443579186	/nfs/dbraw/zinc/57/91/86/443579186.db2.gz	SASCGTVREWEMFV-MXWKQRLJSA-N	-1	3	328.346	1.202	20	5		EDBDHM
CC(C)(C)[C@H]([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C(N)=O	ZINC000272166637	443545166	/nfs/dbraw/zinc/54/51/66/443545166.db2.gz	OZWAPECTIMOHFM-SNVBAGLBSA-N	-1	3	329.303	1.703	20	5		EDBDHM
CN(C)CC1([N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CCC1	ZINC000281586988	443951064	/nfs/dbraw/zinc/95/10/64/443951064.db2.gz	QTAQKLONDVHUEC-UHFFFAOYSA-N	-1	3	331.369	1.497	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1c[nH]nc1C	ZINC000299227505	443988991	/nfs/dbraw/zinc/98/89/91/443988991.db2.gz	DBNSJPAMKODVCR-UHFFFAOYSA-N	-1	3	326.334	1.113	20	5		EDBDHM
NC(=O)CCSc1ccccc1[N-]C(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC000548085963	320859946	/nfs/dbraw/zinc/85/99/46/320859946.db2.gz	BCEVJJJNMLUBDF-UHFFFAOYSA-N	-1	3	335.345	1.538	20	5		EDBDHM
Cc1nc([C@@H](C)[N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])n[nH]1	ZINC000285490538	444003997	/nfs/dbraw/zinc/00/39/97/444003997.db2.gz	WRVSAAPNAZWBTF-SECBINFHSA-N	-1	3	339.377	1.678	20	5		EDBDHM
Cc1nnc([C@@H](C)[N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])[nH]1	ZINC000285490538	444004001	/nfs/dbraw/zinc/00/40/01/444004001.db2.gz	WRVSAAPNAZWBTF-SECBINFHSA-N	-1	3	339.377	1.678	20	5		EDBDHM
Cc1sc(C(=O)N2CCC[C@H]2c2nc(=N)n(C)[n-]2)cc1[N+](=O)[O-]	ZINC000555545059	320970030	/nfs/dbraw/zinc/97/00/30/320970030.db2.gz	XZIOTKRWLFYUMF-QMMMGPOBSA-N	-1	3	336.377	1.483	20	5		EDBDHM
Cc1nnc(NC(=O)c2n[n-]c3ccc([N+](=O)[O-])cc32)n1C1CC1	ZINC000285760259	444099317	/nfs/dbraw/zinc/09/93/17/444099317.db2.gz	KLOFLRGQMKJNTL-UHFFFAOYSA-N	-1	3	327.304	1.958	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@]2(C)CCOC2=O)c1	ZINC000289563321	444172455	/nfs/dbraw/zinc/17/24/55/444172455.db2.gz	NWMAKQAOZYSOCK-GFCCVEGCSA-N	-1	3	348.764	1.541	20	5		EDBDHM
NS(=O)(=O)c1cccc(NCc2ccc([O-])c(F)c2)c1[N+](=O)[O-]	ZINC000302121470	444204742	/nfs/dbraw/zinc/20/47/42/444204742.db2.gz	GFMNPMRBLQRJHP-UHFFFAOYSA-N	-1	3	341.320	1.699	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2CC)n[nH]1	ZINC000296546437	444238141	/nfs/dbraw/zinc/23/81/41/444238141.db2.gz	BPDREAJWDRBUBZ-UHFFFAOYSA-N	-1	3	339.377	1.316	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)[C@@H](O)CC	ZINC000313102714	444295471	/nfs/dbraw/zinc/29/54/71/444295471.db2.gz	VMRNTPQHPOZFHY-MNOVXSKESA-N	-1	3	332.378	1.431	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C	ZINC000321736249	444337309	/nfs/dbraw/zinc/33/73/09/444337309.db2.gz	JBZOTWWLFAKIDH-SNVBAGLBSA-N	-1	3	344.389	1.744	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)c1ccon1	ZINC000342351040	444647691	/nfs/dbraw/zinc/64/76/91/444647691.db2.gz	QNOQMPUCEIBMQI-MRVPVSSYSA-N	-1	3	327.318	1.631	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]Cc2noc(C3CC3)n2)cc1[N+](=O)[O-]	ZINC000342489519	444712937	/nfs/dbraw/zinc/71/29/37/444712937.db2.gz	MQCWKNWZFDHRMQ-UHFFFAOYSA-N	-1	3	344.374	1.704	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@]1(C)CCO[C@H]1C	ZINC000343994842	444715989	/nfs/dbraw/zinc/71/59/89/444715989.db2.gz	WOLGBIMCPUJPRX-TVQRCGJNSA-N	-1	3	330.362	1.449	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000336870715	444814565	/nfs/dbraw/zinc/81/45/65/444814565.db2.gz	KCVACWZOXVFNAR-JTQLQIEISA-N	-1	3	344.389	1.744	20	5		EDBDHM
CC(C)(C)n1ncnc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000336992875	444891363	/nfs/dbraw/zinc/89/13/63/444891363.db2.gz	MGXMZCTYNUDUAU-UHFFFAOYSA-N	-1	3	345.406	1.481	20	5		EDBDHM
O=C(Nc1ccc(N2CCC2=O)cc1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000337107088	444946624	/nfs/dbraw/zinc/94/66/24/444946624.db2.gz	JBEAJHCAGPYEIC-UHFFFAOYSA-N	-1	3	328.284	1.684	20	5		EDBDHM
CS[C@@H]1CN(C(=O)c2cc([O-])ccc2[N+](=O)[O-])C[C@@H]1N(C)C	ZINC000330603845	445056983	/nfs/dbraw/zinc/05/69/83/445056983.db2.gz	KORFRNBDSCCDMB-QWHCGFSZSA-N	-1	3	325.390	1.418	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@]2(C)CCOC2)cc1C	ZINC000354517627	445275020	/nfs/dbraw/zinc/27/50/20/445275020.db2.gz	YMLJYOKZVROLFJ-AWEZNQCLSA-N	-1	3	328.390	1.917	20	5		EDBDHM
Cn1ccc(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)n1	ZINC000354693217	445343281	/nfs/dbraw/zinc/34/32/81/445343281.db2.gz	OLIBLDFHZNGGSI-UHFFFAOYSA-N	-1	3	344.780	1.503	20	5		EDBDHM
Cc1cc(NC(=O)c2n[n-]c3ccc([N+](=O)[O-])cc32)c(=O)n(C)c1	ZINC000355002133	445438049	/nfs/dbraw/zinc/43/80/49/445438049.db2.gz	AQNKVQRXRRPWHT-UHFFFAOYSA-N	-1	3	327.300	1.731	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2[C@@H]3CCC[C@@H]32)cc1[N+](=O)[O-]	ZINC000362979507	445635913	/nfs/dbraw/zinc/63/59/13/445635913.db2.gz	JMTVXBIEOABNGJ-GDGBQDQQSA-N	-1	3	330.337	1.819	20	5		EDBDHM
Cc1c(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)n[nH]c1-c1ccncc1	ZINC000364615021	445937037	/nfs/dbraw/zinc/93/70/37/445937037.db2.gz	QMEYOXJBYWCTHD-UHFFFAOYSA-N	-1	3	340.299	2.041	20	5		EDBDHM
O=C([O-])[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)C[C@@H]1c1ccccc1	ZINC000583505352	326087151	/nfs/dbraw/zinc/08/71/51/326087151.db2.gz	BQLWUHUFOWEMJS-ZIAGYGMSSA-N	-1	3	330.344	1.592	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H]1CCNCC1(F)F	ZINC000420437092	446612551	/nfs/dbraw/zinc/61/25/51/446612551.db2.gz	BYPWRLRTSLKAEC-JTQLQIEISA-N	-1	3	349.359	1.426	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@H]2CCN(C)C(=O)C2)cc1[N+](=O)[O-]	ZINC000425181782	447048011	/nfs/dbraw/zinc/04/80/11/447048011.db2.gz	HYZGZSWPDNNBDX-VIFPVBQESA-N	-1	3	347.418	1.111	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@H]2CCN(C)C(=O)C2)c([N+](=O)[O-])c1	ZINC000425182951	447049337	/nfs/dbraw/zinc/04/93/37/447049337.db2.gz	LFLVCLNFMHIBKV-NSHDSACASA-N	-1	3	341.389	1.050	20	5		EDBDHM
O=C([O-])CN1CCCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1	ZINC000392490767	447523533	/nfs/dbraw/zinc/52/35/33/447523533.db2.gz	XROFDGKTTFZCTF-UHFFFAOYSA-N	-1	3	348.281	1.605	20	5		EDBDHM
Cc1ncc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)o1	ZINC000416546460	447642515	/nfs/dbraw/zinc/64/25/15/447642515.db2.gz	LLGYXTDYHWXVKO-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
Cc1nc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)n(-c2ccccc2)n1	ZINC000570153304	447953787	/nfs/dbraw/zinc/95/37/87/447953787.db2.gz	QOONDADOOAPQIL-UHFFFAOYSA-N	-1	3	340.299	1.259	20	5		EDBDHM
C[C@H](C(=O)Nc1cc(-c2nccn2C)[n-]n1)c1cccc([N+](=O)[O-])c1	ZINC000517272947	448568425	/nfs/dbraw/zinc/56/84/25/448568425.db2.gz	AMSCNAXWNZNWPI-JTQLQIEISA-N	-1	3	340.343	2.461	20	5		EDBDHM
C[C@H](C(=O)Nc1cc(-c2nccn2C)n[n-]1)c1cccc([N+](=O)[O-])c1	ZINC000517272947	448568435	/nfs/dbraw/zinc/56/84/35/448568435.db2.gz	AMSCNAXWNZNWPI-JTQLQIEISA-N	-1	3	340.343	2.461	20	5		EDBDHM
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)[C@@H](C)C(=O)Nc1ncccc1[O-]	ZINC000588860807	448941326	/nfs/dbraw/zinc/94/13/26/448941326.db2.gz	AQBHNTFFRKSTJC-RKDXNWHRSA-N	-1	3	348.315	1.682	20	5		EDBDHM
NC(=O)Cc1ccc(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000589235659	448994620	/nfs/dbraw/zinc/99/46/20/448994620.db2.gz	JNGLVOXASXQFSA-UHFFFAOYSA-N	-1	3	349.368	1.101	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000589837210	449066293	/nfs/dbraw/zinc/06/62/93/449066293.db2.gz	NTTPIHMQPPNBNS-VIFPVBQESA-N	-1	3	340.286	1.044	20	5		EDBDHM
CC(C)[C@@H]1C[C@@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCO1	ZINC000593602492	449102554	/nfs/dbraw/zinc/10/25/54/449102554.db2.gz	VALNFEREKCPDQB-AAEUAGOBSA-N	-1	3	343.405	1.719	20	5		EDBDHM
CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000590399806	449148132	/nfs/dbraw/zinc/14/81/32/449148132.db2.gz	PCVPQYALXAGDMU-JSGCOSHPSA-N	-1	3	335.360	1.236	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H](C)c2cnccn2)cc1[N+](=O)[O-]	ZINC000590760948	449279633	/nfs/dbraw/zinc/27/96/33/449279633.db2.gz	IMLLUXKTXPNOEP-SSDOTTSWSA-N	-1	3	328.375	1.794	20	5		EDBDHM
CCS(=O)(=O)c1ccccc1[N-]C(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000611538123	449328971	/nfs/dbraw/zinc/32/89/71/449328971.db2.gz	RTKQGSJSPQNWLA-UHFFFAOYSA-N	-1	3	338.345	1.374	20	5		EDBDHM
C[C@H](Nc1cc[n-]c(=O)c1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000596256809	449442448	/nfs/dbraw/zinc/44/24/48/449442448.db2.gz	FMCAWZCWRABJFI-NSHDSACASA-N	-1	3	330.344	1.855	20	5		EDBDHM
CNC(=O)[C@]1(C(F)(F)F)CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1	ZINC000596291391	449459222	/nfs/dbraw/zinc/45/92/22/449459222.db2.gz	IHOGIFOPYABQCK-NSHDSACASA-N	-1	3	334.254	1.200	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CN1CCN(C(C)(C)C(=O)[O-])CC1	ZINC000600675461	449485570	/nfs/dbraw/zinc/48/55/70/449485570.db2.gz	SJHBUBPGHCDKHD-UHFFFAOYSA-N	-1	3	337.376	1.584	20	5		EDBDHM
CC(C)(C(=O)[O-])N1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1	ZINC000600673413	449485876	/nfs/dbraw/zinc/48/58/76/449485876.db2.gz	FQDUFTAISDBKIQ-UHFFFAOYSA-N	-1	3	347.375	1.452	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1CCCN2CCCC[C@H]12	ZINC000594482710	449547692	/nfs/dbraw/zinc/54/76/92/449547692.db2.gz	CTFRSEYAWDSGIN-CHWSQXEVSA-N	-1	3	339.417	1.890	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2OC)n[n-]1	ZINC000617409710	449595528	/nfs/dbraw/zinc/59/55/28/449595528.db2.gz	ZPWXPGBVMTWAAJ-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2OC)[n-]n1	ZINC000617409710	449595535	/nfs/dbraw/zinc/59/55/35/449595535.db2.gz	ZPWXPGBVMTWAAJ-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
CCOc1ccc([N+](=O)[O-])cc1[N-]C(=O)c1nnn(C(C)(C)C)n1	ZINC000598843532	449617532	/nfs/dbraw/zinc/61/75/32/449617532.db2.gz	SKFINIYLDIPIMR-UHFFFAOYSA-N	-1	3	334.336	1.987	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC(O)(C2CC2)C2CC2)c(F)c1	ZINC000594866638	449781637	/nfs/dbraw/zinc/78/16/37/449781637.db2.gz	SPXAYJKCBJQLMM-UHFFFAOYSA-N	-1	3	344.364	1.563	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2C[C@@H](O)C23CCC3)c([N+](=O)[O-])c1	ZINC000594866877	449782873	/nfs/dbraw/zinc/78/28/73/449782873.db2.gz	YUOUVZNFQYVKPS-CHWSQXEVSA-N	-1	3	342.373	1.185	20	5		EDBDHM
C[C@H](CN1CCC(C)CC1)[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594862680	449774269	/nfs/dbraw/zinc/77/42/69/449774269.db2.gz	PBIJTCAYOZZGQF-GFCCVEGCSA-N	-1	3	342.421	1.389	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H](CO)CC2CC2)c(F)c1	ZINC000594863488	449774992	/nfs/dbraw/zinc/77/49/92/449774992.db2.gz	GBNSJKAGGIFZBN-JTQLQIEISA-N	-1	3	332.353	1.421	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@H]2CCCN(C)C2)c([N+](=O)[O-])s1	ZINC000601339203	449848850	/nfs/dbraw/zinc/84/88/50/449848850.db2.gz	ABKRCAOBCHUBAY-JTQLQIEISA-N	-1	3	333.435	1.585	20	5		EDBDHM
C[C@@]1(c2ccc(CNc3cccnc3[N+](=O)[O-])cc2)NC(=O)[N-]C1=O	ZINC000608788529	449938884	/nfs/dbraw/zinc/93/88/84/449938884.db2.gz	LBCQYLIWLONKGC-INIZCTEOSA-N	-1	3	341.327	1.657	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC2COC2)c(C(F)(F)F)c1	ZINC000599490438	450017985	/nfs/dbraw/zinc/01/79/85/450017985.db2.gz	UIPZWPDSLQJZNE-UHFFFAOYSA-N	-1	3	340.279	1.538	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2C[C@@H](C)O[C@@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000601499716	450020005	/nfs/dbraw/zinc/02/00/05/450020005.db2.gz	RLUIUAGVRLSPCH-FXPVBKGRSA-N	-1	3	332.353	1.887	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2C(=O)NCC2(C)C)cc1C	ZINC000595355628	450070802	/nfs/dbraw/zinc/07/08/02/450070802.db2.gz	VZTDRYRRLWCCRC-LBPRGKRZSA-N	-1	3	341.389	1.015	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](CO)C(C)(C)C	ZINC000619495972	450491812	/nfs/dbraw/zinc/49/18/12/450491812.db2.gz	QVUXCJAWTPUNAQ-LLVKDONJSA-N	-1	3	332.378	1.289	20	5		EDBDHM
O=C(NCCN1CCc2sccc2C1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000187001160	534342986	/nfs/dbraw/zinc/34/29/86/534342986.db2.gz	SQNANUCIEJUUCT-UHFFFAOYSA-N	-1	3	348.384	1.545	20	5		EDBDHM
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)[N-]C1=NCCS1	ZINC000735847201	578928335	/nfs/dbraw/zinc/92/83/35/578928335.db2.gz	NKHFZJXNRVZEGV-MRVPVSSYSA-N	-1	3	326.382	1.046	20	5		EDBDHM
O=[N+]([O-])c1ccccc1C[N-]S(=O)(=O)c1cnn(CC2CC2)c1	ZINC000777887341	580452522	/nfs/dbraw/zinc/45/25/22/580452522.db2.gz	FUWXOTJWMDGYAT-UHFFFAOYSA-N	-1	3	336.373	1.680	20	5		EDBDHM
COC(=O)C[C@@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C1CC1	ZINC000768852640	580222542	/nfs/dbraw/zinc/22/25/42/580222542.db2.gz	INNKJFMUNXKINE-SECBINFHSA-N	-1	3	334.375	1.276	20	5		EDBDHM
O=C(CC[C@H]1NC(=O)[N-]C1=O)OCc1ccc([N+](=O)[O-])cc1Cl	ZINC000782304518	580571457	/nfs/dbraw/zinc/57/14/57/580571457.db2.gz	HOWUOWQQNXZDCJ-SNVBAGLBSA-N	-1	3	341.707	1.280	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]Cc2cccnc2F)cc1[N+](=O)[O-]	ZINC000795265790	580917087	/nfs/dbraw/zinc/91/70/87/580917087.db2.gz	QIAYBNOTXQNOSP-UHFFFAOYSA-N	-1	3	331.350	1.977	20	5		EDBDHM
CC[C@@H](C)COC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000796272493	580949718	/nfs/dbraw/zinc/94/97/18/580949718.db2.gz	CBQLOTSWFDBDDA-SNVBAGLBSA-N	-1	3	330.362	1.462	20	5		EDBDHM
COc1c([O-])ccc(CN2CCO[C@@H](COC(C)C)C2)c1[N+](=O)[O-]	ZINC000893666980	591039980	/nfs/dbraw/zinc/03/99/80/591039980.db2.gz	ZQVRBUHKAFNLET-CYBMUJFWSA-N	-1	3	340.376	1.935	20	5		EDBDHM
C[C@H](OC(=O)c1cnn[n-]1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000805609074	593113057	/nfs/dbraw/zinc/11/30/57/593113057.db2.gz	MMLZNDDKLDMTRX-LURJTMIESA-N	-1	3	339.695	1.550	20	5		EDBDHM
C[C@H](OC(=O)c1c[n-]nn1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000805609074	593113059	/nfs/dbraw/zinc/11/30/59/593113059.db2.gz	MMLZNDDKLDMTRX-LURJTMIESA-N	-1	3	339.695	1.550	20	5		EDBDHM
COC(=O)c1cc(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)c[n-]1	ZINC000814531075	593592183	/nfs/dbraw/zinc/59/21/83/593592183.db2.gz	OECLHUFYGNVTGR-UHFFFAOYSA-N	-1	3	332.268	1.749	20	5		EDBDHM
C[C@@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)c1cccc(-c2nnn[n-]2)c1	ZINC000820391141	593815707	/nfs/dbraw/zinc/81/57/07/593815707.db2.gz	NQUPLNPJGPXMBA-MRVPVSSYSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)c1cccc(-c2nn[n-]n2)c1	ZINC000820391141	593815708	/nfs/dbraw/zinc/81/57/08/593815708.db2.gz	NQUPLNPJGPXMBA-MRVPVSSYSA-N	-1	3	327.304	1.594	20	5		EDBDHM
CN(CC(=O)NC(C)(C)C)c1ccc(-c2nnn[n-]2)c([N+](=O)[O-])c1	ZINC000821592780	593873074	/nfs/dbraw/zinc/87/30/74/593873074.db2.gz	VBPUWDKRJKWUEH-UHFFFAOYSA-N	-1	3	333.352	1.126	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(CCOc2ccccc2-c2nnn[n-]2)c1=O	ZINC000822213036	594011608	/nfs/dbraw/zinc/01/16/08/594011608.db2.gz	RLLNGKBMIFAGIO-UHFFFAOYSA-N	-1	3	342.315	1.324	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(CCOc2ccccc2-c2nn[n-]n2)c1=O	ZINC000822213036	594011610	/nfs/dbraw/zinc/01/16/10/594011610.db2.gz	RLLNGKBMIFAGIO-UHFFFAOYSA-N	-1	3	342.315	1.324	20	5		EDBDHM
O=C(Cc1cccc(-c2nnn[n-]2)c1)Oc1cccc([N+](=O)[O-])c1	ZINC000823111195	594155109	/nfs/dbraw/zinc/15/51/09/594155109.db2.gz	FVLUHVMVFGNBSE-UHFFFAOYSA-N	-1	3	325.284	1.923	20	5		EDBDHM
O=C(Cc1cccc(-c2nn[n-]n2)c1)Oc1cccc([N+](=O)[O-])c1	ZINC000823111195	594155110	/nfs/dbraw/zinc/15/51/10/594155110.db2.gz	FVLUHVMVFGNBSE-UHFFFAOYSA-N	-1	3	325.284	1.923	20	5		EDBDHM
O=[N+]([O-])c1cc(N2CCN(CC(F)F)CC2)ccc1-c1nnn[n-]1	ZINC000823635486	594223583	/nfs/dbraw/zinc/22/35/83/594223583.db2.gz	XUKSHEVVSZPHOI-UHFFFAOYSA-N	-1	3	339.306	1.162	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H](CO)c2ccccc2)c(-c2nnn[n-]2)c1	ZINC000823651709	594224655	/nfs/dbraw/zinc/22/46/55/594224655.db2.gz	OCCJOZFQVVMRLB-NSHDSACASA-N	-1	3	341.331	1.358	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H](CO)c2ccccc2)c(-c2nn[n-]n2)c1	ZINC000823651709	594224656	/nfs/dbraw/zinc/22/46/56/594224656.db2.gz	OCCJOZFQVVMRLB-NSHDSACASA-N	-1	3	341.331	1.358	20	5		EDBDHM
C[C@@H]1C[C@@H](NC(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CN1C1CC1	ZINC000828177376	594359164	/nfs/dbraw/zinc/35/91/64/594359164.db2.gz	PGTSFOCQLYNZSZ-BXKDBHETSA-N	-1	3	333.344	1.648	20	5		EDBDHM
O=C(Cc1ccon1)Nc1cc(-c2nnn[n-]2)cc([N+](=O)[O-])c1Cl	ZINC000826423885	594470243	/nfs/dbraw/zinc/47/02/43/594470243.db2.gz	LLTIRYWHGMWYFM-UHFFFAOYSA-N	-1	3	349.694	1.598	20	5		EDBDHM
O=C(Cc1ccon1)Nc1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl	ZINC000826423885	594470244	/nfs/dbraw/zinc/47/02/44/594470244.db2.gz	LLTIRYWHGMWYFM-UHFFFAOYSA-N	-1	3	349.694	1.598	20	5		EDBDHM
O=[N+]([O-])c1cccc([C@@H](O)CSc2cc(-c3nnn[n-]3)ccn2)c1	ZINC000826499553	594503461	/nfs/dbraw/zinc/50/34/61/594503461.db2.gz	NCBHDCADMNJZQN-LBPRGKRZSA-N	-1	3	344.356	1.996	20	5		EDBDHM
O=[N+]([O-])c1cccc([C@@H](O)CSc2cc(-c3nn[n-]n3)ccn2)c1	ZINC000826499553	594503464	/nfs/dbraw/zinc/50/34/64/594503464.db2.gz	NCBHDCADMNJZQN-LBPRGKRZSA-N	-1	3	344.356	1.996	20	5		EDBDHM
CC1=C([O-])N(C)S(=O)(=O)N1Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000829562027	594640861	/nfs/dbraw/zinc/64/08/61/594640861.db2.gz	YBTQPNYHRMTEFY-SSDOTTSWSA-N	-1	3	333.753	1.156	20	5		EDBDHM
O=C([O-])N1CCC[C@@H]1[C@@H]1CCCCN1CCn1ccc([N+](=O)[O-])n1	ZINC000831995594	594717635	/nfs/dbraw/zinc/71/76/35/594717635.db2.gz	CRWQRPOMBKCSAT-QWHCGFSZSA-N	-1	3	337.380	1.788	20	5		EDBDHM
C[C@H]1CN(CCC(=O)[O-])CCN1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000833628451	594892110	/nfs/dbraw/zinc/89/21/10/594892110.db2.gz	IKPZKTYOVMEQKX-WFASDCNBSA-N	-1	3	337.376	1.109	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)N1CCCCC1	ZINC000845825003	595075003	/nfs/dbraw/zinc/07/50/03/595075003.db2.gz	DJUOYNWERFOYDB-LLVKDONJSA-N	-1	3	328.394	1.143	20	5		EDBDHM
CC(C)C[C@H](C)OC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000837698061	595171852	/nfs/dbraw/zinc/17/18/52/595171852.db2.gz	FLLNIHNUIRTQRL-NSHDSACASA-N	-1	3	344.389	1.851	20	5		EDBDHM
COC[C@@](C)(O)C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848582587	595409067	/nfs/dbraw/zinc/40/90/67/595409067.db2.gz	GSVNUIJEVBRQAE-LBPRGKRZSA-N	-1	3	334.275	1.080	20	5		EDBDHM
C[C@@H]1CCNC(=O)[C@H]1[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848589359	595410971	/nfs/dbraw/zinc/41/09/71/595410971.db2.gz	DOPPPZFSBNQSIY-KCJUWKMLSA-N	-1	3	343.286	1.207	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C(OC)OC	ZINC000849406383	595521682	/nfs/dbraw/zinc/52/16/82/595521682.db2.gz	JNFVXOKDJPHKTR-GFCCVEGCSA-N	-1	3	332.378	1.412	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C(OC)OC	ZINC000849406814	595521929	/nfs/dbraw/zinc/52/19/29/595521929.db2.gz	MPDLMEZIBBRUBL-JTQLQIEISA-N	-1	3	348.377	1.279	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2[C@@H]3OC[C@@H]4C[C@H]2C[C@@H]43)c([N+](=O)[O-])s1	ZINC000867611731	596460105	/nfs/dbraw/zinc/46/01/05/596460105.db2.gz	OUIOQUYURLNGJK-WPCZNGEBSA-N	-1	3	344.414	1.666	20	5		EDBDHM
O=C([N-]CC1CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1)C(F)(F)F	ZINC000871991984	596782969	/nfs/dbraw/zinc/78/29/69/596782969.db2.gz	QGVUKFORJROCES-GFCCVEGCSA-N	-1	3	347.293	1.239	20	5		EDBDHM
Cc1cc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])c(C)s1	ZINC000125506774	596920346	/nfs/dbraw/zinc/92/03/46/596920346.db2.gz	NOGOYQJJLLSDQF-UHFFFAOYSA-N	-1	3	328.375	1.974	20	5		EDBDHM
CC(C)(C(=O)N[C@@H]1[C@H]2CN(c3cc[n-]c(=O)c3[N+](=O)[O-])C[C@H]21)C1CC1	ZINC001060464568	695252940	/nfs/dbraw/zinc/25/29/40/695252940.db2.gz	FIEMMMZJELPUGN-PJXYFTJBSA-N	-1	3	346.387	1.682	20	5		EDBDHM
Cc1noc(CC[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])n1	ZINC000101575532	219140851	/nfs/dbraw/zinc/14/08/51/219140851.db2.gz	QOHPLZQVPYVAOH-UHFFFAOYSA-N	-1	3	326.334	1.116	20	5		EDBDHM
Cc1cc([N-]C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)no1	ZINC000067786125	215212287	/nfs/dbraw/zinc/21/22/87/215212287.db2.gz	SKGIKXLJTACTDH-UHFFFAOYSA-N	-1	3	325.302	1.547	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CC[C@@H](C)[S@@](C)=O)cc1[N+](=O)[O-]	ZINC000125659368	138335337	/nfs/dbraw/zinc/33/53/37/138335337.db2.gz	PKVZNJKEUHESIX-XJZHNMMOSA-N	-1	3	340.448	1.400	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C)C1CCOCC1	ZINC000132946263	223375066	/nfs/dbraw/zinc/37/50/66/223375066.db2.gz	GTBZUIIFOXPGBZ-NSHDSACASA-N	-1	3	328.390	1.997	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2C[C@H](C)O[C@H]2C)c([N+](=O)[O-])c1	ZINC000416613045	251082647	/nfs/dbraw/zinc/08/26/47/251082647.db2.gz	ZQIXGFLEJONNIO-DCAQKATOSA-N	-1	3	344.389	1.695	20	5		EDBDHM
O=[N+]([O-])c1cnn(CC[N-]S(=O)(=O)c2ccc(F)c(F)c2)c1	ZINC000152844085	224020261	/nfs/dbraw/zinc/02/02/61/224020261.db2.gz	NKCBSUSKUQQLGX-UHFFFAOYSA-N	-1	3	332.288	1.048	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC(=O)NC(C)(C)C)c1C	ZINC000119418297	221315404	/nfs/dbraw/zinc/31/54/04/221315404.db2.gz	FTUIXKGHHCUKTN-UHFFFAOYSA-N	-1	3	343.405	1.405	20	5		EDBDHM
CCc1nc([C@@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1	ZINC000270582105	140128396	/nfs/dbraw/zinc/12/83/96/140128396.db2.gz	QHZBCFYDPWPGON-SSDOTTSWSA-N	-1	3	343.340	1.454	20	5		EDBDHM
CCc1nnc([C@@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)[nH]1	ZINC000270582105	140128398	/nfs/dbraw/zinc/12/83/98/140128398.db2.gz	QHZBCFYDPWPGON-SSDOTTSWSA-N	-1	3	343.340	1.454	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CN(C3CC3)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000331416884	141022159	/nfs/dbraw/zinc/02/21/59/141022159.db2.gz	AGCMNJRLXIBXTL-DGCLKSJQSA-N	-1	3	339.417	1.664	20	5		EDBDHM
COCC[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000416370816	304312231	/nfs/dbraw/zinc/31/22/31/304312231.db2.gz	HUYVPJMJEGJEDB-UHFFFAOYSA-N	-1	3	328.268	1.538	20	5		EDBDHM
CCOC(=O)c1nc(CC)oc1[N-]C(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000357692571	151117248	/nfs/dbraw/zinc/11/72/48/151117248.db2.gz	CWKSFRWNDHTVSA-UHFFFAOYSA-N	-1	3	337.292	1.157	20	5		EDBDHM
CC1=CCN(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000358190188	151299260	/nfs/dbraw/zinc/29/92/60/151299260.db2.gz	DGUILWMRUHALPV-UHFFFAOYSA-N	-1	3	343.380	1.664	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCCN(C)[C@@H]2C)c1C	ZINC000343982728	292292155	/nfs/dbraw/zinc/29/21/55/292292155.db2.gz	OVFVWPFTNWQJEM-CHWSQXEVSA-N	-1	3	341.433	1.973	20	5		EDBDHM
CC[C@@]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)(C(N)=O)C(C)C	ZINC000181539396	287406721	/nfs/dbraw/zinc/40/67/21/287406721.db2.gz	YSVGUWYILZMPRD-ZDUSSCGKSA-N	-1	3	347.368	1.302	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H]2C=C[C@H](CO)C2)cc1[N+](=O)[O-]	ZINC000124585170	222449565	/nfs/dbraw/zinc/44/95/65/222449565.db2.gz	GLRIEHBGVKWOPF-VHSXEESVSA-N	-1	3	346.792	1.772	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@@H]2CCOC2)cc1[N+](=O)[O-]	ZINC000275271152	268311823	/nfs/dbraw/zinc/31/18/23/268311823.db2.gz	QJJMCEXYVJPFRK-QMMMGPOBSA-N	-1	3	334.325	1.057	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)c2ncn(C)n2)c1C	ZINC000275687469	273119901	/nfs/dbraw/zinc/11/99/01/273119901.db2.gz	QFJKWSXHVYDQGH-SNVBAGLBSA-N	-1	3	339.377	1.380	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1snnc1C	ZINC000292063448	289252763	/nfs/dbraw/zinc/25/27/63/289252763.db2.gz	OYIQKLFPJDVTDG-UHFFFAOYSA-N	-1	3	344.374	1.242	20	5		EDBDHM
CCOC(=O)C(C)(C)O[N-]C(=O)c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000295719406	303257496	/nfs/dbraw/zinc/25/74/96/303257496.db2.gz	QERKNFDYYXCIRB-UHFFFAOYSA-N	-1	3	344.295	1.746	20	5		EDBDHM
CCn1nc(C)c(C(=O)[N-]c2cc(C(=O)OC)cc([N+](=O)[O-])c2C)n1	ZINC000297561755	303413212	/nfs/dbraw/zinc/41/32/12/303413212.db2.gz	AJQDPIPPTCYBMC-UHFFFAOYSA-N	-1	3	347.331	1.862	20	5		EDBDHM
CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCC[C@@]2(C1)NC(=O)[N-]C2=O	ZINC000435042130	305135181	/nfs/dbraw/zinc/13/51/81/305135181.db2.gz	LTUZPTVXLCLXFZ-UEICXMAYSA-N	-1	3	344.371	1.672	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])n[nH]1	ZINC000451596153	305355680	/nfs/dbraw/zinc/35/56/80/305355680.db2.gz	LCMBPTBOAWZHGR-UHFFFAOYSA-N	-1	3	339.377	1.371	20	5		EDBDHM
CCc1nnc(C[N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])[nH]1	ZINC000451596153	305355681	/nfs/dbraw/zinc/35/56/81/305355681.db2.gz	LCMBPTBOAWZHGR-UHFFFAOYSA-N	-1	3	339.377	1.371	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C1(CF)CCOCC1	ZINC000451738326	305366114	/nfs/dbraw/zinc/36/61/14/305366114.db2.gz	QHFMEVXVOQYHFS-UHFFFAOYSA-N	-1	3	332.353	1.700	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2COCC2(C)C)c1C	ZINC000451961180	305374328	/nfs/dbraw/zinc/37/43/28/305374328.db2.gz	CUFGVADMWKUVKK-LBPRGKRZSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H](C)Cc2cnn(C)c2)cc1[N+](=O)[O-]	ZINC000451970733	305375091	/nfs/dbraw/zinc/37/50/91/305375091.db2.gz	TWCMCKMHWMEWQB-QMMMGPOBSA-N	-1	3	344.418	1.608	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000536510981	306020966	/nfs/dbraw/zinc/02/09/66/306020966.db2.gz	CBCZGQHPYLKAIV-VIFPVBQESA-N	-1	3	329.316	1.318	20	5		EDBDHM
COC(=O)c1cccc2nc(NC(=O)c3cc([N+](=O)[O-])cn3C)[n-]c21	ZINC000536622135	306024253	/nfs/dbraw/zinc/02/42/53/306024253.db2.gz	VLGLQAMNQAGQCS-UHFFFAOYSA-N	-1	3	343.299	1.849	20	5		EDBDHM
COC(=O)c1cccc2[n-]c(NC(=O)c3cc([N+](=O)[O-])cn3C)nc21	ZINC000536622135	306024254	/nfs/dbraw/zinc/02/42/54/306024254.db2.gz	VLGLQAMNQAGQCS-UHFFFAOYSA-N	-1	3	343.299	1.849	20	5		EDBDHM
Cc1nnc(C[N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)s1	ZINC000541869848	306048532	/nfs/dbraw/zinc/04/85/32/306048532.db2.gz	CPDRICPIMHKZGP-UHFFFAOYSA-N	-1	3	328.375	1.374	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCN(CC3CC3)C2)c(F)c1	ZINC000108403753	441451640	/nfs/dbraw/zinc/45/16/40/441451640.db2.gz	DSPNAKWUIACDMS-NSHDSACASA-N	-1	3	343.380	1.497	20	5		EDBDHM
O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(-c2nnn[n-]2)cc1	ZINC000065535630	441454041	/nfs/dbraw/zinc/45/40/41/441454041.db2.gz	ASWZCSVEZLXLCT-UHFFFAOYSA-N	-1	3	340.299	1.792	20	5		EDBDHM
O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(-c2nn[n-]n2)cc1	ZINC000065535630	441454046	/nfs/dbraw/zinc/45/40/46/441454046.db2.gz	ASWZCSVEZLXLCT-UHFFFAOYSA-N	-1	3	340.299	1.792	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCCOC(C)C	ZINC000032402751	441555856	/nfs/dbraw/zinc/55/58/56/441555856.db2.gz	QGUROKSHXFCTHX-UHFFFAOYSA-N	-1	3	332.378	1.697	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1nc(C)cs1	ZINC000043273134	441828532	/nfs/dbraw/zinc/82/85/32/441828532.db2.gz	GXQWGUUCLMRWHE-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
O=[N+]([O-])c1cccnc1NCC[N-]S(=O)(=O)c1cccs1	ZINC000119996820	441991123	/nfs/dbraw/zinc/99/11/23/441991123.db2.gz	IDNUMHGKXCAKRV-UHFFFAOYSA-N	-1	3	328.375	1.442	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C(N)=O)C(C)(C)C)c1C	ZINC000120411162	442066484	/nfs/dbraw/zinc/06/64/84/442066484.db2.gz	XVSZSGONMPZDHT-LBPRGKRZSA-N	-1	3	343.405	1.390	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H]2C[C@H](O)C2(C)C)cc1[N+](=O)[O-]	ZINC000188115707	442713264	/nfs/dbraw/zinc/71/32/64/442713264.db2.gz	BJXRHYRDWXTGJL-NEPJUHHUSA-N	-1	3	348.808	1.994	20	5		EDBDHM
CN(C)C(=O)CCC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000193926374	442813529	/nfs/dbraw/zinc/81/35/29/442813529.db2.gz	PBHLULUZJYACMG-UHFFFAOYSA-N	-1	3	349.796	1.395	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCC[C@H]1CCO	ZINC000188915959	442842276	/nfs/dbraw/zinc/84/22/76/442842276.db2.gz	SZCIXYDHKVLZGL-NWDGAFQWSA-N	-1	3	328.390	1.733	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C2CCN(CC3CC3)CC2)s1	ZINC000194405121	442891507	/nfs/dbraw/zinc/89/15/07/442891507.db2.gz	CSQPLVLXCBNDNG-UHFFFAOYSA-N	-1	3	345.446	1.809	20	5		EDBDHM
O=C(Nc1cnn(Cc2ccccn2)c1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000189893076	443024532	/nfs/dbraw/zinc/02/45/32/443024532.db2.gz	MTWXNVVJMGZDSE-UHFFFAOYSA-N	-1	3	340.299	1.588	20	5		EDBDHM
CC[C@H](CCO)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000268558980	443034301	/nfs/dbraw/zinc/03/43/01/443034301.db2.gz	DCXKKJNOPMZMAU-SNVBAGLBSA-N	-1	3	332.378	1.290	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)[C@H]1CCOC1	ZINC000266157246	443038028	/nfs/dbraw/zinc/03/80/28/443038028.db2.gz	GUECUZPQQOERHC-UWVGGRQHSA-N	-1	3	330.362	1.307	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](CO)CC(C)C)c1[N+](=O)[O-]	ZINC000189986799	443043248	/nfs/dbraw/zinc/04/32/48/443043248.db2.gz	KDMVPBUAFDOJSJ-GFCCVEGCSA-N	-1	3	330.406	1.897	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)c2nncn2C)c1C	ZINC000268777285	443105389	/nfs/dbraw/zinc/10/53/89/443105389.db2.gz	BNTIWBCHBYNMCA-SNVBAGLBSA-N	-1	3	339.377	1.380	20	5		EDBDHM
O=C1[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CN1c1ccccc1	ZINC000359909359	319114398	/nfs/dbraw/zinc/11/43/98/319114398.db2.gz	YWVRIJNFMAQYSL-LBPRGKRZSA-N	-1	3	347.352	1.289	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCC(C)(C)CO)cc1C	ZINC000385663171	319128318	/nfs/dbraw/zinc/12/83/18/319128318.db2.gz	GOOZJRAUFBIUCR-UHFFFAOYSA-N	-1	3	330.406	1.899	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1C[C@H](C)O[C@@H]1C	ZINC000416597286	319449374	/nfs/dbraw/zinc/44/93/74/319449374.db2.gz	GDPAYMFQTXZUMN-AXFHLTTASA-N	-1	3	344.389	1.695	20	5		EDBDHM
C[C@@H]1CN(CCCNC(=O)c2ccc([N+](=O)[O-])cc2[O-])CCCO1	ZINC000436949721	320027877	/nfs/dbraw/zinc/02/78/77/320027877.db2.gz	ARKUWRGBJFYINB-GFCCVEGCSA-N	-1	3	337.376	1.531	20	5		EDBDHM
C[C@H](CN1CCCCC1)[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000530386513	320622899	/nfs/dbraw/zinc/62/28/99/320622899.db2.gz	XKMWOIAHYRAIAA-LLVKDONJSA-N	-1	3	328.394	1.143	20	5		EDBDHM
CCC[C@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(N)=O	ZINC000285290383	443928596	/nfs/dbraw/zinc/92/85/96/443928596.db2.gz	GJGWYDPUDNHMHZ-JTQLQIEISA-N	-1	3	329.378	1.144	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C(C)(C)c1cnn(C)c1	ZINC000547410400	320827040	/nfs/dbraw/zinc/82/70/40/320827040.db2.gz	OVGYJZORLLXUKK-UHFFFAOYSA-N	-1	3	338.389	1.850	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CCOC[C@@H]1C	ZINC000285667791	444066293	/nfs/dbraw/zinc/06/62/93/444066293.db2.gz	QDTCNWAUXAETHQ-QWRGUYRKSA-N	-1	3	344.389	1.554	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2CCO)c([N+](=O)[O-])c1	ZINC000331167000	444427485	/nfs/dbraw/zinc/42/74/85/444427485.db2.gz	MRJBPTQXUSYIRX-VXGBXAGGSA-N	-1	3	328.390	1.733	20	5		EDBDHM
COc1cc(CNC[C@H](CO)c2cccnc2)c([N+](=O)[O-])cc1[O-]	ZINC000342295643	444616846	/nfs/dbraw/zinc/61/68/46/444616846.db2.gz	IPFCRYXLYWGPIF-CYBMUJFWSA-N	-1	3	333.344	1.570	20	5		EDBDHM
CCn1cnc(S(=O)(=O)[N-]Cc2cc([N+](=O)[O-])ccc2OC)c1	ZINC000343937794	444681105	/nfs/dbraw/zinc/68/11/05/444681105.db2.gz	TXXWOGGBHXACAI-UHFFFAOYSA-N	-1	3	340.361	1.298	20	5		EDBDHM
COc1ccc([N+](=O)[O-])c(C(=O)[N-]c2ncnn2-c2ccccc2)c1	ZINC000342473572	444706715	/nfs/dbraw/zinc/70/67/15/444706715.db2.gz	CGSYJKAIYLWMLU-UHFFFAOYSA-N	-1	3	339.311	1.858	20	5		EDBDHM
CC1(C)CCC[C@]1(O)C[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000339019532	444990228	/nfs/dbraw/zinc/99/02/28/444990228.db2.gz	CVTQWSQWBWUQHY-HNNXBMFYSA-N	-1	3	342.417	1.955	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2CCC[C@@H]2F)cc1[N+](=O)[O-]	ZINC000339121953	445041884	/nfs/dbraw/zinc/04/18/84/445041884.db2.gz	FYQIGURKOWYHKT-WPRPVWTQSA-N	-1	3	336.316	1.911	20	5		EDBDHM
CCN1CC[C@@H]([N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C1	ZINC000360219710	445636043	/nfs/dbraw/zinc/63/60/43/445636043.db2.gz	LVGBRHSRKMDADA-GFCCVEGCSA-N	-1	3	327.406	1.584	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCCN(C)C2=O)cc1C	ZINC000360467667	445709395	/nfs/dbraw/zinc/70/93/95/445709395.db2.gz	GDDPXRDTRXBPNK-NSHDSACASA-N	-1	3	341.389	1.111	20	5		EDBDHM
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1	ZINC000374824171	446407662	/nfs/dbraw/zinc/40/76/62/446407662.db2.gz	AEQAGKZOYFWRSB-UHFFFAOYSA-N	-1	3	343.278	1.749	20	5		EDBDHM
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1	ZINC000374824171	446407665	/nfs/dbraw/zinc/40/76/65/446407665.db2.gz	AEQAGKZOYFWRSB-UHFFFAOYSA-N	-1	3	343.278	1.749	20	5		EDBDHM
Cc1noc([C@H]2CCCN(C(=O)c3cc(C)[n-]c(=O)c3[N+](=O)[O-])C2)n1	ZINC000375101385	446582112	/nfs/dbraw/zinc/58/21/12/446582112.db2.gz	OKFULYLRGPNWAA-JTQLQIEISA-N	-1	3	347.331	1.715	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CNCCC2(F)F)c1C	ZINC000420451661	446627341	/nfs/dbraw/zinc/62/73/41/446627341.db2.gz	VUFNMXGTTRDNLE-LLVKDONJSA-N	-1	3	349.359	1.487	20	5		EDBDHM
Cn1c2cc([O-])c(NC(=O)c3ccc([N+](=O)[O-])o3)cc2n(C)c1=O	ZINC000427861609	447663276	/nfs/dbraw/zinc/66/32/76/447663276.db2.gz	DCUIJFGAFASRSQ-UHFFFAOYSA-N	-1	3	332.272	1.336	20	5		EDBDHM
Cn1c(=O)n(C)c2cc([N-]C(=O)c3ccc([N+](=O)[O-])o3)c(O)cc21	ZINC000427861609	447663283	/nfs/dbraw/zinc/66/32/83/447663283.db2.gz	DCUIJFGAFASRSQ-UHFFFAOYSA-N	-1	3	332.272	1.336	20	5		EDBDHM
Cc1nnc([C@@H](C)[N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)o1	ZINC000591326618	448322820	/nfs/dbraw/zinc/32/28/20/448322820.db2.gz	APXSAKRUIZNEQB-SECBINFHSA-N	-1	3	340.361	1.943	20	5		EDBDHM
CC[C@@H](C)C[C@H](CO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000592081471	448668004	/nfs/dbraw/zinc/66/80/04/448668004.db2.gz	BQYDUCHCXCLOPM-GHMZBOCLSA-N	-1	3	346.405	1.679	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCCC23CCOCC3)nc1	ZINC000593591979	449094690	/nfs/dbraw/zinc/09/46/90/449094690.db2.gz	QOKKSDTWXNUOSD-LBPRGKRZSA-N	-1	3	341.389	1.617	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@@H](CO)CC1CC1	ZINC000611109808	449171739	/nfs/dbraw/zinc/17/17/39/449171739.db2.gz	HPELUIKTNNXKJR-SNVBAGLBSA-N	-1	3	334.781	1.688	20	5		EDBDHM
COCCNc1nnc(Sc2cc[n-]c(=O)c2[N+](=O)[O-])s1	ZINC000596057795	449340619	/nfs/dbraw/zinc/34/06/19/449340619.db2.gz	VYJZYTIFHJRRAY-UHFFFAOYSA-N	-1	3	329.363	1.756	20	5		EDBDHM
CC1(C)[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)[C@@H]2CCCO[C@H]21	ZINC000593552555	449343198	/nfs/dbraw/zinc/34/31/98/449343198.db2.gz	LYPJSLYYOIIPGY-CYZMBNFOSA-N	-1	3	341.389	1.472	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)[N-]c2cncc(C(=O)OC(C)(C)C)c2)n1	ZINC000594080920	449348115	/nfs/dbraw/zinc/34/81/15/449348115.db2.gz	TZUWYLNJQDDJTC-UHFFFAOYSA-N	-1	3	347.331	1.931	20	5		EDBDHM
Cc1nc(N2CCOCC2)ccc1Nc1cc[n-]c(=O)c1[N+](=O)[O-]	ZINC000596168227	449393583	/nfs/dbraw/zinc/39/35/83/449393583.db2.gz	RCRMYOHGXKELRJ-UHFFFAOYSA-N	-1	3	331.332	1.979	20	5		EDBDHM
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)c2cccc([N+](=O)[O-])c2[O-])C1	ZINC000600629795	449465970	/nfs/dbraw/zinc/46/59/70/449465970.db2.gz	VRPMSRHXTHBERG-FPMFFAJLSA-N	-1	3	349.387	1.672	20	5		EDBDHM
O=C(c1cc(F)c[n-]c1=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000598703188	449554346	/nfs/dbraw/zinc/55/43/46/449554346.db2.gz	QPUORSOOVJDUNS-UHFFFAOYSA-N	-1	3	335.295	1.508	20	5		EDBDHM
O=C([O-])c1ccc([N+](=O)[O-])c(CN2CC[C@H](Cn3ccnn3)C2)c1	ZINC000594734386	449655816	/nfs/dbraw/zinc/65/58/16/449655816.db2.gz	ZGUKUJNGJGISLF-NSHDSACASA-N	-1	3	331.332	1.407	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1CCC[C@H](C)O1	ZINC000594850664	449758396	/nfs/dbraw/zinc/75/83/96/449758396.db2.gz	FAAXZRIGUBFRFL-JQWIXIFHSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2CCCN(C)C2)c(F)cc1[N+](=O)[O-]	ZINC000601312875	449821831	/nfs/dbraw/zinc/82/18/31/449821831.db2.gz	NFVAOYHWJKXYPI-SNVBAGLBSA-N	-1	3	331.369	1.415	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H](C)[C@H]2CCOC2)c(F)cc1[N+](=O)[O-]	ZINC000601356919	449869410	/nfs/dbraw/zinc/86/94/10/449869410.db2.gz	IDUNAGXOTULNCW-ZJUUUORDSA-N	-1	3	332.353	1.746	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1oc(C)nc1C	ZINC000599316485	449886296	/nfs/dbraw/zinc/88/62/96/449886296.db2.gz	IMAXWOOBBJAICM-UHFFFAOYSA-N	-1	3	341.345	1.687	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCOCC(F)F)c([N+](=O)[O-])s1	ZINC000601401212	449917501	/nfs/dbraw/zinc/91/75/01/449917501.db2.gz	IXXXPGYFWCYRQO-UHFFFAOYSA-N	-1	3	330.334	1.525	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](C)[C@H]1CCCCO1	ZINC000619495420	450490870	/nfs/dbraw/zinc/49/08/70/450490870.db2.gz	RQFJCKJZAODQGQ-CMPLNLGQSA-N	-1	3	344.389	1.839	20	5		EDBDHM
O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cc2nnn[n-]2)cc1	ZINC000136994509	491020215	/nfs/dbraw/zinc/02/02/15/491020215.db2.gz	BUVLBNAZAZIESL-UHFFFAOYSA-N	-1	3	338.327	1.880	20	5		EDBDHM
O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cc2nn[n-]n2)cc1	ZINC000136994509	491020216	/nfs/dbraw/zinc/02/02/16/491020216.db2.gz	BUVLBNAZAZIESL-UHFFFAOYSA-N	-1	3	338.327	1.880	20	5		EDBDHM
O=C([N-]C1=NCCS1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000731876442	578682071	/nfs/dbraw/zinc/68/20/71/578682071.db2.gz	XXCFRFQMFJLCFA-QMMMGPOBSA-N	-1	3	338.345	1.011	20	5		EDBDHM
C[C@@H]1CN(c2cc(-c3nnn[n-]3)c3cc([N+](=O)[O-])ccc3n2)CCO1	ZINC000736290157	578974069	/nfs/dbraw/zinc/97/40/69/578974069.db2.gz	PBHXJALIIZOOHM-SECBINFHSA-N	-1	3	341.331	1.548	20	5		EDBDHM
C[C@@H]1CN(c2cc(-c3nn[n-]n3)c3cc([N+](=O)[O-])ccc3n2)CCO1	ZINC000736290157	578974070	/nfs/dbraw/zinc/97/40/70/578974070.db2.gz	PBHXJALIIZOOHM-SECBINFHSA-N	-1	3	341.331	1.548	20	5		EDBDHM
C[C@H]1C[C@H](N(C)C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CCN1C	ZINC000736758212	579018036	/nfs/dbraw/zinc/01/80/36/579018036.db2.gz	BZBWJYCFGOLORS-GXFFZTMASA-N	-1	3	335.360	1.848	20	5		EDBDHM
O=C(OCc1cc(=O)c([O-])co1)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000736764329	579018583	/nfs/dbraw/zinc/01/85/83/579018583.db2.gz	ZACWTETUZRECCJ-UHFFFAOYSA-N	-1	3	349.251	1.382	20	5		EDBDHM
COC(=O)N1CCC[C@@H](Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000736934447	579032264	/nfs/dbraw/zinc/03/22/64/579032264.db2.gz	BIMXYFPIBLLFCY-SNVBAGLBSA-N	-1	3	347.335	1.418	20	5		EDBDHM
COC(=O)N1CCC[C@@H](Nc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1	ZINC000736934447	579032265	/nfs/dbraw/zinc/03/22/65/579032265.db2.gz	BIMXYFPIBLLFCY-SNVBAGLBSA-N	-1	3	347.335	1.418	20	5		EDBDHM
NC(=O)[C@H]1CCC[C@@H](Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000737742931	579127425	/nfs/dbraw/zinc/12/74/25/579127425.db2.gz	HSGOKVYQBSMYHZ-WCBMZHEXSA-N	-1	3	331.336	1.231	20	5		EDBDHM
NC(=O)[C@H]1CCC[C@@H](Nc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1	ZINC000737742931	579127427	/nfs/dbraw/zinc/12/74/27/579127427.db2.gz	HSGOKVYQBSMYHZ-WCBMZHEXSA-N	-1	3	331.336	1.231	20	5		EDBDHM
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2nnn[n-]2)cn1	ZINC000737920415	579140220	/nfs/dbraw/zinc/14/02/20/579140220.db2.gz	SASSMTAGNCYJJH-UHFFFAOYSA-N	-1	3	341.287	1.187	20	5		EDBDHM
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2nn[n-]n2)cn1	ZINC000737920415	579140221	/nfs/dbraw/zinc/14/02/21/579140221.db2.gz	SASSMTAGNCYJJH-UHFFFAOYSA-N	-1	3	341.287	1.187	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2cccc(F)n2)c(F)c1	ZINC000747904072	579662471	/nfs/dbraw/zinc/66/24/71/579662471.db2.gz	AUIKYRGTQBQBQK-UHFFFAOYSA-N	-1	3	329.284	1.747	20	5		EDBDHM
Cc1[n-]ncc1S(=O)(=O)Oc1cc(N(C)C)ccc1[N+](=O)[O-]	ZINC000748653810	579696484	/nfs/dbraw/zinc/69/64/84/579696484.db2.gz	SBDLHGLKGNYYRA-UHFFFAOYSA-N	-1	3	326.334	1.460	20	5		EDBDHM
Nc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c([O-])c1	ZINC000751350878	579802529	/nfs/dbraw/zinc/80/25/29/579802529.db2.gz	IQXRDFUBBCOCQA-UHFFFAOYSA-N	-1	3	342.355	1.845	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C[C@@](C)(O)C2CC2)cc1[N+](=O)[O-]	ZINC000751393425	579804298	/nfs/dbraw/zinc/80/42/98/579804298.db2.gz	PPAVNESDXITPAC-CYBMUJFWSA-N	-1	3	348.808	1.996	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](CCO)C2CC2)c1C	ZINC000751438738	579806719	/nfs/dbraw/zinc/80/67/19/579806719.db2.gz	CKKYLARZKYWEFE-GFCCVEGCSA-N	-1	3	328.390	1.651	20	5		EDBDHM
COc1cc(N)c([N+](=O)[O-])cc1C(=O)OCc1cc(=O)c([O-])co1	ZINC000753456160	579880519	/nfs/dbraw/zinc/88/05/19/579880519.db2.gz	WPWKPQVLSSXISD-UHFFFAOYSA-N	-1	3	336.256	1.201	20	5		EDBDHM
Cc1nccn1CCC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768816303	580221128	/nfs/dbraw/zinc/22/11/28/580221128.db2.gz	JWXAKQCEOYMCBW-UHFFFAOYSA-N	-1	3	330.391	1.530	20	5		EDBDHM
C[C@H](Cc1ccncc1)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768851986	580222412	/nfs/dbraw/zinc/22/24/12/580222412.db2.gz	HCEZNHSPAZPMTD-SECBINFHSA-N	-1	3	327.387	1.961	20	5		EDBDHM
O=Cc1ccc(OCC(=O)NCc2ccc([O-])c(F)c2)c([N+](=O)[O-])c1	ZINC000769559887	580240105	/nfs/dbraw/zinc/24/01/05/580240105.db2.gz	FUCKIKNPIUUSOJ-UHFFFAOYSA-N	-1	3	348.286	1.947	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]Cc2cn(C)nn2)c1	ZINC000782984201	580590396	/nfs/dbraw/zinc/59/03/96/580590396.db2.gz	PKCNFCUWHMOXTO-UHFFFAOYSA-N	-1	3	345.768	1.164	20	5		EDBDHM
COc1c([O-])ccc(CN2CCOC[C@@H]2[C@@H]2CCCO2)c1[N+](=O)[O-]	ZINC000894409321	591303618	/nfs/dbraw/zinc/30/36/18/591303618.db2.gz	NYVQSPQQSAXWQF-OCCSQVGLSA-N	-1	3	338.360	1.689	20	5		EDBDHM
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000736823851	593041286	/nfs/dbraw/zinc/04/12/86/593041286.db2.gz	IFNBSYDQNPGSOB-ZWNOBZJWSA-N	-1	3	333.344	1.602	20	5		EDBDHM
CC(C)OC(=O)[C@@H](C)N(C)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000820141963	593794726	/nfs/dbraw/zinc/79/47/26/593794726.db2.gz	DCOZCPUKAPNYOQ-SECBINFHSA-N	-1	3	334.336	1.551	20	5		EDBDHM
CC(C)OC(=O)[C@@H](C)N(C)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000820141963	593794727	/nfs/dbraw/zinc/79/47/27/593794727.db2.gz	DCOZCPUKAPNYOQ-SECBINFHSA-N	-1	3	334.336	1.551	20	5		EDBDHM
C[C@@H](CO[C@H]1CCOC1)Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000820286981	593806563	/nfs/dbraw/zinc/80/65/63/593806563.db2.gz	HUOIEAUDVCRWFJ-ONGXEEELSA-N	-1	3	334.336	1.381	20	5		EDBDHM
C[C@@H](CO[C@H]1CCOC1)Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000820286981	593806564	/nfs/dbraw/zinc/80/65/64/593806564.db2.gz	HUOIEAUDVCRWFJ-ONGXEEELSA-N	-1	3	334.336	1.381	20	5		EDBDHM
O=c1ccn(CCCOc2ccc(-c3nnn[n-]3)cc2)cc1[N+](=O)[O-]	ZINC000823665453	593829197	/nfs/dbraw/zinc/82/91/97/593829197.db2.gz	KQROICLWKAUTOJ-UHFFFAOYSA-N	-1	3	342.315	1.406	20	5		EDBDHM
O=c1ccn(CCCOc2ccc(-c3nn[n-]n3)cc2)cc1[N+](=O)[O-]	ZINC000823665453	593829198	/nfs/dbraw/zinc/82/91/98/593829198.db2.gz	KQROICLWKAUTOJ-UHFFFAOYSA-N	-1	3	342.315	1.406	20	5		EDBDHM
CN(Cc1cccc(-c2nnn[n-]2)c1)C(=O)c1ccc([N+](=O)[O-])cn1	ZINC000821613371	593881359	/nfs/dbraw/zinc/88/13/59/593881359.db2.gz	KJPNAEZFPIIMQB-UHFFFAOYSA-N	-1	3	339.315	1.442	20	5		EDBDHM
CN(Cc1cccc(-c2nn[n-]n2)c1)C(=O)c1ccc([N+](=O)[O-])cn1	ZINC000821613371	593881361	/nfs/dbraw/zinc/88/13/61/593881361.db2.gz	KJPNAEZFPIIMQB-UHFFFAOYSA-N	-1	3	339.315	1.442	20	5		EDBDHM
COC[C@@H](C)Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000821682521	593910308	/nfs/dbraw/zinc/91/03/08/593910308.db2.gz	HRKIANUKILQUQV-MRVPVSSYSA-N	-1	3	329.320	1.770	20	5		EDBDHM
COC[C@@H](C)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000821682521	593910311	/nfs/dbraw/zinc/91/03/11/593910311.db2.gz	HRKIANUKILQUQV-MRVPVSSYSA-N	-1	3	329.320	1.770	20	5		EDBDHM
Cc1cc(C)c(-c2nnn[n-]2)c(NCCn2cc([N+](=O)[O-])cn2)n1	ZINC000822193194	594006568	/nfs/dbraw/zinc/00/65/68/594006568.db2.gz	OFOSTMPBHQOCQC-UHFFFAOYSA-N	-1	3	329.324	1.095	20	5		EDBDHM
Cc1cc(C)c(-c2nn[n-]n2)c(NCCn2cc([N+](=O)[O-])cn2)n1	ZINC000822193194	594006570	/nfs/dbraw/zinc/00/65/70/594006570.db2.gz	OFOSTMPBHQOCQC-UHFFFAOYSA-N	-1	3	329.324	1.095	20	5		EDBDHM
C[C@@H](OC(=O)c1nn(C)cc1[N+](=O)[O-])c1ccc(-c2nnn[n-]2)cc1	ZINC000824731570	594064504	/nfs/dbraw/zinc/06/45/04/594064504.db2.gz	WSULMMMBCUNXOT-MRVPVSSYSA-N	-1	3	343.303	1.426	20	5		EDBDHM
C[C@@H](OC(=O)c1nn(C)cc1[N+](=O)[O-])c1ccc(-c2nn[n-]n2)cc1	ZINC000824731570	594064505	/nfs/dbraw/zinc/06/45/05/594064505.db2.gz	WSULMMMBCUNXOT-MRVPVSSYSA-N	-1	3	343.303	1.426	20	5		EDBDHM
CNC(=O)[C@@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000826060191	594321300	/nfs/dbraw/zinc/32/13/00/594321300.db2.gz	IKROKTKBDJUFDC-MWLCHTKSSA-N	-1	3	331.336	1.102	20	5		EDBDHM
CNC(=O)[C@@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000826060191	594321302	/nfs/dbraw/zinc/32/13/02/594321302.db2.gz	IKROKTKBDJUFDC-MWLCHTKSSA-N	-1	3	331.336	1.102	20	5		EDBDHM
COCCCC(=O)Nc1cc(-c2nnn[n-]2)cc([N+](=O)[O-])c1Cl	ZINC000826155682	594352064	/nfs/dbraw/zinc/35/20/64/594352064.db2.gz	YHPSHRVVKNBXDF-UHFFFAOYSA-N	-1	3	340.727	1.793	20	5		EDBDHM
COCCCC(=O)Nc1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl	ZINC000826155682	594352066	/nfs/dbraw/zinc/35/20/66/594352066.db2.gz	YHPSHRVVKNBXDF-UHFFFAOYSA-N	-1	3	340.727	1.793	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NC[C@@H]1CCCn2ccnc21	ZINC000826497542	594502257	/nfs/dbraw/zinc/50/22/57/594502257.db2.gz	KQGXKPGHLAJFDB-NSHDSACASA-N	-1	3	340.347	1.961	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NC[C@@H]1CCCn2ccnc21	ZINC000826497542	594502259	/nfs/dbraw/zinc/50/22/59/594502259.db2.gz	KQGXKPGHLAJFDB-NSHDSACASA-N	-1	3	340.347	1.961	20	5		EDBDHM
O=[N+]([O-])c1cnc(Nc2ccc3c(c2)COC3)c(-c2nnn[n-]2)c1	ZINC000826500646	594503445	/nfs/dbraw/zinc/50/34/45/594503445.db2.gz	GLLGTDHRXNUIIJ-UHFFFAOYSA-N	-1	3	325.288	1.944	20	5		EDBDHM
O=[N+]([O-])c1cnc(Nc2ccc3c(c2)COC3)c(-c2nn[n-]n2)c1	ZINC000826500646	594503448	/nfs/dbraw/zinc/50/34/48/594503448.db2.gz	GLLGTDHRXNUIIJ-UHFFFAOYSA-N	-1	3	325.288	1.944	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2CCn3ccnc32)c1[N+](=O)[O-]	ZINC000831738097	594697832	/nfs/dbraw/zinc/69/78/32/594697832.db2.gz	KFXLYKAHGNHRFU-LLVKDONJSA-N	-1	3	336.373	1.831	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCn3ccnc32)c(Cl)c1	ZINC000831739082	594697965	/nfs/dbraw/zinc/69/79/65/594697965.db2.gz	QHJALCDPKXGEJR-SNVBAGLBSA-N	-1	3	342.764	1.868	20	5		EDBDHM
CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1C(=O)[N-]c1nncn1C1CC1	ZINC000831985462	594716613	/nfs/dbraw/zinc/71/66/13/594716613.db2.gz	GGCWTHYSKXBNEL-UHFFFAOYSA-N	-1	3	348.294	1.871	20	5		EDBDHM
Cc1c(CNC2(C(=O)[O-])CCS(=O)(=O)CC2)cccc1[N+](=O)[O-]	ZINC000832853900	594781132	/nfs/dbraw/zinc/78/11/32/594781132.db2.gz	WZAYMIGNLJHSQR-UHFFFAOYSA-N	-1	3	342.373	1.025	20	5		EDBDHM
C[C@]1(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])CCCC[C@@H]1C(=O)[O-]	ZINC000833568131	594876034	/nfs/dbraw/zinc/87/60/34/594876034.db2.gz	DSWYEXVIZITENE-WBMJQRKESA-N	-1	3	335.360	1.817	20	5		EDBDHM
O=C([O-])NC1(CN[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCC1	ZINC000834154738	595032567	/nfs/dbraw/zinc/03/25/67/595032567.db2.gz	MMVQSVVXFDDQJN-ZDUSSCGKSA-N	-1	3	348.359	1.480	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2COc3ccccc3C2)nc1	ZINC000845806460	595069435	/nfs/dbraw/zinc/06/94/35/595069435.db2.gz	ABMYSSPPJFBCDQ-LLVKDONJSA-N	-1	3	349.368	1.519	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2(N(C)C)CC2)cc1F	ZINC000867439451	595321516	/nfs/dbraw/zinc/32/15/16/595321516.db2.gz	SVQPSTBBQSOFAF-UHFFFAOYSA-N	-1	3	331.369	1.415	20	5		EDBDHM
CC[S@](=O)CC[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848582952	595409047	/nfs/dbraw/zinc/40/90/47/595409047.db2.gz	LVKSOTQDTHLVLQ-QFIPXVFZSA-N	-1	3	336.316	1.451	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)C(OC)OC	ZINC000849404826	595520945	/nfs/dbraw/zinc/52/09/45/595520945.db2.gz	ATVAAVYVAMBSJA-LBPRGKRZSA-N	-1	3	332.378	1.412	20	5		EDBDHM
O=c1[n-]ccc(NCC2(O)CCC3(CC2)OCCO3)c1[N+](=O)[O-]	ZINC000853251660	595720157	/nfs/dbraw/zinc/72/01/57/595720157.db2.gz	AJNQVOLVNCPJCM-UHFFFAOYSA-N	-1	3	325.321	1.156	20	5		EDBDHM
O=c1[n-]ccc(N2CCN(c3ncccc3[N+](=O)[O-])CC2)c1[N+](=O)[O-]	ZINC000853676245	595852693	/nfs/dbraw/zinc/85/26/93/595852693.db2.gz	ABWQHKOARHTABB-UHFFFAOYSA-N	-1	3	346.303	1.325	20	5		EDBDHM
COc1cc(S(=O)(=O)[N-][C@@H]2C[C@H]2C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000867692371	596499623	/nfs/dbraw/zinc/49/96/23/596499623.db2.gz	HPCYBWYRTSUNTD-HTQZYQBOSA-N	-1	3	340.279	1.833	20	5		EDBDHM
O=C1[N-]C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3C(F)F)C[C@H]12	ZINC000865662856	596642839	/nfs/dbraw/zinc/64/28/39/596642839.db2.gz	HCTUUPKLNGAPJY-SNVBAGLBSA-N	-1	3	326.259	1.273	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@@H]2C[C@H]3CCC[C@H]3O2)cs1	ZINC000872557717	596964162	/nfs/dbraw/zinc/96/41/62/596964162.db2.gz	RWBWBRLUAPXHSA-WCABBAIRSA-N	-1	3	332.403	1.892	20	5		EDBDHM
O=C([N-]c1nc2ccccn2n1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000133273238	597953774	/nfs/dbraw/zinc/95/37/74/597953774.db2.gz	WEIGGGRXCBPWMC-UHFFFAOYSA-N	-1	3	328.244	1.798	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N[C@@H](CO)Cc1ccccc1	ZINC000738358078	598244313	/nfs/dbraw/zinc/24/43/13/598244313.db2.gz	KQYHWQCHYDNLPQ-CYBMUJFWSA-N	-1	3	340.343	1.790	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N[C@@H](CO)Cc1ccccc1	ZINC000738358078	598244315	/nfs/dbraw/zinc/24/43/15/598244315.db2.gz	KQYHWQCHYDNLPQ-CYBMUJFWSA-N	-1	3	340.343	1.790	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@H]2Cn2cccn2)c(-c2nnn[n-]2)c1	ZINC000738371618	598338226	/nfs/dbraw/zinc/33/82/26/598338226.db2.gz	UQEIZZWJAVUJLU-LBPRGKRZSA-N	-1	3	340.347	1.640	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@H]2Cn2cccn2)c(-c2nn[n-]n2)c1	ZINC000738371618	598338228	/nfs/dbraw/zinc/33/82/28/598338228.db2.gz	UQEIZZWJAVUJLU-LBPRGKRZSA-N	-1	3	340.347	1.640	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@H](n3ccnc3)C2)c(-c2nnn[n-]2)c1	ZINC000738368658	598502665	/nfs/dbraw/zinc/50/26/65/598502665.db2.gz	HPWCNXZFNDIJES-JTQLQIEISA-N	-1	3	341.335	1.208	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@H](n3ccnc3)C2)c(-c2nn[n-]n2)c1	ZINC000738368658	598502666	/nfs/dbraw/zinc/50/26/66/598502666.db2.gz	HPWCNXZFNDIJES-JTQLQIEISA-N	-1	3	341.335	1.208	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NC[C@H](O)Cc1ccccc1	ZINC000738360286	598798134	/nfs/dbraw/zinc/79/81/34/598798134.db2.gz	UYTLXRFORWWMPU-CYBMUJFWSA-N	-1	3	340.343	1.790	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NC[C@H](O)Cc1ccccc1	ZINC000738360286	598798135	/nfs/dbraw/zinc/79/81/35/598798135.db2.gz	UYTLXRFORWWMPU-CYBMUJFWSA-N	-1	3	340.343	1.790	20	5		EDBDHM
O=C(Cc1cncc([O-])c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000557669573	306232664	/nfs/dbraw/zinc/23/26/64/306232664.db2.gz	JJPJYCDAZYCETE-UHFFFAOYSA-N	-1	3	329.312	1.528	20	5		EDBDHM
Cc1nn(C)cc1[C@H](C)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000069125358	215360103	/nfs/dbraw/zinc/36/01/03/215360103.db2.gz	ANXWHTPMKMYXHT-NSHDSACASA-N	-1	3	338.389	1.985	20	5		EDBDHM
CN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)[C@@H]1c1ccccc1	ZINC000179222218	283055219	/nfs/dbraw/zinc/05/52/19/283055219.db2.gz	YCQKUUWEULTMGZ-CABCVRRESA-N	-1	3	342.355	1.871	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]C[C@@H]1CCC[C@H]1O	ZINC000089165744	138273346	/nfs/dbraw/zinc/27/33/46/138273346.db2.gz	BIHKKTWHCAKSRH-GZMMTYOYSA-N	-1	3	334.781	1.688	20	5		EDBDHM
CNC(=O)C[C@@H](C)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000451953150	305373789	/nfs/dbraw/zinc/37/37/89/305373789.db2.gz	IHWSUGNUOOBZRC-SNVBAGLBSA-N	-1	3	329.378	1.015	20	5		EDBDHM
O=[N+]([O-])c1cnn(CC[N-]S(=O)(=O)c2ccc(Cl)s2)c1	ZINC000152832678	224017899	/nfs/dbraw/zinc/01/78/99/224017899.db2.gz	PKIFUAOTMZFESE-UHFFFAOYSA-N	-1	3	336.782	1.485	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@@H]1CCN(C2CC2)C1	ZINC000354281473	285091261	/nfs/dbraw/zinc/09/12/61/285091261.db2.gz	KKQIDQUURCPCBV-SNVBAGLBSA-N	-1	3	345.808	1.763	20	5		EDBDHM
COC(=O)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C1CC1	ZINC000267822459	139677980	/nfs/dbraw/zinc/67/79/80/139677980.db2.gz	YDLKEDPZLFYNFG-NSHDSACASA-N	-1	3	348.764	1.478	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](CO)CC2CCC2)c([N+](=O)[O-])c1	ZINC000360366236	152008432	/nfs/dbraw/zinc/00/84/32/152008432.db2.gz	ZWJFYKUEZBNOCC-NSHDSACASA-N	-1	3	344.389	1.433	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1C[C@H]2OCCC[C@@H]12	ZINC000364842406	153349170	/nfs/dbraw/zinc/34/91/70/153349170.db2.gz	JHSULZJBUPKICK-QJPTWQEYSA-N	-1	3	342.373	1.449	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCc2cscn2)c(F)c1	ZINC000072711923	287255915	/nfs/dbraw/zinc/25/59/15/287255915.db2.gz	ORVJGJVIJNSAAJ-UHFFFAOYSA-N	-1	3	331.350	1.711	20	5		EDBDHM
CCOC(=O)N1CC[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000274699517	268187206	/nfs/dbraw/zinc/18/72/06/268187206.db2.gz	XZRADJVGQRXNPI-SNVBAGLBSA-N	-1	3	343.361	1.104	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC(C)(C)C	ZINC000273153048	273030051	/nfs/dbraw/zinc/03/00/51/273030051.db2.gz	MGSLPUISONPEKP-UHFFFAOYSA-N	-1	3	330.362	1.706	20	5		EDBDHM
CCCC[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000273986477	273064884	/nfs/dbraw/zinc/06/48/84/273064884.db2.gz	RBMAULIDMUAWOD-SNVBAGLBSA-N	-1	3	330.362	1.605	20	5		EDBDHM
C[C@@](O)(C[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1)C(F)(F)F	ZINC000274047067	273067472	/nfs/dbraw/zinc/06/74/72/273067472.db2.gz	YJYIPQKKLUTBDE-SECBINFHSA-N	-1	3	328.268	1.186	20	5		EDBDHM
CCO[C@@H]1C[C@H]([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)[C@@H]1OC	ZINC000274880567	273098443	/nfs/dbraw/zinc/09/84/43/273098443.db2.gz	FVZRTNDVUSHTOM-XQQFMLRXSA-N	-1	3	344.314	1.995	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@](C)(C(N)=O)C(C)C	ZINC000285359209	274519517	/nfs/dbraw/zinc/51/95/17/274519517.db2.gz	QEAVUZYVVPIILX-CYBMUJFWSA-N	-1	3	329.378	1.082	20	5		EDBDHM
CCn1cc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)cn1	ZINC000285503478	274564276	/nfs/dbraw/zinc/56/42/76/274564276.db2.gz	FLBQVDXYFPZVDZ-UHFFFAOYSA-N	-1	3	328.325	1.429	20	5		EDBDHM
C[C@H](CN(C)Cc1ccccc1)NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000189555938	279283617	/nfs/dbraw/zinc/28/36/17/279283617.db2.gz	CAESEDRWAXNQOQ-GFCCVEGCSA-N	-1	3	344.371	1.946	20	5		EDBDHM
CCc1nnc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)s1	ZINC000289579647	288734979	/nfs/dbraw/zinc/73/49/79/288734979.db2.gz	QDNKPXXKHSMTBD-UHFFFAOYSA-N	-1	3	342.402	1.796	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CCCCC[C@H]1O	ZINC000344966771	302049611	/nfs/dbraw/zinc/04/96/11/302049611.db2.gz	PZZKZLUNAQPJEY-WCQYABFASA-N	-1	3	328.390	1.875	20	5		EDBDHM
O=c1[n-]nc([C@H]2CCCN(CCOc3ccc([N+](=O)[O-])cc3)C2)o1	ZINC000295342086	303206950	/nfs/dbraw/zinc/20/69/50/303206950.db2.gz	NDKAAPVETRQGHQ-NSHDSACASA-N	-1	3	334.332	1.530	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCOCCC(C)C	ZINC000299362138	303612151	/nfs/dbraw/zinc/61/21/51/303612151.db2.gz	VHUHVHFNKHNVBT-UHFFFAOYSA-N	-1	3	346.405	1.944	20	5		EDBDHM
Cn1cc(C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c(=O)[n-]c1=O	ZINC000430575385	305056741	/nfs/dbraw/zinc/05/67/41/305056741.db2.gz	KPTBYZXTRLOWPV-UHFFFAOYSA-N	-1	3	332.316	1.059	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCC1CC(O)C1	ZINC000432292918	305090476	/nfs/dbraw/zinc/09/04/76/305090476.db2.gz	APXUBNRAUOMHRP-UHFFFAOYSA-N	-1	3	330.362	1.043	20	5		EDBDHM
CC[C@@](C)(C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)OC	ZINC000451803476	305370036	/nfs/dbraw/zinc/37/00/36/305370036.db2.gz	QLLDJFIUUVKWGN-ZDUSSCGKSA-N	-1	3	332.378	1.697	20	5		EDBDHM
CC(C)OC(=O)[C@H](C)[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000452021809	305379146	/nfs/dbraw/zinc/37/91/46/305379146.db2.gz	SZPVEQSGDSKYCE-JTQLQIEISA-N	-1	3	330.362	1.354	20	5		EDBDHM
Cc1c([C@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)cnn1C	ZINC000064245420	441366908	/nfs/dbraw/zinc/36/69/08/441366908.db2.gz	VFPQUYSFVMGMHW-ZETCQYMHSA-N	-1	3	330.391	1.738	20	5		EDBDHM
CCOCCCC[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000055264285	441635252	/nfs/dbraw/zinc/63/52/52/441635252.db2.gz	UYIORNCRXGSNDN-UHFFFAOYSA-N	-1	3	332.378	1.698	20	5		EDBDHM
O=C([N-]c1cnns1)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000192082125	442587220	/nfs/dbraw/zinc/58/72/20/442587220.db2.gz	YBMGRNYURCVXDJ-UHFFFAOYSA-N	-1	3	347.356	1.576	20	5		EDBDHM
O=C(Nc1cnn(CC(F)(F)F)c1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000187108466	442652944	/nfs/dbraw/zinc/65/29/44/442652944.db2.gz	XMMFRBOEAGGZHI-UHFFFAOYSA-N	-1	3	331.210	1.707	20	5		EDBDHM
NC(=O)CO[N-]C(=O)/C=C/c1ccc(-c2ccccc2[N+](=O)[O-])s1	ZINC000181531146	442702243	/nfs/dbraw/zinc/70/22/43/442702243.db2.gz	LNJPXRMPYIIDGS-SOFGYWHQSA-N	-1	3	347.352	1.870	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2C[C@H](O)C2(C)C)cc1C	ZINC000189272885	442909821	/nfs/dbraw/zinc/90/98/21/442909821.db2.gz	PYXRNTVMORZXBY-STQMWFEESA-N	-1	3	328.390	1.649	20	5		EDBDHM
COCc1nc(SCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)n[n-]1	ZINC000268469039	442999614	/nfs/dbraw/zinc/99/96/14/442999614.db2.gz	HFAXXJSZINHEAD-UHFFFAOYSA-N	-1	3	349.372	1.541	20	5		EDBDHM
Cc1nsc(NCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])n1	ZINC000266210366	443059150	/nfs/dbraw/zinc/05/91/50/443059150.db2.gz	GBSHVWLPHCJMDH-UHFFFAOYSA-N	-1	3	343.390	1.145	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC2(CO)CCC2)c1[N+](=O)[O-]	ZINC000190143726	443062902	/nfs/dbraw/zinc/06/29/02/443062902.db2.gz	LHYWNWZIDXDYLE-UHFFFAOYSA-N	-1	3	328.390	1.653	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCCC[C@@H]1CO	ZINC000269301801	443273575	/nfs/dbraw/zinc/27/35/75/443273575.db2.gz	QVUCBVKQGDNCOR-PWSUYJOCSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1C[C@@H](C)O[C@@H]1C	ZINC000416597291	319449345	/nfs/dbraw/zinc/44/93/45/319449345.db2.gz	GDPAYMFQTXZUMN-MXWKQRLJSA-N	-1	3	344.389	1.695	20	5		EDBDHM
O=C([N-][C@@H]1CCc2ncnn2C1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000272443321	443318397	/nfs/dbraw/zinc/31/83/97/443318397.db2.gz	BJQXCYHNDWHHTC-SNVBAGLBSA-N	-1	3	337.286	1.409	20	5		EDBDHM
CC(C)[C@H]1OCC[C@@H]1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000267305869	443412050	/nfs/dbraw/zinc/41/20/50/443412050.db2.gz	VUJWOAXONBAWRO-BXUZGUMPSA-N	-1	3	328.390	1.934	20	5		EDBDHM
CC[C@H](C)[C@H](O)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000269756779	443426873	/nfs/dbraw/zinc/42/68/73/443426873.db2.gz	ISHONGFDQAIJBD-JOYOIKCWSA-N	-1	3	332.378	1.289	20	5		EDBDHM
CC[C@@H](C)[C@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000269763287	443430432	/nfs/dbraw/zinc/43/04/32/443430432.db2.gz	KIPDGULSJKHBKK-MWLCHTKSSA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000427143492	319891223	/nfs/dbraw/zinc/89/12/23/319891223.db2.gz	JGYFNGVUDDUESR-UHFFFAOYSA-N	-1	3	334.288	1.512	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000431272985	319939192	/nfs/dbraw/zinc/93/91/92/319939192.db2.gz	CHEJIMBFPIKNFD-GFCCVEGCSA-N	-1	3	340.401	1.998	20	5		EDBDHM
CS[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])C[C@@H]1N(C)C	ZINC000436960929	320028674	/nfs/dbraw/zinc/02/86/74/320028674.db2.gz	SGIHJPUPBPVQOZ-WCQYABFASA-N	-1	3	325.390	1.418	20	5		EDBDHM
COC(=O)[C@@H](C)C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276791206	443828815	/nfs/dbraw/zinc/82/88/15/443828815.db2.gz	JLYFHLCIYRKZNA-JTQLQIEISA-N	-1	3	330.362	1.299	20	5		EDBDHM
C[N-]S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1OC	ZINC000276923674	443874823	/nfs/dbraw/zinc/87/48/23/443874823.db2.gz	PNSPWDUNYTYJBN-UHFFFAOYSA-N	-1	3	339.167	1.582	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1CCSCC1	ZINC000299631438	444100525	/nfs/dbraw/zinc/10/05/25/444100525.db2.gz	YLWNKDKQFZIUCQ-UHFFFAOYSA-N	-1	3	332.403	1.777	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CC[C@H](OC)C1	ZINC000331002270	444354303	/nfs/dbraw/zinc/35/43/03/444354303.db2.gz	OMIMGLYELNHFSM-ONGXEEELSA-N	-1	3	330.362	1.449	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCC[C@@H](CO)C2)c(F)c1	ZINC000319877698	444326508	/nfs/dbraw/zinc/32/65/08/444326508.db2.gz	HYKOBPZKKGRYPO-ZJUUUORDSA-N	-1	3	332.353	1.563	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H]1CCC[C@@H](CO)C1	ZINC000320228907	444328731	/nfs/dbraw/zinc/32/87/31/444328731.db2.gz	HHLFWHSPQJUHIQ-VXGBXAGGSA-N	-1	3	328.390	1.672	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@H](C)Cn2cccn2)c([N+](=O)[O-])c1	ZINC000337805922	444415864	/nfs/dbraw/zinc/41/58/64/444415864.db2.gz	KTZBBCIPYRFQKK-LBPRGKRZSA-N	-1	3	338.389	1.714	20	5		EDBDHM
CC(C)(C(=O)[O-])N1CCN(c2ncnc3cccc([N+](=O)[O-])c32)CC1	ZINC000579964885	321992994	/nfs/dbraw/zinc/99/29/94/321992994.db2.gz	XOCQAIIBPGNSHN-UHFFFAOYSA-N	-1	3	345.359	1.523	20	5		EDBDHM
COC(=O)c1cc(C)nc(N2CCc3c(nc[n-]c3=O)C2)c1[N+](=O)[O-]	ZINC000581327914	322164995	/nfs/dbraw/zinc/16/49/95/322164995.db2.gz	XYYADJCDQKEKCV-UHFFFAOYSA-N	-1	3	345.315	1.143	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2CCC[C@@H]2OC)c([N+](=O)[O-])c1	ZINC000341221291	444736415	/nfs/dbraw/zinc/73/64/15/444736415.db2.gz	USMQKDZYJULUJI-GWCFXTLKSA-N	-1	3	344.389	1.697	20	5		EDBDHM
COCC1(C[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])CCC1	ZINC000337207065	444984957	/nfs/dbraw/zinc/98/49/57/444984957.db2.gz	NTXZTLKVTMJTLC-UHFFFAOYSA-N	-1	3	328.390	1.998	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1cc(C)ccn1	ZINC000339041249	445002187	/nfs/dbraw/zinc/00/21/87/445002187.db2.gz	VDMSQNSDRPXOIE-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1cnc(C)[n-]c1=O	ZINC000343619055	445265748	/nfs/dbraw/zinc/26/57/48/445265748.db2.gz	JOHRRRQRUKBRRF-UHFFFAOYSA-N	-1	3	347.331	1.407	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@]2(C)CCOC2)c1C	ZINC000360227317	445641396	/nfs/dbraw/zinc/64/13/96/445641396.db2.gz	JNJSHJDYKWXBKF-AWEZNQCLSA-N	-1	3	328.390	1.917	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC[C@@H](O)C(F)(F)F	ZINC000349976205	445739316	/nfs/dbraw/zinc/73/93/16/445739316.db2.gz	PDORXUIMIAKRTF-SECBINFHSA-N	-1	3	342.295	1.495	20	5		EDBDHM
COC(=O)c1c[n-]c(C(=O)OC)c1NC(=O)c1ccccc1[N+](=O)[O-]	ZINC000354390867	446170467	/nfs/dbraw/zinc/17/04/67/446170467.db2.gz	OAIAFUVIOHZVOV-UHFFFAOYSA-N	-1	3	347.283	1.748	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CNCCC2(F)F)ccc1[N+](=O)[O-]	ZINC000420441304	446616850	/nfs/dbraw/zinc/61/68/50/446616850.db2.gz	IEQIXAINTWDOOL-NSHDSACASA-N	-1	3	335.332	1.179	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1C(=O)[N-]c1ncn(-c2ccccn2)n1	ZINC000375434595	446797001	/nfs/dbraw/zinc/79/70/01/446797001.db2.gz	CNNQTPRNIQSTJU-UHFFFAOYSA-N	-1	3	340.299	1.831	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC[C@H](O)C(C)C)c([N+](=O)[O-])c1	ZINC000443243256	447012796	/nfs/dbraw/zinc/01/27/96/447012796.db2.gz	CPZYRGJNMOGDEG-LBPRGKRZSA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@H](O)CC(C)(C)C)c([N+](=O)[O-])c1	ZINC000443260038	447017868	/nfs/dbraw/zinc/01/78/68/447017868.db2.gz	BUXATURABQHCDO-LLVKDONJSA-N	-1	3	330.406	1.979	20	5		EDBDHM
C[C@@H](CO[N-]C(=O)CCC(C)(C)[N+](=O)[O-])NC(=O)OC(C)(C)C	ZINC000496087428	447707560	/nfs/dbraw/zinc/70/75/60/447707560.db2.gz	YLPYAKKLSAFYHJ-JTQLQIEISA-N	-1	3	333.385	1.783	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000451885529	447773689	/nfs/dbraw/zinc/77/36/89/447773689.db2.gz	BNKKVIMDWHNOCI-ZDUSSCGKSA-N	-1	3	326.374	1.751	20	5		EDBDHM
CCOC(=O)[C@@H](C)C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000431273711	447795867	/nfs/dbraw/zinc/79/58/67/447795867.db2.gz	IGSQWKJYJNGFRG-JTQLQIEISA-N	-1	3	330.362	1.381	20	5		EDBDHM
NC(=O)[N-]C(=O)OCCCn1cc([N+](=O)[O-])c(=O)c2ccccc21	ZINC000497161675	447907982	/nfs/dbraw/zinc/90/79/82/447907982.db2.gz	LPKTTWMNNDVHCB-UHFFFAOYSA-N	-1	3	334.288	1.105	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)n[n-]1	ZINC000570197979	447961773	/nfs/dbraw/zinc/96/17/73/447961773.db2.gz	GSMPRCGJGDYWAE-UHFFFAOYSA-N	-1	3	332.316	2.364	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)[n-]n1	ZINC000570197979	447961778	/nfs/dbraw/zinc/96/17/78/447961778.db2.gz	GSMPRCGJGDYWAE-UHFFFAOYSA-N	-1	3	332.316	2.364	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-])N1CCC[C@@H](C)C1	ZINC000525086519	447967702	/nfs/dbraw/zinc/96/77/02/447967702.db2.gz	AIFIHLVLJVJYNO-VXGBXAGGSA-N	-1	3	342.421	1.389	20	5		EDBDHM
COCCCN1CCC(Nc2nc(C(=O)[O-])ccc2[N+](=O)[O-])CC1	ZINC000582610364	448290277	/nfs/dbraw/zinc/29/02/77/448290277.db2.gz	WUDYFCONHWGCDM-UHFFFAOYSA-N	-1	3	338.364	1.601	20	5		EDBDHM
CCC[C@H](C)[C@H](CO)[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000582790411	448341404	/nfs/dbraw/zinc/34/14/04/448341404.db2.gz	ORHSEYNPBIPCBF-JQWIXIFHSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CC[C@@H](C)C[C@@H](CO)[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000592082154	448668072	/nfs/dbraw/zinc/66/80/72/448668072.db2.gz	GUCCXTDRBFWWBS-MNOVXSKESA-N	-1	3	346.405	1.679	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1CSC[C@H]1C	ZINC000586773095	448808161	/nfs/dbraw/zinc/80/81/61/448808161.db2.gz	ACHAANONTOKNOS-RKDXNWHRSA-N	-1	3	332.403	1.633	20	5		EDBDHM
CCc1nncn1CC[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000545096781	448775507	/nfs/dbraw/zinc/77/55/07/448775507.db2.gz	IMFWGLBVNKTNDR-UHFFFAOYSA-N	-1	3	339.377	1.036	20	5		EDBDHM
COC(=O)c1cc(Cl)cc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)c1[O-]	ZINC000588100097	448870799	/nfs/dbraw/zinc/87/07/99/448870799.db2.gz	NRKHUQCFQPCNJE-UHFFFAOYSA-N	-1	3	340.679	1.716	20	5		EDBDHM
Cc1cnc([C@H](C)C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)s1	ZINC000593576283	449083481	/nfs/dbraw/zinc/08/34/81/449083481.db2.gz	NGUDQNMKBVNLKX-MRVPVSSYSA-N	-1	3	342.402	1.837	20	5		EDBDHM
CC(C)c1[nH]nc(C(=O)[N-]c2nc(CCO)cs2)c1[N+](=O)[O-]	ZINC000590391789	449145794	/nfs/dbraw/zinc/14/57/94/449145794.db2.gz	HJJNYINHHCAVJA-UHFFFAOYSA-N	-1	3	325.350	1.685	20	5		EDBDHM
Cn1ncc([N-]c2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])c1C(F)F	ZINC000611143828	449185271	/nfs/dbraw/zinc/18/52/71/449185271.db2.gz	RVMRWGXDUONNKU-UHFFFAOYSA-N	-1	3	347.303	1.657	20	5		EDBDHM
COC(=O)[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000590760453	449277986	/nfs/dbraw/zinc/27/79/86/449277986.db2.gz	HOCGABYHRZMCTI-ZJUUUORDSA-N	-1	3	328.346	1.215	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCC[C@@H]2CCCC[C@H]2O)nc1	ZINC000593564897	449353698	/nfs/dbraw/zinc/35/36/98/449353698.db2.gz	BOBVQFFHASCPCM-WCQYABFASA-N	-1	3	343.405	1.599	20	5		EDBDHM
CCn1nc(C)c(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)c1C	ZINC000593540667	449334717	/nfs/dbraw/zinc/33/47/17/449334717.db2.gz	GBWSWNPXCHGRSI-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
Cc1noc(C)c1C[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593548523	449339023	/nfs/dbraw/zinc/33/90/23/449339023.db2.gz	OAYTVNODYDQPAC-QMMMGPOBSA-N	-1	3	340.361	1.504	20	5		EDBDHM
Cc1cc(C)nc(N2CCN(c3cc[n-]c(=O)c3[N+](=O)[O-])CC2)n1	ZINC000596190253	449404743	/nfs/dbraw/zinc/40/47/43/449404743.db2.gz	QEUBSAQWBLMGBO-UHFFFAOYSA-N	-1	3	330.348	1.429	20	5		EDBDHM
CS(=O)(=O)N[C@H]1CCCC[C@H]1CNc1cc[n-]c(=O)c1[N+](=O)[O-]	ZINC000596230864	449429203	/nfs/dbraw/zinc/42/92/03/449429203.db2.gz	CXZAYNWTCACTQW-UWVGGRQHSA-N	-1	3	344.393	1.215	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H](C2CC2)[C@@H]2CCCCO2)nc1	ZINC000594485350	449549639	/nfs/dbraw/zinc/54/96/39/449549639.db2.gz	QFJZXYVKYAPKFW-JSGCOSHPSA-N	-1	3	341.389	1.616	20	5		EDBDHM
O=C(c1cc(=O)[n-]cn1)N1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000598960883	449670379	/nfs/dbraw/zinc/67/03/79/449670379.db2.gz	GWAYHPJAFQSKKV-UHFFFAOYSA-N	-1	3	329.316	1.053	20	5		EDBDHM
CC(C)(C)N1CC[C@@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000594788898	449697374	/nfs/dbraw/zinc/69/73/74/449697374.db2.gz	HZPCOFHQCYQNEM-LLVKDONJSA-N	-1	3	345.396	1.885	20	5		EDBDHM
CC[C@@H](COCC1CC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000594801258	449713368	/nfs/dbraw/zinc/71/33/68/449713368.db2.gz	LXAUIDVGHNBPBN-NSHDSACASA-N	-1	3	329.378	1.473	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCO[C@@H]2CC2(F)F)cc1[N+](=O)[O-]	ZINC000594840863	449748515	/nfs/dbraw/zinc/74/85/15/449748515.db2.gz	WJKIXNCDACHCAQ-MRVPVSSYSA-N	-1	3	342.345	1.667	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2CCN(C3CC3)C2)c([N+](=O)[O-])s1	ZINC000601318714	449828009	/nfs/dbraw/zinc/82/80/09/449828009.db2.gz	QDDCVUJBZUXWOK-SECBINFHSA-N	-1	3	331.419	1.480	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2Cc3ccccc3CO2)nc1	ZINC000599369180	449924400	/nfs/dbraw/zinc/92/44/00/449924400.db2.gz	LKSLGDAONOXEMP-AWEZNQCLSA-N	-1	3	349.368	1.410	20	5		EDBDHM
CN1C(=O)CCc2cc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)ccc21	ZINC000609203174	449978285	/nfs/dbraw/zinc/97/82/85/449978285.db2.gz	LDJPFQIXFZWNPD-UHFFFAOYSA-N	-1	3	342.311	1.857	20	5		EDBDHM
CC1(C)CNC(=O)[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000595355800	450070519	/nfs/dbraw/zinc/07/05/19/450070519.db2.gz	XQXCUELHHXIYBX-JTQLQIEISA-N	-1	3	347.780	1.051	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H]2CCOC2(C)C)c([N+](=O)[O-])c1	ZINC000595394026	450107442	/nfs/dbraw/zinc/10/74/42/450107442.db2.gz	ZYXVEVOKIIFUDN-SNVBAGLBSA-N	-1	3	344.389	1.697	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](C)Cn1cccn1	ZINC000619476297	450484267	/nfs/dbraw/zinc/48/42/67/450484267.db2.gz	ZSRMDNWEOCWBMG-JTQLQIEISA-N	-1	3	340.361	1.167	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)cc(CN[C@H]2CCCS(=O)(=O)C2)c1[O-]	ZINC000754890160	578690853	/nfs/dbraw/zinc/69/08/53/578690853.db2.gz	NTBJIOKDXPRWHX-JTQLQIEISA-N	-1	3	334.781	1.621	20	5		EDBDHM
CC(C)[C@@H]1CN(C)CCN1c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000735757309	578920770	/nfs/dbraw/zinc/92/07/70/578920770.db2.gz	AMFSZLZXXLWTQL-AWEZNQCLSA-N	-1	3	331.380	1.551	20	5		EDBDHM
CC(C)[C@@H]1CN(C)CCN1c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000735757309	578920771	/nfs/dbraw/zinc/92/07/71/578920771.db2.gz	AMFSZLZXXLWTQL-AWEZNQCLSA-N	-1	3	331.380	1.551	20	5		EDBDHM
O=C(Cc1cccc([N+](=O)[O-])c1)Oc1ccc(-c2nnn[n-]2)cc1	ZINC000737969629	579145324	/nfs/dbraw/zinc/14/53/24/579145324.db2.gz	PUMICKILBIYPOE-UHFFFAOYSA-N	-1	3	325.284	1.923	20	5		EDBDHM
O=C(Cc1cccc([N+](=O)[O-])c1)Oc1ccc(-c2nn[n-]n2)cc1	ZINC000737969629	579145325	/nfs/dbraw/zinc/14/53/25/579145325.db2.gz	PUMICKILBIYPOE-UHFFFAOYSA-N	-1	3	325.284	1.923	20	5		EDBDHM
O=C([O-])c1cc(C(=O)N2CCC[C@@H]2CN2CCCC2)cc([N+](=O)[O-])c1	ZINC000740067132	579286463	/nfs/dbraw/zinc/28/64/63/579286463.db2.gz	KWJWTGIWNZSRKO-CQSZACIVSA-N	-1	3	347.371	1.993	20	5		EDBDHM
C[C@@H](C1CC1)n1[n-]ccc1=NC(=O)COC(=O)c1ccc([N+](=O)[O-])o1	ZINC000744473729	579511926	/nfs/dbraw/zinc/51/19/26/579511926.db2.gz	JZOGAQPXFBVVIJ-VIFPVBQESA-N	-1	3	348.315	1.573	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2cccc(F)n2)c([N+](=O)[O-])c1	ZINC000747905293	579662557	/nfs/dbraw/zinc/66/25/57/579662557.db2.gz	XVBYFEYELKBSCT-UHFFFAOYSA-N	-1	3	341.320	1.616	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CC2(C)OCCCO2)cc1[N+](=O)[O-]	ZINC000752838343	579866887	/nfs/dbraw/zinc/86/68/87/579866887.db2.gz	WBYSDAMYZOUFLR-UHFFFAOYSA-N	-1	3	336.391	1.396	20	5		EDBDHM
Cc1sc2ncn([N-]C(=O)c3cc([N+](=O)[O-])c[nH]3)c(=O)c2c1C	ZINC000756772619	579956880	/nfs/dbraw/zinc/95/68/80/579956880.db2.gz	OHVNSWGHPTXNHV-UHFFFAOYSA-N	-1	3	333.329	1.695	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H]2[C@@H]3CCO[C@H]3C23CCC3)cs1	ZINC000768861930	580222916	/nfs/dbraw/zinc/22/29/16/580222916.db2.gz	PMZGEGXOQKZPGJ-MVWJERBFSA-N	-1	3	344.414	1.892	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1n[n-]nc1C	ZINC000791043479	580783296	/nfs/dbraw/zinc/78/32/96/580783296.db2.gz	AMPUDQOMKXABHY-MRVPVSSYSA-N	-1	3	349.303	1.214	20	5		EDBDHM
Cc1nnc([C@@H](C)[N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)[nH]1	ZINC000804815252	590780251	/nfs/dbraw/zinc/78/02/51/590780251.db2.gz	PTIOIGDNGSTCGH-SSDOTTSWSA-N	-1	3	325.275	1.991	20	5		EDBDHM
Cc1nc([C@@H](C)[N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)n[nH]1	ZINC000804815252	590780258	/nfs/dbraw/zinc/78/02/58/590780258.db2.gz	PTIOIGDNGSTCGH-SSDOTTSWSA-N	-1	3	325.275	1.991	20	5		EDBDHM
COc1c([O-])ccc(CN2CCC(C(=O)N(C)C)CC2)c1[N+](=O)[O-]	ZINC000891498287	591094819	/nfs/dbraw/zinc/09/48/19/591094819.db2.gz	MCQRYYCBZXJXHR-UHFFFAOYSA-N	-1	3	337.376	1.609	20	5		EDBDHM
CSc1nnc(NC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)[n-]1	ZINC000727486680	591728616	/nfs/dbraw/zinc/72/86/16/591728616.db2.gz	OSXDPHBZTNDWIE-UHFFFAOYSA-N	-1	3	333.333	1.423	20	5		EDBDHM
CSc1n[n-]c(NC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)n1	ZINC000727486680	591728618	/nfs/dbraw/zinc/72/86/18/591728618.db2.gz	OSXDPHBZTNDWIE-UHFFFAOYSA-N	-1	3	333.333	1.423	20	5		EDBDHM
CSc1nc(NC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)n[n-]1	ZINC000727486680	591728621	/nfs/dbraw/zinc/72/86/21/591728621.db2.gz	OSXDPHBZTNDWIE-UHFFFAOYSA-N	-1	3	333.333	1.423	20	5		EDBDHM
O=C(OCc1cc(=O)c([O-])co1)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000736744221	593027257	/nfs/dbraw/zinc/02/72/57/593027257.db2.gz	LRGJPJBIVARVFY-UHFFFAOYSA-N	-1	3	335.224	1.339	20	5		EDBDHM
COc1ccc(NC(=O)c2ccc(-c3nnn[n-]3)cn2)c([N+](=O)[O-])c1	ZINC000737104014	593066700	/nfs/dbraw/zinc/06/67/00/593066700.db2.gz	NWSRDSLSLKTLHO-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
COc1ccc(NC(=O)c2ccc(-c3nn[n-]n3)cn2)c([N+](=O)[O-])c1	ZINC000737104014	593066701	/nfs/dbraw/zinc/06/67/01/593066701.db2.gz	NWSRDSLSLKTLHO-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
CC(C)c1nncn1CCNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000820211468	593799380	/nfs/dbraw/zinc/79/93/80/593799380.db2.gz	NZVTYWCEOPPOFM-UHFFFAOYSA-N	-1	3	343.351	1.602	20	5		EDBDHM
CC(C)c1nncn1CCNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000820211468	593799381	/nfs/dbraw/zinc/79/93/81/593799381.db2.gz	NZVTYWCEOPPOFM-UHFFFAOYSA-N	-1	3	343.351	1.602	20	5		EDBDHM
C[C@@H](NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000820384342	593814944	/nfs/dbraw/zinc/81/49/44/593814944.db2.gz	BTMOQUQIMZVRRU-MRVPVSSYSA-N	-1	3	327.304	1.594	20	5		EDBDHM
C[C@@H](NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000820384342	593814945	/nfs/dbraw/zinc/81/49/45/593814945.db2.gz	BTMOQUQIMZVRRU-MRVPVSSYSA-N	-1	3	327.304	1.594	20	5		EDBDHM
O=C([O-])C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000821517141	593852089	/nfs/dbraw/zinc/85/20/89/593852089.db2.gz	XNUDJPGFHNRWHG-QWHCGFSZSA-N	-1	3	338.360	1.521	20	5		EDBDHM
CC1CCN(CCNc2nccc(-c3nnn[n-]3)c2[N+](=O)[O-])CC1	ZINC000820722845	593872841	/nfs/dbraw/zinc/87/28/41/593872841.db2.gz	PWQYCEAYDFWZMJ-UHFFFAOYSA-N	-1	3	332.368	1.314	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@]1(C)CC(C)(C)OC1=O	ZINC000820735250	593875736	/nfs/dbraw/zinc/87/57/36/593875736.db2.gz	PTTCWPKIOWFQQG-AWEZNQCLSA-N	-1	3	342.373	1.666	20	5		EDBDHM
CC(=O)N1CC[C@H](Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000823973565	593898234	/nfs/dbraw/zinc/89/82/34/593898234.db2.gz	KTOGJAKVRPDYHD-CABZTGNLSA-N	-1	3	345.363	1.444	20	5		EDBDHM
CC(=O)N1CC[C@H](Nc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000823973565	593898236	/nfs/dbraw/zinc/89/82/36/593898236.db2.gz	KTOGJAKVRPDYHD-CABZTGNLSA-N	-1	3	345.363	1.444	20	5		EDBDHM
COCCCn1ccc(Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)n1	ZINC000821688381	593914685	/nfs/dbraw/zinc/91/46/85/593914685.db2.gz	IXTGELQWJIMROU-UHFFFAOYSA-N	-1	3	344.335	1.752	20	5		EDBDHM
COCCCn1ccc(Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)n1	ZINC000821688381	593914688	/nfs/dbraw/zinc/91/46/88/593914688.db2.gz	IXTGELQWJIMROU-UHFFFAOYSA-N	-1	3	344.335	1.752	20	5		EDBDHM
O=C(NCCc1ccccc1[N+](=O)[O-])c1cc(-c2nnn[n-]2)c[nH]1	ZINC000823224017	594172111	/nfs/dbraw/zinc/17/21/11/594172111.db2.gz	PQYRYGLZWCTZCB-UHFFFAOYSA-N	-1	3	327.304	1.076	20	5		EDBDHM
O=C(NCCc1ccccc1[N+](=O)[O-])c1cc(-c2nn[n-]n2)c[nH]1	ZINC000823224017	594172114	/nfs/dbraw/zinc/17/21/14/594172114.db2.gz	PQYRYGLZWCTZCB-UHFFFAOYSA-N	-1	3	327.304	1.076	20	5		EDBDHM
C[C@H](NCCCN1CCN(C(=O)[O-])CC1)c1ccc([N+](=O)[O-])cc1	ZINC000825496366	594193132	/nfs/dbraw/zinc/19/31/32/594193132.db2.gz	PLYQMWMHEGMVRK-ZDUSSCGKSA-N	-1	3	336.392	1.931	20	5		EDBDHM
O=C(OCc1cc(-c2nnn[n-]2)ccc1F)c1ccc([N+](=O)[O-])cn1	ZINC000823413676	594199228	/nfs/dbraw/zinc/19/92/28/594199228.db2.gz	LVXWTVMESDPDHU-UHFFFAOYSA-N	-1	3	344.262	1.666	20	5		EDBDHM
O=C(OCc1cc(-c2nn[n-]n2)ccc1F)c1ccc([N+](=O)[O-])cn1	ZINC000823413676	594199229	/nfs/dbraw/zinc/19/92/29/594199229.db2.gz	LVXWTVMESDPDHU-UHFFFAOYSA-N	-1	3	344.262	1.666	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N[C@@H]1CCCc2c[nH]nc21	ZINC000823629931	594222982	/nfs/dbraw/zinc/22/29/82/594222982.db2.gz	MPAJOPQTWMFHKQ-LLVKDONJSA-N	-1	3	326.320	1.988	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N[C@@H]1CCCc2c[nH]nc21	ZINC000823629931	594222983	/nfs/dbraw/zinc/22/29/83/594222983.db2.gz	MPAJOPQTWMFHKQ-LLVKDONJSA-N	-1	3	326.320	1.988	20	5		EDBDHM
O=[N+]([O-])c1cc(N[C@@H](CO)c2ccccc2)ccc1-c1nnn[n-]1	ZINC000823634978	594223571	/nfs/dbraw/zinc/22/35/71/594223571.db2.gz	PCCGYLAREVCLGB-ZDUSSCGKSA-N	-1	3	326.316	1.920	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(NCc3cocn3)cc(-c3nnn[n-]3)c2c1	ZINC000823644066	594224307	/nfs/dbraw/zinc/22/43/07/594224307.db2.gz	FDTFRUJLOQEFFI-UHFFFAOYSA-N	-1	3	338.287	1.923	20	5		EDBDHM
O=[N+]([O-])c1ccc2nc(NCc3cocn3)cc(-c3nn[n-]n3)c2c1	ZINC000823644066	594224308	/nfs/dbraw/zinc/22/43/08/594224308.db2.gz	FDTFRUJLOQEFFI-UHFFFAOYSA-N	-1	3	338.287	1.923	20	5		EDBDHM
Cc1ccc(-c2nnn[n-]2)c(NCCOc2ccc([N+](=O)[O-])cc2)n1	ZINC000826276410	594407697	/nfs/dbraw/zinc/40/76/97/594407697.db2.gz	FNGDRNIHPJKAIT-UHFFFAOYSA-N	-1	3	341.331	1.969	20	5		EDBDHM
Cc1ccc(-c2nn[n-]n2)c(NCCOc2ccc([N+](=O)[O-])cc2)n1	ZINC000826276410	594407698	/nfs/dbraw/zinc/40/76/98/594407698.db2.gz	FNGDRNIHPJKAIT-UHFFFAOYSA-N	-1	3	341.331	1.969	20	5		EDBDHM
CC[C@](C)(CC(=O)[O-])NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000828653258	594473223	/nfs/dbraw/zinc/47/32/23/594473223.db2.gz	XJQYGDXREKRXGJ-MRXNPFEDSA-N	-1	3	335.360	1.717	20	5		EDBDHM
O=C(OCc1cccc(-c2nnn[n-]2)c1F)c1ccc([N+](=O)[O-])cn1	ZINC000826466885	594487045	/nfs/dbraw/zinc/48/70/45/594487045.db2.gz	XJBGHWMVDOYSEL-UHFFFAOYSA-N	-1	3	344.262	1.666	20	5		EDBDHM
O=C(OCc1cccc(-c2nn[n-]n2)c1F)c1ccc([N+](=O)[O-])cn1	ZINC000826466885	594487046	/nfs/dbraw/zinc/48/70/46/594487046.db2.gz	XJBGHWMVDOYSEL-UHFFFAOYSA-N	-1	3	344.262	1.666	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)[C@H](O)C(F)F	ZINC000831894970	594709772	/nfs/dbraw/zinc/70/97/72/594709772.db2.gz	IVJJQNIGXFWIIA-SVRRBLITSA-N	-1	3	330.334	1.339	20	5		EDBDHM
C[C@H]1CN(CCC(=O)[O-])CCN1Cc1c(F)cccc1[N+](=O)[O-]	ZINC000833628279	594891487	/nfs/dbraw/zinc/89/14/87/594891487.db2.gz	FKTIABUAHNHCLY-NSHDSACASA-N	-1	3	325.340	1.715	20	5		EDBDHM
O=c1cc(CNc2cc([N+](=O)[O-])ccc2NCCO)nc(C2CC2)[n-]1	ZINC000841690520	594938057	/nfs/dbraw/zinc/93/80/57/594938057.db2.gz	QXNPEBPBQJUVIP-UHFFFAOYSA-N	-1	3	345.359	1.984	20	5		EDBDHM
O=C([O-])/C=C/c1ccc(NC[C@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000844211967	595303333	/nfs/dbraw/zinc/30/33/33/595303333.db2.gz	MVDNIZPNKLAZSG-HZRUHFOJSA-N	-1	3	349.387	1.951	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-][C@@H]1C=CCC1)OCCO2	ZINC000849429558	595525035	/nfs/dbraw/zinc/52/50/35/595525035.db2.gz	AFLSLYPFYBZBQS-SECBINFHSA-N	-1	3	326.330	1.363	20	5		EDBDHM
O=C(N1CCC[C@@H](CNc2cc[n-]c(=O)c2[N+](=O)[O-])C1)C(F)(F)F	ZINC000853717462	595862796	/nfs/dbraw/zinc/86/27/96/595862796.db2.gz	DYMZFRZTNRNQRA-QMMMGPOBSA-N	-1	3	348.281	1.908	20	5		EDBDHM
CN1CCOC[C@H]1C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000863505417	596604413	/nfs/dbraw/zinc/60/44/13/596604413.db2.gz	NFHSLRXHNOMPKC-LLVKDONJSA-N	-1	3	345.302	1.013	20	5		EDBDHM
CCOC1CC2(C[C@H]2[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000872652735	597011270	/nfs/dbraw/zinc/01/12/70/597011270.db2.gz	NDTXELJVSNQDJB-IWXRYERYSA-N	-1	3	326.374	1.831	20	5		EDBDHM
CO[C@H]1C[C@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000882590727	597999856	/nfs/dbraw/zinc/99/98/56/597999856.db2.gz	UALWTBPHVQMRLP-CZMCAQCFSA-N	-1	3	334.781	1.952	20	5		EDBDHM
CCC1(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CCOCC1	ZINC000820962659	599688980	/nfs/dbraw/zinc/68/89/80/599688980.db2.gz	XPRMODONLOONPD-UHFFFAOYSA-N	-1	3	333.352	1.789	20	5		EDBDHM
CCC1(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CCOCC1	ZINC000820962659	599688981	/nfs/dbraw/zinc/68/89/81/599688981.db2.gz	XPRMODONLOONPD-UHFFFAOYSA-N	-1	3	333.352	1.789	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C(C)(C)c2ncccn2)c([N+](=O)[O-])c1	ZINC000560254370	306263132	/nfs/dbraw/zinc/26/31/32/306263132.db2.gz	HRUQHDSRRWVFDJ-UHFFFAOYSA-N	-1	3	336.373	1.907	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCNC(=O)C(C)(C)C	ZINC000129490922	138626412	/nfs/dbraw/zinc/62/64/12/138626412.db2.gz	OLJXABILDRDHIT-UHFFFAOYSA-N	-1	3	343.405	1.344	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]Cc2ncn(C)n2)cc1[N+](=O)[O-]	ZINC000092265857	218131610	/nfs/dbraw/zinc/13/16/10/218131610.db2.gz	PKGYKCUGARNSHG-UHFFFAOYSA-N	-1	3	345.768	1.164	20	5		EDBDHM
O=c1[n-]cnc2c1CN(c1ncnc3sc([N+](=O)[O-])cc31)CC2	ZINC000342785159	285100215	/nfs/dbraw/zinc/10/02/15/285100215.db2.gz	RYCOYENHROGSGR-UHFFFAOYSA-N	-1	3	330.329	1.658	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@@]2(C)CCCO2)cc1[N+](=O)[O-]	ZINC000491531136	255128737	/nfs/dbraw/zinc/12/87/37/255128737.db2.gz	MDCZISDADXCUPN-CYBMUJFWSA-N	-1	3	348.352	1.590	20	5		EDBDHM
COC(=O)Cc1n[n-]c(NC(=O)C=Cc2cccc([N+](=O)[O-])c2)n1	ZINC000491857942	255152833	/nfs/dbraw/zinc/15/28/33/255152833.db2.gz	DIUNPZZPVNFEQV-WAYWQWQTSA-N	-1	3	331.288	1.080	20	5		EDBDHM
COC(=O)Cc1nnc(NC(=O)C=Cc2cccc([N+](=O)[O-])c2)[n-]1	ZINC000491857942	255152834	/nfs/dbraw/zinc/15/28/34/255152834.db2.gz	DIUNPZZPVNFEQV-WAYWQWQTSA-N	-1	3	331.288	1.080	20	5		EDBDHM
COC(=O)Cc1nc(NC(=O)C=Cc2cccc([N+](=O)[O-])c2)n[n-]1	ZINC000491857942	255152835	/nfs/dbraw/zinc/15/28/35/255152835.db2.gz	DIUNPZZPVNFEQV-WAYWQWQTSA-N	-1	3	331.288	1.080	20	5		EDBDHM
O=C(C=Cc1ccc([N+](=O)[O-])cc1)N1CCc2c(=O)[n-]cnc2C1	ZINC000493653654	255218787	/nfs/dbraw/zinc/21/87/87/255218787.db2.gz	YZLGRGBRMAAQAZ-UTCJRWHESA-N	-1	3	326.312	1.689	20	5		EDBDHM
O=C(CCC1CC1)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000116651315	220978516	/nfs/dbraw/zinc/97/85/16/220978516.db2.gz	ZBPMGNKAWPUKGK-UHFFFAOYSA-N	-1	3	341.389	1.180	20	5		EDBDHM
Cc1nc(C(C)(C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)no1	ZINC000264229230	139388485	/nfs/dbraw/zinc/38/84/85/139388485.db2.gz	XXMYRYOZBSWZTC-UHFFFAOYSA-N	-1	3	340.361	1.808	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC(C)(C)C[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000272080376	140397573	/nfs/dbraw/zinc/39/75/73/140397573.db2.gz	HEOQTXJYRQFQNF-SNVBAGLBSA-N	-1	3	346.405	1.679	20	5		EDBDHM
O=[N+]([O-])c1ccc([O-])cc1CN1CCN(CC2CCOCC2)CC1	ZINC000332109180	141124552	/nfs/dbraw/zinc/12/45/52/141124552.db2.gz	HYBWCOLTWMEZHX-UHFFFAOYSA-N	-1	3	335.404	1.845	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)CC1CC1	ZINC000345543182	143103697	/nfs/dbraw/zinc/10/36/97/143103697.db2.gz	NETGZQJNKTYDGZ-VIFPVBQESA-N	-1	3	342.373	1.848	20	5		EDBDHM
Cc1cc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)[n-]c(=O)n1	ZINC000346313695	143190678	/nfs/dbraw/zinc/19/06/78/143190678.db2.gz	JJRZPJIZQGFKFQ-JTQLQIEISA-N	-1	3	344.331	1.120	20	5		EDBDHM
Cc1ncc(CNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c(=O)[n-]1	ZINC000346396829	143200524	/nfs/dbraw/zinc/20/05/24/143200524.db2.gz	SHYQFRNAJXSBNS-UHFFFAOYSA-N	-1	3	330.344	1.993	20	5		EDBDHM
CCn1ccc(C[N-]S(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)n1	ZINC000416587706	304334188	/nfs/dbraw/zinc/33/41/88/304334188.db2.gz	QHOWRAGXRKVAMS-UHFFFAOYSA-N	-1	3	340.361	1.298	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCC[C@H](CO)C2)cc1[N+](=O)[O-]	ZINC000416645959	304341097	/nfs/dbraw/zinc/34/10/97/304341097.db2.gz	GJTJDVADQLXZGI-VHSXEESVSA-N	-1	3	334.419	1.794	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCN(C)[C@@H](C)C2)cc1C	ZINC000360651731	152138810	/nfs/dbraw/zinc/13/88/10/152138810.db2.gz	IQQIHIRWTFHABK-STQMWFEESA-N	-1	3	341.433	1.973	20	5		EDBDHM
CCC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(N)=O	ZINC000352498142	162214521	/nfs/dbraw/zinc/21/45/21/162214521.db2.gz	DXEWNFLDPZXHAH-SECBINFHSA-N	-1	3	335.769	1.181	20	5		EDBDHM
O=[N+]([O-])c1cnn(CC[N-]S(=O)(=O)Cc2c(F)cccc2F)c1	ZINC000164834870	226101470	/nfs/dbraw/zinc/10/14/70/226101470.db2.gz	PGEUTGLAKPOBHY-UHFFFAOYSA-N	-1	3	346.315	1.189	20	5		EDBDHM
C[C@H](CO)[N-]S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1	ZINC000122841768	222170175	/nfs/dbraw/zinc/17/01/75/222170175.db2.gz	ZXZPOHYIGFPCSF-ZCFIWIBFSA-N	-1	3	339.167	1.016	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H](CO)C(C)C)cc1[N+](=O)[O-]	ZINC000275099692	268280691	/nfs/dbraw/zinc/28/06/91/268280691.db2.gz	SYFQWRWDKGHVIV-SNVBAGLBSA-N	-1	3	336.341	1.038	20	5		EDBDHM
CCOC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)C(C)C	ZINC000276793709	268476989	/nfs/dbraw/zinc/47/69/89/268476989.db2.gz	YHHPTBMDJHRDJM-LBPRGKRZSA-N	-1	3	346.405	1.943	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCOC[C@@H]2C)cc1[N+](=O)[O-]	ZINC000278044080	273243079	/nfs/dbraw/zinc/24/30/79/273243079.db2.gz	XSTHIZSVSVBFEH-GZMMTYOYSA-N	-1	3	348.352	1.446	20	5		EDBDHM
CCCC(C)(C)NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000281057465	273430761	/nfs/dbraw/zinc/43/07/61/273430761.db2.gz	YHHOZOROACYBAK-UHFFFAOYSA-N	-1	3	343.405	1.568	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2ncccc2F)c(F)c1	ZINC000156748453	287675529	/nfs/dbraw/zinc/67/55/29/287675529.db2.gz	AGIVEQIUROPLMY-UHFFFAOYSA-N	-1	3	329.284	1.747	20	5		EDBDHM
CCCN1CCC[C@H]1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000352512061	276011988	/nfs/dbraw/zinc/01/19/88/276011988.db2.gz	NFKSRQGRZMDGNR-LBPRGKRZSA-N	-1	3	327.406	1.748	20	5		EDBDHM
Cc1cc(C(=O)N[C@H]2COc3ccc(F)cc3C2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000366519476	278652100	/nfs/dbraw/zinc/65/21/00/278652100.db2.gz	NRYWXYKUKQVMGB-LLVKDONJSA-N	-1	3	347.302	1.876	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1C[C@@H]2OCCC[C@H]12	ZINC000190632574	302049441	/nfs/dbraw/zinc/04/94/41/302049441.db2.gz	ICWPCTRIAONJEE-WZRBSPASSA-N	-1	3	326.374	1.749	20	5		EDBDHM
O=C([N-]OCC1CC1)c1ccc(C(=O)NOCC2CC2)cc1[N+](=O)[O-]	ZINC000293734254	303011336	/nfs/dbraw/zinc/01/13/36/303011336.db2.gz	ICMOOQLXWXWOTN-UHFFFAOYSA-N	-1	3	349.343	1.738	20	5		EDBDHM
CC(C)c1nc(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])n[nH]1	ZINC000295450250	303221177	/nfs/dbraw/zinc/22/11/77/303221177.db2.gz	ZAJCFJAGKLFFOR-UHFFFAOYSA-N	-1	3	325.350	1.315	20	5		EDBDHM
CC(C)c1nnc(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])[nH]1	ZINC000295450250	303221179	/nfs/dbraw/zinc/22/11/79/303221179.db2.gz	ZAJCFJAGKLFFOR-UHFFFAOYSA-N	-1	3	325.350	1.315	20	5		EDBDHM
CN(C)C[C@H](O)COc1ccc(NC(=O)c2ccc([N+](=O)[O-])[n-]2)cc1	ZINC000426898177	304984439	/nfs/dbraw/zinc/98/44/39/304984439.db2.gz	SRMLNGPCQRCPPI-LBPRGKRZSA-N	-1	3	348.359	1.477	20	5		EDBDHM
Cc1[nH]nc(C(=O)[N-]c2cc3c(cc2F)NC(=O)CC3)c1[N+](=O)[O-]	ZINC000428857014	305019302	/nfs/dbraw/zinc/01/93/02/305019302.db2.gz	QOPYVWMWPPXLSJ-UHFFFAOYSA-N	-1	3	333.279	1.902	20	5		EDBDHM
CS(=O)(=O)[N-]c1cc(NC(=O)c2c[nH]nc2[N+](=O)[O-])ccc1F	ZINC000554835977	306198503	/nfs/dbraw/zinc/19/85/03/306198503.db2.gz	UIPPATQQQPCFJR-UHFFFAOYSA-N	-1	3	343.296	1.081	20	5		EDBDHM
O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)C(=O)[N-]C2=O	ZINC000104862182	441216193	/nfs/dbraw/zinc/21/61/93/441216193.db2.gz	CJHCOZHRRCGHPB-UHFFFAOYSA-N	-1	3	339.307	1.451	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H]2CCN(C)C2=O)cc1[N+](=O)[O-]	ZINC000083995361	441380465	/nfs/dbraw/zinc/38/04/65/441380465.db2.gz	LRIPIQDACJRKSL-VIFPVBQESA-N	-1	3	347.780	1.066	20	5		EDBDHM
Cc1nc(C)c(CCC(=O)NCCc2cccc([N+](=O)[O-])c2)c(=O)[n-]1	ZINC000089835577	441584470	/nfs/dbraw/zinc/58/44/70/441584470.db2.gz	BQLGJUJRHYKKAW-UHFFFAOYSA-N	-1	3	344.371	1.586	20	5		EDBDHM
CC(C)(O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000161009106	441946785	/nfs/dbraw/zinc/94/67/85/441946785.db2.gz	LQYIQYKTBFHLCC-UHFFFAOYSA-N	-1	3	342.295	1.663	20	5		EDBDHM
C[C@@H](O)C[C@H](C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000120765743	442129438	/nfs/dbraw/zinc/12/94/38/442129438.db2.gz	OCGHLJROTOKYHX-DTWKUNHWSA-N	-1	3	336.797	1.934	20	5		EDBDHM
O=C(Nc1ccn(CC(F)(F)F)n1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000127365813	442197117	/nfs/dbraw/zinc/19/71/17/442197117.db2.gz	NYVWZGNGSBWLJT-UHFFFAOYSA-N	-1	3	331.210	1.707	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]Cc2ccncc2)cc1[N+](=O)[O-]	ZINC000186175958	442478546	/nfs/dbraw/zinc/47/85/46/442478546.db2.gz	QMEDISHFDFZBLZ-UHFFFAOYSA-N	-1	3	341.320	1.616	20	5		EDBDHM
CC[C@H](O)CC[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl	ZINC000156800505	442522088	/nfs/dbraw/zinc/52/20/88/442522088.db2.gz	KPWKHABNDOISMW-VIFPVBQESA-N	-1	3	336.797	1.996	20	5		EDBDHM
CNC(=O)[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(C)C	ZINC000178927197	442528578	/nfs/dbraw/zinc/52/85/78/442528578.db2.gz	MJAFYWQVGIUSKU-LLVKDONJSA-N	-1	3	349.796	1.297	20	5		EDBDHM
CC[C@@H]1OCC[C@H]1[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	ZINC000416557866	319444350	/nfs/dbraw/zinc/44/43/50/319444350.db2.gz	KWTHGTNJDQSIIU-PWSUYJOCSA-N	-1	3	348.352	1.588	20	5		EDBDHM
CO[C@H]1C[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C12CCC2	ZINC000416569885	319446188	/nfs/dbraw/zinc/44/61/88/319446188.db2.gz	YXUFPYQOYKKLLR-OLZOCXBDSA-N	-1	3	326.374	1.831	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1C[C@H](C)O[C@H]1C	ZINC000416597288	319449417	/nfs/dbraw/zinc/44/94/17/319449417.db2.gz	GDPAYMFQTXZUMN-DCAQKATOSA-N	-1	3	344.389	1.695	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](CO)[C@@H]2CCCO2)c1[N+](=O)[O-]	ZINC000447934619	320148275	/nfs/dbraw/zinc/14/82/75/320148275.db2.gz	ZQMMZNHKYMEXNX-RYUDHWBXSA-N	-1	3	344.389	1.030	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1CCCC1	ZINC000276260437	443677277	/nfs/dbraw/zinc/67/72/77/443677277.db2.gz	UDAHESWIFGPFTL-UHFFFAOYSA-N	-1	3	328.346	1.602	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCOCC(F)F	ZINC000276259185	443677375	/nfs/dbraw/zinc/67/73/75/443677375.db2.gz	SDAJNIVEOPYFLE-UHFFFAOYSA-N	-1	3	340.304	1.163	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])CC1	ZINC000276838917	443847413	/nfs/dbraw/zinc/84/74/13/443847413.db2.gz	PNFUYSDKUKSPJQ-UHFFFAOYSA-N	-1	3	328.346	1.196	20	5		EDBDHM
Cn1nc2c(c1NC(=O)c1n[n-]c3ccc([N+](=O)[O-])cc31)CCC2	ZINC000299195340	443978843	/nfs/dbraw/zinc/97/88/43/443978843.db2.gz	MRRZZFCFISRXNB-UHFFFAOYSA-N	-1	3	326.316	1.946	20	5		EDBDHM
Cc1n[nH]cc1CCC[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000288926603	444015689	/nfs/dbraw/zinc/01/56/89/444015689.db2.gz	MOKHQFSDERLOJQ-UHFFFAOYSA-N	-1	3	338.389	1.846	20	5		EDBDHM
Cc1ccnc(NCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])n1	ZINC000301292642	444161774	/nfs/dbraw/zinc/16/17/74/444161774.db2.gz	VLTUXTKMVVZSFS-UHFFFAOYSA-N	-1	3	337.361	1.084	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@H]1CCC[C@@H](CO)C1	ZINC000320228903	444328738	/nfs/dbraw/zinc/32/87/38/444328738.db2.gz	HHLFWHSPQJUHIQ-NWDGAFQWSA-N	-1	3	328.390	1.672	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@](C)(O)C1CC1	ZINC000320229866	444328741	/nfs/dbraw/zinc/32/87/41/444328741.db2.gz	VZIPTBLDLWQXBH-CYBMUJFWSA-N	-1	3	330.362	1.043	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](C(N)=O)c2ccccc2)c([N+](=O)[O-])c1	ZINC000337862326	444439914	/nfs/dbraw/zinc/43/99/14/444439914.db2.gz	YNNXADPLQKHRQG-AWEZNQCLSA-N	-1	3	349.368	1.408	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCNc2ccccn2)cc1[N+](=O)[O-]	ZINC000342525137	444731738	/nfs/dbraw/zinc/73/17/38/444731738.db2.gz	WOHYXNHZHRQFIO-UHFFFAOYSA-N	-1	3	342.402	1.750	20	5		EDBDHM
CN(C)c1nc2cc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)ccc2[nH]1	ZINC000338915399	444930981	/nfs/dbraw/zinc/93/09/81/444930981.db2.gz	GQWCAEPANLMHRJ-UHFFFAOYSA-N	-1	3	342.315	1.890	20	5		EDBDHM
CN(C)c1nc2ccc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)cc2[nH]1	ZINC000338915399	444930982	/nfs/dbraw/zinc/93/09/82/444930982.db2.gz	GQWCAEPANLMHRJ-UHFFFAOYSA-N	-1	3	342.315	1.890	20	5		EDBDHM
CC(C)[C@H]([N-]S(C)(=O)=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1	ZINC000347999454	445260655	/nfs/dbraw/zinc/26/06/55/445260655.db2.gz	HWZHBHBNLUQOJJ-NSHDSACASA-N	-1	3	333.341	1.246	20	5		EDBDHM
CCCC[C@@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)OC	ZINC000354670409	445334022	/nfs/dbraw/zinc/33/40/22/445334022.db2.gz	JDLGGBGBKKYQJV-LLVKDONJSA-N	-1	3	344.389	1.913	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1(C(F)F)CC1	ZINC000359762687	445414652	/nfs/dbraw/zinc/41/46/52/445414652.db2.gz	FIJLFYUPUINTDF-UHFFFAOYSA-N	-1	3	336.316	1.927	20	5		EDBDHM
CNC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)ccc1F	ZINC000359626889	446326035	/nfs/dbraw/zinc/32/60/35/446326035.db2.gz	RZDJLGRBCWBJQV-UHFFFAOYSA-N	-1	3	349.278	1.838	20	5		EDBDHM
O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc2n[n-]nc2c1	ZINC000444639672	447113516	/nfs/dbraw/zinc/11/35/16/447113516.db2.gz	ZOUGIKLDRKGYGD-UHFFFAOYSA-N	-1	3	337.299	1.672	20	5		EDBDHM
COc1ccc([O-])c(C(=O)N2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)c1	ZINC000372477666	447074762	/nfs/dbraw/zinc/07/47/62/447074762.db2.gz	ILCTVWCIKXGRNH-LLVKDONJSA-N	-1	3	346.343	1.983	20	5		EDBDHM
CC[C@@H](C)C[C@@H](CO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000592081472	448667476	/nfs/dbraw/zinc/66/74/76/448667476.db2.gz	BQYDUCHCXCLOPM-MNOVXSKESA-N	-1	3	346.405	1.679	20	5		EDBDHM
CCc1n[nH]c([N-]S(=O)(=O)c2ccc(CC)c([N+](=O)[O-])c2)n1	ZINC000592384362	448816355	/nfs/dbraw/zinc/81/63/55/448816355.db2.gz	VJEAYFTYZJMLEK-UHFFFAOYSA-N	-1	3	325.350	1.639	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)n[n-]1	ZINC000580047229	448937859	/nfs/dbraw/zinc/93/78/59/448937859.db2.gz	WKQNLFJBOCNZNU-NWDGAFQWSA-N	-1	3	344.327	2.237	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)[n-]n1	ZINC000580047229	448937863	/nfs/dbraw/zinc/93/78/63/448937863.db2.gz	WKQNLFJBOCNZNU-NWDGAFQWSA-N	-1	3	344.327	2.237	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2[C@H]3Cc4ccccc4[C@@H]23)nc1	ZINC000593567685	449076875	/nfs/dbraw/zinc/07/68/75/449076875.db2.gz	QOSSZRFTYCCGPJ-NWANDNLSSA-N	-1	3	331.353	1.606	20	5		EDBDHM
C[C@@H](CCO)C1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCC1	ZINC000593572291	449080902	/nfs/dbraw/zinc/08/09/02/449080902.db2.gz	HUYQUXOMFUNJHA-NSHDSACASA-N	-1	3	343.405	1.457	20	5		EDBDHM
CN1CCN(CCNc2ccc([N+](=O)[O-])c(C(=O)[O-])c2)CC1(C)C	ZINC000569579407	449049528	/nfs/dbraw/zinc/04/95/28/449049528.db2.gz	KQWLXKOLQZPHHK-UHFFFAOYSA-N	-1	3	336.392	1.731	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCc3cc(O)ccc3C2)nc1	ZINC000593587309	449092178	/nfs/dbraw/zinc/09/21/78/449092178.db2.gz	DLKVQKPNCAUOHG-LBPRGKRZSA-N	-1	3	349.368	1.531	20	5		EDBDHM
CCC[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(=O)OCC	ZINC000593587120	449092368	/nfs/dbraw/zinc/09/23/68/449092368.db2.gz	SHRBNRRPTWOVGX-SNVBAGLBSA-N	-1	3	345.377	1.248	20	5		EDBDHM
CN1CCN(c2nc3ccccc3cc2[N+](=O)[O-])C[C@@H](C(=O)[O-])C1	ZINC000592981395	449094102	/nfs/dbraw/zinc/09/41/02/449094102.db2.gz	RDGPYHDBAYBJIQ-LBPRGKRZSA-N	-1	3	330.344	1.596	20	5		EDBDHM
CCN1C[C@@H](C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)CC1=O	ZINC000593640914	449124909	/nfs/dbraw/zinc/12/49/09/449124909.db2.gz	JBPZLKOLFKWARR-SECBINFHSA-N	-1	3	347.418	1.111	20	5		EDBDHM
Cc1c(C[N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)cnn1C	ZINC000590590635	449207345	/nfs/dbraw/zinc/20/73/45/449207345.db2.gz	HKVHBOYNQFPZGB-UHFFFAOYSA-N	-1	3	342.352	1.563	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1CCOC1(C)C	ZINC000590759306	449278637	/nfs/dbraw/zinc/27/86/37/449278637.db2.gz	KZACHCIPSXJHPL-LLVKDONJSA-N	-1	3	330.362	1.449	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)nc1	ZINC000593563860	449353347	/nfs/dbraw/zinc/35/33/47/449353347.db2.gz	GQOVWPLDZUUFQP-LZWOXQAQSA-N	-1	3	345.380	1.854	20	5		EDBDHM
CS(=O)(=O)N[C@H]1CCCC[C@@H]1CNc1cc[n-]c(=O)c1[N+](=O)[O-]	ZINC000596230866	449429508	/nfs/dbraw/zinc/42/95/08/449429508.db2.gz	CXZAYNWTCACTQW-ZJUUUORDSA-N	-1	3	344.393	1.215	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-]C[C@@H]1CCCO1	ZINC000594744027	449661813	/nfs/dbraw/zinc/66/18/13/449661813.db2.gz	GOCLFFBJNLTHLR-JTQLQIEISA-N	-1	3	337.357	1.600	20	5		EDBDHM
COC[C@@H](CC[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])OC	ZINC000594805631	449717936	/nfs/dbraw/zinc/71/79/36/449717936.db2.gz	UBFJRDVBTVSSPT-GFCCVEGCSA-N	-1	3	346.405	1.541	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](CO)CC2CC2)cc1C	ZINC000594865299	449779214	/nfs/dbraw/zinc/77/92/14/449779214.db2.gz	OQEHCQMQDQHGND-ZDUSSCGKSA-N	-1	3	342.417	1.899	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2C[C@@H](O)C23CCC3)c1C	ZINC000594865361	449779366	/nfs/dbraw/zinc/77/93/66/449779366.db2.gz	RMEDXMMPPPHOHX-CHWSQXEVSA-N	-1	3	340.401	1.793	20	5		EDBDHM
COCc1csc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)c1	ZINC000594850971	449759293	/nfs/dbraw/zinc/75/92/93/449759293.db2.gz	UKMKZYOYCUNOHH-UHFFFAOYSA-N	-1	3	343.386	1.676	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@]2(C)CCOC2)c(F)cc1[N+](=O)[O-]	ZINC000601344768	449854535	/nfs/dbraw/zinc/85/45/35/449854535.db2.gz	DPIKSLZYZFAICE-CYBMUJFWSA-N	-1	3	332.353	1.747	20	5		EDBDHM
Cc1nc(C)c(C[N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)o1	ZINC000599317365	449888150	/nfs/dbraw/zinc/88/81/50/449888150.db2.gz	VWVHSKIDQYLIRR-UHFFFAOYSA-N	-1	3	325.346	1.819	20	5		EDBDHM
CCCN1CC[C@H]([N-]S(=O)(=O)c2cc(C)sc2[N+](=O)[O-])C1	ZINC000601467909	449991491	/nfs/dbraw/zinc/99/14/91/449991491.db2.gz	ADZQVJDUYRMQIB-JTQLQIEISA-N	-1	3	333.435	1.727	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1[C@@H](C)[C@@H](C)O[C@H]1C	ZINC000599460517	449994909	/nfs/dbraw/zinc/99/49/09/449994909.db2.gz	YGYMCKUXGGDVLW-JIXVBMEVSA-N	-1	3	344.389	1.694	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CCOCCF)cc1[N+](=O)[O-]	ZINC000595407252	450119732	/nfs/dbraw/zinc/11/97/32/450119732.db2.gz	FGHKRJICSXTUGO-UHFFFAOYSA-N	-1	3	340.304	1.007	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)c2cccc([N+](=O)[O-])c2NC)[n-]1	ZINC000619448734	450477651	/nfs/dbraw/zinc/47/76/51/450477651.db2.gz	DLHCUTQSZTZSLG-UHFFFAOYSA-N	-1	3	333.304	1.789	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)c2cccc([N+](=O)[O-])c2NC)c[n-]1	ZINC000619448734	450477655	/nfs/dbraw/zinc/47/76/55/450477655.db2.gz	DLHCUTQSZTZSLG-UHFFFAOYSA-N	-1	3	333.304	1.789	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1cc(C)no1	ZINC000619478925	450485032	/nfs/dbraw/zinc/48/50/32/450485032.db2.gz	JVWUCEUZISUBQM-UHFFFAOYSA-N	-1	3	327.318	1.378	20	5		EDBDHM
C[C@H]([N-]c1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)NC(C)(C)C	ZINC000129146858	534034584	/nfs/dbraw/zinc/03/45/84/534034584.db2.gz	FQPXWPWBBZBVMJ-ZETCQYMHSA-N	-1	3	349.434	1.775	20	5		EDBDHM
C/C=C/C[C@H](CO)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000190162059	526292308	/nfs/dbraw/zinc/29/23/08/526292308.db2.gz	YAYKWQGMZDZYRD-ZYOFXKKJSA-N	-1	3	328.390	1.817	20	5		EDBDHM
O=C([O-])N1CC[C@@H](CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1	ZINC000740502816	579354267	/nfs/dbraw/zinc/35/42/67/579354267.db2.gz	IBVAUBJBKSHWEX-ZDUSSCGKSA-N	-1	3	334.376	1.717	20	5		EDBDHM
CC(C)CN(CCN(C)C)C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000736432350	578988216	/nfs/dbraw/zinc/98/82/16/578988216.db2.gz	ISMFNEWPIWXJON-UHFFFAOYSA-N	-1	3	337.376	1.953	20	5		EDBDHM
Cn1c(Cl)cnc1CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000737594052	579116773	/nfs/dbraw/zinc/11/67/73/579116773.db2.gz	VOYCJTVOUMBJFG-UHFFFAOYSA-N	-1	3	335.715	1.169	20	5		EDBDHM
Cn1c(Cl)cnc1CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000737594052	579116774	/nfs/dbraw/zinc/11/67/74/579116774.db2.gz	VOYCJTVOUMBJFG-UHFFFAOYSA-N	-1	3	335.715	1.169	20	5		EDBDHM
O=C([O-])/C=C/c1ccc(NC2CCN(CCO)CC2)c([N+](=O)[O-])c1	ZINC000739625806	579227940	/nfs/dbraw/zinc/22/79/40/579227940.db2.gz	RIBJXQDWNYDFON-DUXPYHPUSA-N	-1	3	335.360	1.561	20	5		EDBDHM
C[C@H]1CCN(CC[N-]S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000745942224	579568134	/nfs/dbraw/zinc/56/81/34/579568134.db2.gz	BTKHTQIHBMCIML-JTQLQIEISA-N	-1	3	347.824	1.868	20	5		EDBDHM
O=C([N-]OCc1cccnc1)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000746945152	579617944	/nfs/dbraw/zinc/61/79/44/579617944.db2.gz	HYSFBDRSSKYTIW-UHFFFAOYSA-N	-1	3	331.284	1.623	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)n[n-]1	ZINC000777837598	580451637	/nfs/dbraw/zinc/45/16/37/580451637.db2.gz	OVKBAPKVFQFNAD-UHFFFAOYSA-N	-1	3	347.331	1.813	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)[n-]n1	ZINC000777837598	580451638	/nfs/dbraw/zinc/45/16/38/580451638.db2.gz	OVKBAPKVFQFNAD-UHFFFAOYSA-N	-1	3	347.331	1.813	20	5		EDBDHM
COc1cc(F)c([N+](=O)[O-])c([N-]c2ccn(CC(=O)N(C)C)n2)c1	ZINC000779895770	580501655	/nfs/dbraw/zinc/50/16/55/580501655.db2.gz	FPKFIULMGMQDOJ-UHFFFAOYSA-N	-1	3	337.311	1.771	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]C1COC(C)(C)OC1	ZINC000795156646	580914695	/nfs/dbraw/zinc/91/46/95/580914695.db2.gz	PLFBIHUFPNVVFI-UHFFFAOYSA-N	-1	3	346.361	1.033	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NCCOc1cccnc1	ZINC000738357606	598914728	/nfs/dbraw/zinc/91/47/28/598914728.db2.gz	GJURWXQSZPRRLR-UHFFFAOYSA-N	-1	3	327.304	1.661	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NCCOc1cccnc1	ZINC000738357606	598914729	/nfs/dbraw/zinc/91/47/29/598914729.db2.gz	GJURWXQSZPRRLR-UHFFFAOYSA-N	-1	3	327.304	1.661	20	5		EDBDHM
COc1c([O-])ccc(CN2CCO[C@@H]([C@H]3CCCO3)C2)c1[N+](=O)[O-]	ZINC000892222134	590871706	/nfs/dbraw/zinc/87/17/06/590871706.db2.gz	ORKOXQNLUVSQMQ-ZIAGYGMSSA-N	-1	3	338.360	1.689	20	5		EDBDHM
COc1c([O-])ccc(CN2CC[C@H](CN3CCCC3=O)C2)c1[N+](=O)[O-]	ZINC000895449577	591761945	/nfs/dbraw/zinc/76/19/45/591761945.db2.gz	RTBFJRIJBKCRQF-LBPRGKRZSA-N	-1	3	349.387	1.753	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@H]1CC[C@H](C2CC2)O1	ZINC000907468735	592650984	/nfs/dbraw/zinc/65/09/84/592650984.db2.gz	KNHJEACJKAAITL-DGCLKSJQSA-N	-1	3	326.374	1.831	20	5		EDBDHM
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)[N-]C1=NC[C@H](C)S1	ZINC000819774941	593768374	/nfs/dbraw/zinc/76/83/74/593768374.db2.gz	WBOZPRJMMAPJCL-CBAPKCEASA-N	-1	3	340.409	1.435	20	5		EDBDHM
C[C@@H]1CN=C([N-]C(=O)c2cc([N+](=O)[O-])ncc2Br)S1	ZINC000819775966	593768517	/nfs/dbraw/zinc/76/85/17/593768517.db2.gz	ABJCJMOIPFANMR-RXMQYKEDSA-N	-1	3	345.178	1.973	20	5		EDBDHM
CC(C)C[C@@H](CCO)CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820056201	593787022	/nfs/dbraw/zinc/78/70/22/593787022.db2.gz	NNCVTCRCXABPHH-SNVBAGLBSA-N	-1	3	335.368	1.627	20	5		EDBDHM
CC(C)C[C@@H](CCO)CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820056201	593787023	/nfs/dbraw/zinc/78/70/23/593787023.db2.gz	NNCVTCRCXABPHH-SNVBAGLBSA-N	-1	3	335.368	1.627	20	5		EDBDHM
C[C@H](CCS(C)(=O)=O)Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000820248388	593802746	/nfs/dbraw/zinc/80/27/46/593802746.db2.gz	GRCUGSMLUURLMG-MRVPVSSYSA-N	-1	3	340.365	1.010	20	5		EDBDHM
C[C@H](CCS(C)(=O)=O)Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000820248388	593802747	/nfs/dbraw/zinc/80/27/47/593802747.db2.gz	GRCUGSMLUURLMG-MRVPVSSYSA-N	-1	3	340.365	1.010	20	5		EDBDHM
CCN(CCOC)c1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000821215115	593990969	/nfs/dbraw/zinc/99/09/69/593990969.db2.gz	NUFTVOXDJDLMQK-UHFFFAOYSA-N	-1	3	343.347	1.796	20	5		EDBDHM
CCN(CCOC)c1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000821215115	593990970	/nfs/dbraw/zinc/99/09/70/593990970.db2.gz	NUFTVOXDJDLMQK-UHFFFAOYSA-N	-1	3	343.347	1.796	20	5		EDBDHM
Cn1cc([C@H]2CCCN2c2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cn1	ZINC000822674320	594083462	/nfs/dbraw/zinc/08/34/62/594083462.db2.gz	QKRSNCNJXGTJQG-GFCCVEGCSA-N	-1	3	341.335	1.245	20	5		EDBDHM
Cn1cc([C@H]2CCCN2c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)cn1	ZINC000822674320	594083464	/nfs/dbraw/zinc/08/34/64/594083464.db2.gz	QKRSNCNJXGTJQG-GFCCVEGCSA-N	-1	3	341.335	1.245	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CC(OCC(F)F)C1	ZINC000823629873	594223045	/nfs/dbraw/zinc/22/30/45/594223045.db2.gz	KLMCKDAIGSHVRI-UHFFFAOYSA-N	-1	3	326.263	1.245	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CC(OCC(F)F)C1	ZINC000823629873	594223046	/nfs/dbraw/zinc/22/30/46/594223046.db2.gz	KLMCKDAIGSHVRI-UHFFFAOYSA-N	-1	3	326.263	1.245	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCC2(CO)CCCCC2)c(-c2nnn[n-]2)c1	ZINC000823652016	594224806	/nfs/dbraw/zinc/22/48/06/594224806.db2.gz	WCZOLFYZFJBGJD-UHFFFAOYSA-N	-1	3	333.352	1.525	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCC2(CO)CCCCC2)c(-c2nn[n-]n2)c1	ZINC000823652016	594224807	/nfs/dbraw/zinc/22/48/07/594224807.db2.gz	WCZOLFYZFJBGJD-UHFFFAOYSA-N	-1	3	333.352	1.525	20	5		EDBDHM
O=C(Cn1cccn1)Nc1cc(-c2nnn[n-]2)cc([N+](=O)[O-])c1Cl	ZINC000826424374	594471000	/nfs/dbraw/zinc/47/10/00/594471000.db2.gz	JRAYYLHVDXCAIV-UHFFFAOYSA-N	-1	3	348.710	1.264	20	5		EDBDHM
O=C(Cn1cccn1)Nc1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl	ZINC000826424374	594471001	/nfs/dbraw/zinc/47/10/01/594471001.db2.gz	JRAYYLHVDXCAIV-UHFFFAOYSA-N	-1	3	348.710	1.264	20	5		EDBDHM
O=[N+]([O-])c1cnc2c(c1)CN(Cc1ccccc1-c1nnn[n-]1)CC2	ZINC000826500570	594503502	/nfs/dbraw/zinc/50/35/02/594503502.db2.gz	CDOBGBOPJQZPTL-UHFFFAOYSA-N	-1	3	337.343	1.728	20	5		EDBDHM
O=[N+]([O-])c1cnc2c(c1)CN(Cc1ccccc1-c1nn[n-]n1)CC2	ZINC000826500570	594503503	/nfs/dbraw/zinc/50/35/03/594503503.db2.gz	CDOBGBOPJQZPTL-UHFFFAOYSA-N	-1	3	337.343	1.728	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)[C@@H](O)C(F)F	ZINC000831894966	594709775	/nfs/dbraw/zinc/70/97/75/594709775.db2.gz	IVJJQNIGXFWIIA-HTRCEHHLSA-N	-1	3	330.334	1.339	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl)C(=O)NC	ZINC000832738683	594773150	/nfs/dbraw/zinc/77/31/50/594773150.db2.gz	KFJAIQACYLMTFX-MRVPVSSYSA-N	-1	3	349.796	1.360	20	5		EDBDHM
Cc1nccn1C[C@@H](C)C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000840951434	594831498	/nfs/dbraw/zinc/83/14/98/594831498.db2.gz	WLUQXSKXNVHVAC-VIFPVBQESA-N	-1	3	344.418	1.776	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H]2C[C@@H](C)OC2=O)cc1[N+](=O)[O-]	ZINC000841523114	594914792	/nfs/dbraw/zinc/91/47/92/594914792.db2.gz	LBVGUGLIOQSSDR-APPZFPTMSA-N	-1	3	348.764	1.539	20	5		EDBDHM
Cc1ccc(CC[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)nc1	ZINC000841527754	594915528	/nfs/dbraw/zinc/91/55/28/594915528.db2.gz	XQFMSGFGVWMBIL-UHFFFAOYSA-N	-1	3	327.387	1.881	20	5		EDBDHM
Nc1cccc([N+](=O)[O-])c1C(=O)OCc1cc(=O)[n-]c(C2CC2)n1	ZINC000837619200	595154539	/nfs/dbraw/zinc/15/45/39/595154539.db2.gz	RGSBZHRBQRAVNK-UHFFFAOYSA-N	-1	3	330.300	1.907	20	5		EDBDHM
Cn1[n-]c([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2F)nc1=N	ZINC000847179616	595371816	/nfs/dbraw/zinc/37/18/16/595371816.db2.gz	DRAQSRWSTWCAJW-LLVKDONJSA-N	-1	3	334.311	1.252	20	5		EDBDHM
COCCOCC[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848580534	595408092	/nfs/dbraw/zinc/40/80/92/595408092.db2.gz	XJFBLQFYSLEJOV-UHFFFAOYSA-N	-1	3	334.275	1.346	20	5		EDBDHM
COC[C@@H](CCO)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848584394	595409468	/nfs/dbraw/zinc/40/94/68/595409468.db2.gz	WWAQXYLZRUEZNU-SECBINFHSA-N	-1	3	334.275	1.080	20	5		EDBDHM
CCOC(=O)CC[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848583439	595409622	/nfs/dbraw/zinc/40/96/22/595409622.db2.gz	ZVGVCSOMASWYDX-UHFFFAOYSA-N	-1	3	332.259	1.636	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2COC3(CCC3)C2)c(F)c1	ZINC000849450493	595532164	/nfs/dbraw/zinc/53/21/64/595532164.db2.gz	ZNWUEKASVAULSY-SECBINFHSA-N	-1	3	330.337	1.724	20	5		EDBDHM
Cc1ccc(N2CCN(c3cc[n-]c(=O)c3[N+](=O)[O-])CC2=O)cc1	ZINC000853610061	595830484	/nfs/dbraw/zinc/83/04/84/595830484.db2.gz	PFIOWITUWOXKCG-UHFFFAOYSA-N	-1	3	328.328	1.857	20	5		EDBDHM
Cc1cc(=O)n(C)cc1[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000120278479	596395311	/nfs/dbraw/zinc/39/53/11/596395311.db2.gz	CQYXDECDDUSDSJ-UHFFFAOYSA-N	-1	3	329.359	1.464	20	5		EDBDHM
CCN1CC[C@@H]1C[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F	ZINC000882763989	598046895	/nfs/dbraw/zinc/04/68/95/598046895.db2.gz	GJDPJECGCKYSTC-SNVBAGLBSA-N	-1	3	331.369	1.415	20	5		EDBDHM
O=[N+]([O-])c1cnc(SC[C@H](O)c2ccccc2)c(-c2nnn[n-]2)c1	ZINC000738373312	598500175	/nfs/dbraw/zinc/50/01/75/598500175.db2.gz	ADNSGHQIVCWEMQ-LBPRGKRZSA-N	-1	3	344.356	1.996	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@@H](CO)Cc2ccccc2)c(-c2nnn[n-]2)c1	ZINC000738369581	598810509	/nfs/dbraw/zinc/81/05/09/598810509.db2.gz	JHBFHUNTPIIROY-GFCCVEGCSA-N	-1	3	340.343	1.790	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@@H](CO)Cc2ccccc2)c(-c2nn[n-]n2)c1	ZINC000738369581	598810510	/nfs/dbraw/zinc/81/05/10/598810510.db2.gz	JHBFHUNTPIIROY-GFCCVEGCSA-N	-1	3	340.343	1.790	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCNc2ccccc2)c(-c2nnn[n-]2)c1	ZINC000738374624	599441560	/nfs/dbraw/zinc/44/15/60/599441560.db2.gz	RBCPDNVPKNIFNH-UHFFFAOYSA-N	-1	3	326.320	1.694	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCNc2ccccc2)c(-c2nn[n-]n2)c1	ZINC000738374624	599441563	/nfs/dbraw/zinc/44/15/63/599441563.db2.gz	RBCPDNVPKNIFNH-UHFFFAOYSA-N	-1	3	326.320	1.694	20	5		EDBDHM
O=C(N[C@@H]1[C@H]2CN(c3cc[n-]c(=O)c3[N+](=O)[O-])C[C@H]21)c1cc(F)c[nH]1	ZINC001060456382	695187837	/nfs/dbraw/zinc/18/78/37/695187837.db2.gz	INAKYZWQSYVBPA-GDGBQDQQSA-N	-1	3	347.306	1.027	20	5		EDBDHM
CS[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2[O-])C[C@H]1N(C)C	ZINC000271204083	295671350	/nfs/dbraw/zinc/67/13/50/295671350.db2.gz	XPTQCIYUSUUQRA-NEPJUHHUSA-N	-1	3	325.390	1.418	20	5		EDBDHM
CC[C@@H](C[C@@H](C)CO)[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000443345980	305238065	/nfs/dbraw/zinc/23/80/65/305238065.db2.gz	UGPGUBNIUGLTGQ-MNOVXSKESA-N	-1	3	346.405	1.679	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCNCc1cccnc1	ZINC000007093242	138094756	/nfs/dbraw/zinc/09/47/56/138094756.db2.gz	GETXIWXTNLOHGM-UHFFFAOYSA-N	-1	3	336.373	1.058	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCc1nccs1	ZINC000051162967	138134702	/nfs/dbraw/zinc/13/47/02/138134702.db2.gz	AITMXUJIPIAWPD-UHFFFAOYSA-N	-1	3	343.386	1.581	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@]2(C)CO)c([N+](=O)[O-])c1	ZINC000132720690	223357868	/nfs/dbraw/zinc/35/78/68/223357868.db2.gz	NPMKJTPDALNVDO-ZIAGYGMSSA-N	-1	3	328.390	1.733	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2C[C@@H]3OCCC[C@@H]23)c(F)c1	ZINC000249454071	139193493	/nfs/dbraw/zinc/19/34/93/139193493.db2.gz	DALMSUKOJAPERL-WCQGTBRESA-N	-1	3	330.337	1.580	20	5		EDBDHM
O=[N+]([O-])c1cnn(CC[N-]S(=O)(=O)c2cc(F)cc(F)c2)c1	ZINC000152845074	224020090	/nfs/dbraw/zinc/02/00/90/224020090.db2.gz	JOOCWQKTUXOMMD-UHFFFAOYSA-N	-1	3	332.288	1.048	20	5		EDBDHM
O=C1[N-]C(=O)N2CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])C[C@H]12	ZINC000342928836	296357133	/nfs/dbraw/zinc/35/71/33/296357133.db2.gz	DDMPEXFOJBZZGO-SECBINFHSA-N	-1	3	345.142	1.642	20	5		EDBDHM
CC[C@@H](O)CC[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	ZINC000491548577	255131133	/nfs/dbraw/zinc/13/11/33/255131133.db2.gz	SGEDYRKPOBGNHI-MRVPVSSYSA-N	-1	3	336.341	1.182	20	5		EDBDHM
Cn1cccc1CNCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000119306900	221290060	/nfs/dbraw/zinc/29/00/60/221290060.db2.gz	OSRHCUMWMHMAKR-UHFFFAOYSA-N	-1	3	338.389	1.001	20	5		EDBDHM
CCC[C@@H](O)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl	ZINC000119264912	221279882	/nfs/dbraw/zinc/27/98/82/221279882.db2.gz	ZAICISLYOOSDOK-SECBINFHSA-N	-1	3	336.797	1.996	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CCCC[C@@H]1O	ZINC000269835120	140003210	/nfs/dbraw/zinc/00/32/10/140003210.db2.gz	XWLUTUOEOFZNGZ-JQWIXIFHSA-N	-1	3	344.389	1.433	20	5		EDBDHM
O=C(CCc1cccc([N+](=O)[O-])c1)Nc1nnc(SCCO)[n-]1	ZINC000270696162	140149812	/nfs/dbraw/zinc/14/98/12/140149812.db2.gz	AKZYIPOUOZTBNA-UHFFFAOYSA-N	-1	3	337.361	1.369	20	5		EDBDHM
O=C(CCc1cccc([N+](=O)[O-])c1)Nc1nc(SCCO)n[n-]1	ZINC000270696162	140149813	/nfs/dbraw/zinc/14/98/13/140149813.db2.gz	AKZYIPOUOZTBNA-UHFFFAOYSA-N	-1	3	337.361	1.369	20	5		EDBDHM
O=C(CCc1cccc([N+](=O)[O-])c1)Nc1n[n-]c(SCCO)n1	ZINC000270696162	140149814	/nfs/dbraw/zinc/14/98/14/140149814.db2.gz	AKZYIPOUOZTBNA-UHFFFAOYSA-N	-1	3	337.361	1.369	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C1CCC(CO)CC1	ZINC000340057915	142251234	/nfs/dbraw/zinc/25/12/34/142251234.db2.gz	LMLJRDCUUCQECW-UHFFFAOYSA-N	-1	3	328.390	1.733	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](CO)C(C)C)c1C	ZINC000344809457	143014433	/nfs/dbraw/zinc/01/44/33/143014433.db2.gz	MOHCRBFOLBSIRN-GFCCVEGCSA-N	-1	3	330.406	1.754	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]Cc2ccnc(C)n2)cc1C	ZINC000345350879	143081116	/nfs/dbraw/zinc/08/11/16/143081116.db2.gz	FLBBWXRGBSVBIX-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2C[C@@H](OC(C)C)C2)c([N+](=O)[O-])c1	ZINC000416530855	304329086	/nfs/dbraw/zinc/32/90/86/304329086.db2.gz	SXKLTJAYXAVLJA-KLPPZKSPSA-N	-1	3	344.389	1.838	20	5		EDBDHM
CCOC(=O)[C@H](C)[C@H](C)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000344194240	285915213	/nfs/dbraw/zinc/91/52/13/285915213.db2.gz	ZVMKETAMVFOKFI-MNOVXSKESA-N	-1	3	344.389	1.769	20	5		EDBDHM
CN1CCC[C@@H]1C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000357666116	151108573	/nfs/dbraw/zinc/10/85/73/151108573.db2.gz	VTFSQJHABVMLHY-SNVBAGLBSA-N	-1	3	333.797	1.621	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H](O)C(F)(F)F)c1[N+](=O)[O-]	ZINC000360256135	151969932	/nfs/dbraw/zinc/96/99/32/151969932.db2.gz	FBCXKYXWHSQHGR-QMMMGPOBSA-N	-1	3	342.295	1.413	20	5		EDBDHM
Cn1ncc2c1ncc(C(=O)Nc1cc(F)cc([N+](=O)[O-])c1)c2[O-]	ZINC000352184271	162036090	/nfs/dbraw/zinc/03/60/90/162036090.db2.gz	OKWLTAMWSIQZBW-UHFFFAOYSA-N	-1	3	331.263	1.974	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]CC1(O)CCCCC1	ZINC000123428093	222275376	/nfs/dbraw/zinc/27/53/76/222275376.db2.gz	IVHXEYBHDCHVQB-UHFFFAOYSA-N	-1	3	328.390	1.709	20	5		EDBDHM
COCCC(C)(C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000273595545	268061857	/nfs/dbraw/zinc/06/18/57/268061857.db2.gz	KOSAANDKGLXJCG-UHFFFAOYSA-N	-1	3	346.405	1.944	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1(C)CCC1	ZINC000273617077	268065776	/nfs/dbraw/zinc/06/57/76/268065776.db2.gz	VEFBIXRQIFDZFC-UHFFFAOYSA-N	-1	3	328.346	1.602	20	5		EDBDHM
C/C=C/C[C@H](CO)[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000274637402	268174186	/nfs/dbraw/zinc/17/41/86/268174186.db2.gz	LLALZZLLVNGTFW-HMDXOVGESA-N	-1	3	330.362	1.209	20	5		EDBDHM
CCOC(=O)[C@@H](C)C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276917052	273169003	/nfs/dbraw/zinc/16/90/03/273169003.db2.gz	YBRNLEOMFWRXTC-NSHDSACASA-N	-1	3	344.389	1.689	20	5		EDBDHM
O=C(Nc1cc([C@H]2CCCOC2)[nH]n1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000279997475	273338602	/nfs/dbraw/zinc/33/86/02/273338602.db2.gz	MEBNURUBMDEVTO-QMMMGPOBSA-N	-1	3	333.304	1.565	20	5		EDBDHM
CC(C)(C)[C@@H](CO)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000180370729	278485954	/nfs/dbraw/zinc/48/59/54/278485954.db2.gz	XIQWFYDGROZKOV-LLVKDONJSA-N	-1	3	336.797	1.934	20	5		EDBDHM
C[C@@H]1CCC[C@]1(O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000294579431	303126680	/nfs/dbraw/zinc/12/66/80/303126680.db2.gz	MPIWGAIPKLWJDT-RNCFNFMXSA-N	-1	3	332.353	1.563	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])[C@@H](O)C(F)F	ZINC000295761446	303263050	/nfs/dbraw/zinc/26/30/50/303263050.db2.gz	PEOQZQSGBSLUNI-WCBMZHEXSA-N	-1	3	338.332	1.586	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])n[nH]1	ZINC000297218337	303374262	/nfs/dbraw/zinc/37/42/62/303374262.db2.gz	VSLBHYLARFUUIA-UHFFFAOYSA-N	-1	3	339.377	1.371	20	5		EDBDHM
COC(=O)C[C@H](C)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000390054614	303849105	/nfs/dbraw/zinc/84/91/05/303849105.db2.gz	HNYAUMGHYCXWAI-JTQLQIEISA-N	-1	3	330.362	1.442	20	5		EDBDHM
CN(C)[C@@]1(CNC(=O)c2cccc([N+](=O)[O-])c2[O-])CCSC1	ZINC000436791481	305167241	/nfs/dbraw/zinc/16/72/41/305167241.db2.gz	RWTBJQWADIKBKE-CQSZACIVSA-N	-1	3	325.390	1.468	20	5		EDBDHM
CCc1ncc(C[N-]S(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)o1	ZINC000451959264	305374172	/nfs/dbraw/zinc/37/41/72/305374172.db2.gz	MSRWUEKVJOHSPG-UHFFFAOYSA-N	-1	3	341.345	1.632	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])n[n-]1	ZINC000540976214	306043072	/nfs/dbraw/zinc/04/30/72/306043072.db2.gz	UZUQSWWILSAILM-UHFFFAOYSA-N	-1	3	336.308	1.593	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])[n-]n1	ZINC000540976214	306043073	/nfs/dbraw/zinc/04/30/73/306043073.db2.gz	UZUQSWWILSAILM-UHFFFAOYSA-N	-1	3	336.308	1.593	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCCn2cccn2)cc1C	ZINC000060499167	441247074	/nfs/dbraw/zinc/24/70/74/441247074.db2.gz	XCFQNTVYVOWIMO-UHFFFAOYSA-N	-1	3	338.389	1.777	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCCOCC(F)(F)F	ZINC000073637083	441336989	/nfs/dbraw/zinc/33/69/89/441336989.db2.gz	XRRFHSAFVARQDF-UHFFFAOYSA-N	-1	3	342.295	1.842	20	5		EDBDHM
CC(C)C(=O)NCC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000029940484	441478638	/nfs/dbraw/zinc/47/86/38/441478638.db2.gz	PLQJNOXDOWNCCV-UHFFFAOYSA-N	-1	3	349.796	1.299	20	5		EDBDHM
CN(C)Cc1cccc(CNC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)c1	ZINC000029965243	441481965	/nfs/dbraw/zinc/48/19/65/441481965.db2.gz	FWCWFEOTNAAWIT-UHFFFAOYSA-N	-1	3	330.344	1.275	20	5		EDBDHM
Cn1ncc2c1CCC[C@H]2[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000066000131	441498881	/nfs/dbraw/zinc/49/88/81/441498881.db2.gz	OJYSUJMKAPEXFE-SECBINFHSA-N	-1	3	342.402	1.746	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C)c1nncn1C	ZINC000056069114	441685476	/nfs/dbraw/zinc/68/54/76/441685476.db2.gz	PWFTXAGDDXGEFJ-VIFPVBQESA-N	-1	3	325.350	1.071	20	5		EDBDHM
CC(C)(CO)CCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000121687276	441758562	/nfs/dbraw/zinc/75/85/62/441758562.db2.gz	AWVSOMRNFKDLGW-UHFFFAOYSA-N	-1	3	334.369	1.811	20	5		EDBDHM
O=C(Cc1cccc([N+](=O)[O-])c1)NCc1ccc(-c2nnn[n-]2)cc1	ZINC000173613361	441805534	/nfs/dbraw/zinc/80/55/34/441805534.db2.gz	XGXYBNIZGOMGAH-UHFFFAOYSA-N	-1	3	338.327	1.634	20	5		EDBDHM
O=C(Cc1cccc([N+](=O)[O-])c1)NCc1ccc(-c2nn[n-]n2)cc1	ZINC000173613361	441805540	/nfs/dbraw/zinc/80/55/40/441805540.db2.gz	XGXYBNIZGOMGAH-UHFFFAOYSA-N	-1	3	338.327	1.634	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc2n[n-]nc2c1	ZINC000194417191	442893251	/nfs/dbraw/zinc/89/32/51/442893251.db2.gz	WBINFRIGYPGDCY-UHFFFAOYSA-N	-1	3	327.300	1.805	20	5		EDBDHM
CC(C)N1C[C@H](C)[C@H]([N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000266299083	443090103	/nfs/dbraw/zinc/09/01/03/443090103.db2.gz	NKOSHUAWFQHRHH-CMPLNLGQSA-N	-1	3	345.396	1.741	20	5		EDBDHM
Cc1noc(C)c1S(=O)(=O)[N-]CCc1ccccc1[N+](=O)[O-]	ZINC000266364880	443107530	/nfs/dbraw/zinc/10/75/30/443107530.db2.gz	ZXYUGMYWNMLZES-UHFFFAOYSA-N	-1	3	325.346	1.721	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])C1CC1	ZINC000269624360	443369270	/nfs/dbraw/zinc/36/92/70/443369270.db2.gz	CEWNIQQHDPYWSA-NSHDSACASA-N	-1	3	330.362	1.307	20	5		EDBDHM
CCCOC(=O)CC[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000267188251	443371488	/nfs/dbraw/zinc/37/14/88/443371488.db2.gz	ZIBQCMAWUFPCAN-UHFFFAOYSA-N	-1	3	330.362	1.525	20	5		EDBDHM
CN(C)CC[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1Cl	ZINC000279366864	443565415	/nfs/dbraw/zinc/56/54/15/443565415.db2.gz	LBCLOCKGQAIGQM-UHFFFAOYSA-N	-1	3	342.204	1.742	20	5		EDBDHM
CCCn1[n-]cc/c1=N\C(=O)COc1ccc([N+](=O)[O-])c(OC)c1	ZINC000279913576	443640346	/nfs/dbraw/zinc/64/03/46/443640346.db2.gz	KAFZFPOWQIQVDH-SAPNQHFASA-N	-1	3	334.332	1.649	20	5		EDBDHM
C[C@H]1C[C@@H]1N1CCN(C(=O)c2cc([N+](=O)[O-])c[n-]c2=O)C[C@@H](C)C1	ZINC000452121573	320243343	/nfs/dbraw/zinc/24/33/43/320243343.db2.gz	KNHKYAQQTMJNED-MJVIPROJSA-N	-1	3	334.376	1.498	20	5		EDBDHM
CCOc1cc([N-]C(=O)c2cnn(C)n2)c([N+](=O)[O-])cc1OCC	ZINC000283866226	443748063	/nfs/dbraw/zinc/74/80/63/443748063.db2.gz	NADGLTAOTKZUSX-UHFFFAOYSA-N	-1	3	335.320	1.773	20	5		EDBDHM
CC(C)[C@@H](C)NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000280866802	443762909	/nfs/dbraw/zinc/76/29/09/443762909.db2.gz	YASYTQMNRILIQS-SNVBAGLBSA-N	-1	3	329.378	1.034	20	5		EDBDHM
Cc1nc([C@H](C)[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)n[nH]1	ZINC000285265037	443918272	/nfs/dbraw/zinc/91/82/72/443918272.db2.gz	DIURNBFMKYPHQZ-ZETCQYMHSA-N	-1	3	343.340	1.508	20	5		EDBDHM
C[C@H](CC[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-])N1CCCCC1	ZINC000544187354	320789943	/nfs/dbraw/zinc/78/99/43/320789943.db2.gz	WFYKOCRYJZAZCJ-GFCCVEGCSA-N	-1	3	342.421	1.533	20	5		EDBDHM
O=Cc1ccc(OCC(=O)[N-]c2nncn2C2CC2)c([N+](=O)[O-])c1	ZINC000285577962	444034795	/nfs/dbraw/zinc/03/47/95/444034795.db2.gz	ARGAZLOJGWVXLI-UHFFFAOYSA-N	-1	3	331.288	1.351	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC1(CCO)CC1	ZINC000319186376	444322898	/nfs/dbraw/zinc/32/28/98/444322898.db2.gz	IKXDTMLOECDCDC-UHFFFAOYSA-N	-1	3	330.362	1.044	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]c2ccc(=O)[nH]c2)c([N+](=O)[O-])c1	ZINC000320097087	444327896	/nfs/dbraw/zinc/32/78/96/444327896.db2.gz	GLZPSKDQMYMGLP-UHFFFAOYSA-N	-1	3	325.302	1.505	20	5		EDBDHM
CCOC(=O)C[C@@H](C)C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000340604456	444457285	/nfs/dbraw/zinc/45/72/85/444457285.db2.gz	MOLYDSRVZNLQDY-LLVKDONJSA-N	-1	3	344.389	1.771	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CCC[C@H]2CCO)c([N+](=O)[O-])c1	ZINC000331166998	444427389	/nfs/dbraw/zinc/42/73/89/444427389.db2.gz	MRJBPTQXUSYIRX-RYUDHWBXSA-N	-1	3	328.390	1.733	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2nccs2)c([N+](=O)[O-])c1	ZINC000340535840	444428470	/nfs/dbraw/zinc/42/84/70/444428470.db2.gz	WCFOGOLPUNNDOS-UHFFFAOYSA-N	-1	3	329.359	1.538	20	5		EDBDHM
CN1CCN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@@H](C(=O)[O-])C1	ZINC000581073738	322132571	/nfs/dbraw/zinc/13/25/71/322132571.db2.gz	HIYVDUGYTHHOMM-NSHDSACASA-N	-1	3	330.344	1.596	20	5		EDBDHM
Cn1ncc([N+](=O)[O-])c1[N-]C(=O)c1ncsc1Br	ZINC000343750150	444563895	/nfs/dbraw/zinc/56/38/95/444563895.db2.gz	NAWRVWUZNDHZMM-UHFFFAOYSA-N	-1	3	332.139	1.800	20	5		EDBDHM
Cc1ncc(CNC(=O)NCCc2ccccc2[N+](=O)[O-])c(=O)[n-]1	ZINC000343931544	444676857	/nfs/dbraw/zinc/67/68/57/444676857.db2.gz	UBMSXZJJFJUAOX-UHFFFAOYSA-N	-1	3	331.332	1.441	20	5		EDBDHM
C[C@H](NC(=O)c1ccc2c(c1)C(=O)[N-]C2=O)c1ccccc1[N+](=O)[O-]	ZINC000342490197	444714039	/nfs/dbraw/zinc/71/40/39/444714039.db2.gz	NTGVHDUIBSSYKP-VIFPVBQESA-N	-1	3	339.307	1.969	20	5		EDBDHM
COC(=O)CCCC[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000343508162	445235724	/nfs/dbraw/zinc/23/57/24/445235724.db2.gz	QBQQHVUDQZWCFO-UHFFFAOYSA-N	-1	3	336.391	1.586	20	5		EDBDHM
COc1cc(C(=O)NCc2cnc(C)[n-]c2=O)cc([N+](=O)[O-])c1C	ZINC000359860896	445464561	/nfs/dbraw/zinc/46/45/61/445464561.db2.gz	XAPGSMFAURKFOW-UHFFFAOYSA-N	-1	3	332.316	1.646	20	5		EDBDHM
COC(=O)[C@@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(C)C	ZINC000360176828	445614140	/nfs/dbraw/zinc/61/41/40/445614140.db2.gz	DPXJSGYZPXSDFA-LBPRGKRZSA-N	-1	3	344.389	1.688	20	5		EDBDHM
Cc1nc(C)c(CC(=O)N(C)CCc2ccccc2[N+](=O)[O-])c(=O)[n-]1	ZINC000359143270	445977563	/nfs/dbraw/zinc/97/75/63/445977563.db2.gz	ZEYJEIYECCZBPO-UHFFFAOYSA-N	-1	3	344.371	1.951	20	5		EDBDHM
O=C(CNc1ccccc1[N+](=O)[O-])N1CCc2c(=O)[n-]cnc2C1	ZINC000582810552	325933786	/nfs/dbraw/zinc/93/37/86/325933786.db2.gz	AZEKBEUMUAIQIK-UHFFFAOYSA-N	-1	3	329.316	1.087	20	5		EDBDHM
CC[C@]1([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)CCOC1	ZINC000616461200	450428901	/nfs/dbraw/zinc/42/89/01/450428901.db2.gz	CMCBISBWPPMCEY-ZDUSSCGKSA-N	-1	3	330.362	1.451	20	5		EDBDHM
COc1cc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)ccc1[O-]	ZINC000442806705	446974221	/nfs/dbraw/zinc/97/42/21/446974221.db2.gz	BZQIYXOSYXVZQF-UHFFFAOYSA-N	-1	3	328.284	2.438	20	5		EDBDHM
C[C@@H](CCN1CCN(C)CC1)Nc1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000570164176	447956908	/nfs/dbraw/zinc/95/69/08/447956908.db2.gz	AZGLMZSQPKYPFS-LBPRGKRZSA-N	-1	3	336.392	1.731	20	5		EDBDHM
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC[C@@]2(N(C)C)CCSC2)n1	ZINC000576043717	447956890	/nfs/dbraw/zinc/95/68/90/447956890.db2.gz	WZOYIJPUUMVZMT-AWEZNQCLSA-N	-1	3	340.405	1.846	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)CCCNc1ccc([N+](=O)[O-])cc1	ZINC000524395630	447927381	/nfs/dbraw/zinc/92/73/81/447927381.db2.gz	QJZOQBBECYEQPG-CQSZACIVSA-N	-1	3	347.375	1.415	20	5		EDBDHM
COc1ccc(CNC(=O)c2cc(=O)[n-]c(C3CC3)n2)cc1[N+](=O)[O-]	ZINC000584478326	448542980	/nfs/dbraw/zinc/54/29/80/448542980.db2.gz	PBXSJKMUZPJBOG-UHFFFAOYSA-N	-1	3	344.327	1.906	20	5		EDBDHM
CC[C@H](C)C[C@@H](CO)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000592081732	448667679	/nfs/dbraw/zinc/66/76/79/448667679.db2.gz	CFRMLNFPHDQFME-JQWIXIFHSA-N	-1	3	330.406	1.979	20	5		EDBDHM
C[C@@H](C(=O)N1CCC[C@@H]1c1nc(=N)n(C)[n-]1)c1cccc([N+](=O)[O-])c1	ZINC000574405463	448867194	/nfs/dbraw/zinc/86/71/94/448867194.db2.gz	DIHVZNMHMSCGIR-ZWNOBZJWSA-N	-1	3	344.375	1.603	20	5		EDBDHM
CN1C[C@H]2[C@@H](CCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2[O-])C1	ZINC000592802346	448996586	/nfs/dbraw/zinc/99/65/86/448996586.db2.gz	XFLNGZKYAUUFGI-UFBFGSQYSA-N	-1	3	325.752	1.730	20	5		EDBDHM
Cc1cnc([C@@H](C)C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)s1	ZINC000593576284	449084076	/nfs/dbraw/zinc/08/40/76/449084076.db2.gz	NGUDQNMKBVNLKX-QMMMGPOBSA-N	-1	3	342.402	1.837	20	5		EDBDHM
COC1CCN(CCNc2ccc(CC(=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000592976905	449091966	/nfs/dbraw/zinc/09/19/66/449091966.db2.gz	IGHPVHQAXOOXSQ-UHFFFAOYSA-N	-1	3	337.376	1.745	20	5		EDBDHM
COC(=O)[C@@H](CC(C)(C)C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593613040	449108548	/nfs/dbraw/zinc/10/85/48/449108548.db2.gz	PTQMSIDPOPGQLZ-SNVBAGLBSA-N	-1	3	345.377	1.246	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]Cc2cscn2)c(F)cc1[N+](=O)[O-]	ZINC000590590854	449206507	/nfs/dbraw/zinc/20/65/07/449206507.db2.gz	FUPFTZQZZQWAGB-UHFFFAOYSA-N	-1	3	331.350	1.977	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])ncn1	ZINC000611134003	449181383	/nfs/dbraw/zinc/18/13/83/449181383.db2.gz	IFOZFMHNNLBGTQ-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
O=C(NC[C@@H]1CCN1C1CCCCC1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000600228975	449254733	/nfs/dbraw/zinc/25/47/33/449254733.db2.gz	IRZAELYCGZAETC-ZDUSSCGKSA-N	-1	3	334.376	1.832	20	5		EDBDHM
Cc1nccn1CCCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593550935	449341770	/nfs/dbraw/zinc/34/17/70/449341770.db2.gz	OFLGRAFISLDUNZ-UHFFFAOYSA-N	-1	3	339.377	1.253	20	5		EDBDHM
O=C1[C@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])CCN1Cc1ccccc1	ZINC000596096778	449361183	/nfs/dbraw/zinc/36/11/83/449361183.db2.gz	AMMSWVNGMCDCSR-CYBMUJFWSA-N	-1	3	328.328	1.908	20	5		EDBDHM
C[C@@H](CC[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])N1CCCCC1	ZINC000594770650	449683572	/nfs/dbraw/zinc/68/35/72/449683572.db2.gz	BQDJNEFLJQOFAZ-LBPRGKRZSA-N	-1	3	342.421	1.533	20	5		EDBDHM
CCOc1cnc(C(=O)[N-]c2cc(C(=O)OC)cc([N+](=O)[O-])c2)cn1	ZINC000614493841	449644713	/nfs/dbraw/zinc/64/47/13/449644713.db2.gz	VAVIJYHBJLSSHJ-UHFFFAOYSA-N	-1	3	346.299	1.822	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@]23C[C@@H]2CCC3)cc1[N+](=O)[O-]	ZINC000594806145	449719055	/nfs/dbraw/zinc/71/90/55/449719055.db2.gz	XPSXAEYZIFWESW-SDBXPKJASA-N	-1	3	330.337	1.963	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1oc(C)nc1C	ZINC000599317302	449887422	/nfs/dbraw/zinc/88/74/22/449887422.db2.gz	TUAFKLZSAFIGOK-UHFFFAOYSA-N	-1	3	341.345	1.687	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@H]2CCOC[C@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000601414840	449930690	/nfs/dbraw/zinc/93/06/90/449930690.db2.gz	KHKBTEOTTOMMIY-GHMZBOCLSA-N	-1	3	346.380	1.993	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCN(CC2CC2)C1	ZINC000609387992	450024450	/nfs/dbraw/zinc/02/44/50/450024450.db2.gz	WHEGENCUJVLJOZ-CYBMUJFWSA-N	-1	3	339.417	1.666	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@]1(C)CC1(C)C	ZINC000595360401	450074110	/nfs/dbraw/zinc/07/41/10/450074110.db2.gz	ARYYBGUFBOGABN-CQSZACIVSA-N	-1	3	342.373	1.848	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)c1nccn1C	ZINC000595384556	450099120	/nfs/dbraw/zinc/09/91/20/450099120.db2.gz	XPFQZTDUNDXKED-VIFPVBQESA-N	-1	3	340.361	1.376	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CCOC1(C)C	ZINC000595393293	450106815	/nfs/dbraw/zinc/10/68/15/450106815.db2.gz	ULIZHHHSTNTGTQ-SNVBAGLBSA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCCn2cncn2)c1C	ZINC000610800152	450339199	/nfs/dbraw/zinc/33/91/99/450339199.db2.gz	FWNRQAMVLOIBRT-UHFFFAOYSA-N	-1	3	339.377	1.172	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)[n-]1	ZINC000619446154	450475887	/nfs/dbraw/zinc/47/58/87/450475887.db2.gz	UDEDDJLXKPFGTG-UHFFFAOYSA-N	-1	3	336.308	1.065	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)c[n-]1	ZINC000619446154	450475889	/nfs/dbraw/zinc/47/58/89/450475889.db2.gz	UDEDDJLXKPFGTG-UHFFFAOYSA-N	-1	3	336.308	1.065	20	5		EDBDHM
CN(C(=O)CCn1cc([N+](=O)[O-])cn1)c1ccc(-c2nnn[n-]2)cc1	ZINC000736732511	579016039	/nfs/dbraw/zinc/01/60/39/579016039.db2.gz	LYWRQQXSAPEFIV-UHFFFAOYSA-N	-1	3	342.319	1.025	20	5		EDBDHM
CN(C(=O)CCn1cc([N+](=O)[O-])cn1)c1ccc(-c2nn[n-]n2)cc1	ZINC000736732511	579016040	/nfs/dbraw/zinc/01/60/40/579016040.db2.gz	LYWRQQXSAPEFIV-UHFFFAOYSA-N	-1	3	342.319	1.025	20	5		EDBDHM
COC(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C1	ZINC000736906963	579030600	/nfs/dbraw/zinc/03/06/00/579030600.db2.gz	AMUKPORVWKJNLN-SECBINFHSA-N	-1	3	332.320	1.164	20	5		EDBDHM
COC(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C1	ZINC000736906963	579030601	/nfs/dbraw/zinc/03/06/01/579030601.db2.gz	AMUKPORVWKJNLN-SECBINFHSA-N	-1	3	332.320	1.164	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cnc1NCCNc1ccc(-c2nnn[n-]2)cn1	ZINC000737284906	579065924	/nfs/dbraw/zinc/06/59/24/579065924.db2.gz	OZFPSRLOJZJZJS-UHFFFAOYSA-N	-1	3	341.335	1.397	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cnc1NCCNc1ccc(-c2nn[n-]n2)cn1	ZINC000737284906	579065925	/nfs/dbraw/zinc/06/59/25/579065925.db2.gz	OZFPSRLOJZJZJS-UHFFFAOYSA-N	-1	3	341.335	1.397	20	5		EDBDHM
Cn1cc([C@@H]2CCN(c3ccc(-c4nnn[n-]4)cc3[N+](=O)[O-])C2)cn1	ZINC000737602820	579118085	/nfs/dbraw/zinc/11/80/85/579118085.db2.gz	IROVIXGDEJSLNA-LLVKDONJSA-N	-1	3	340.347	1.502	20	5		EDBDHM
Cn1cc([C@@H]2CCN(c3ccc(-c4nn[n-]n4)cc3[N+](=O)[O-])C2)cn1	ZINC000737602820	579118087	/nfs/dbraw/zinc/11/80/87/579118087.db2.gz	IROVIXGDEJSLNA-LLVKDONJSA-N	-1	3	340.347	1.502	20	5		EDBDHM
Cn1cnc2c1CCN(c1ccc(-c3nnn[n-]3)cc1[N+](=O)[O-])C2	ZINC000737618356	579121138	/nfs/dbraw/zinc/12/11/38/579121138.db2.gz	HPORYYRTEPJDBX-UHFFFAOYSA-N	-1	3	326.320	1.071	20	5		EDBDHM
Cn1cnc2c1CCN(c1ccc(-c3nn[n-]n3)cc1[N+](=O)[O-])C2	ZINC000737618356	579121139	/nfs/dbraw/zinc/12/11/39/579121139.db2.gz	HPORYYRTEPJDBX-UHFFFAOYSA-N	-1	3	326.320	1.071	20	5		EDBDHM
O=C(NCc1ccc(-c2nnn[n-]2)cc1F)c1ccc([N+](=O)[O-])o1	ZINC000738101042	579159938	/nfs/dbraw/zinc/15/99/38/579159938.db2.gz	DLNPAFFRVGQXLO-UHFFFAOYSA-N	-1	3	332.251	1.437	20	5		EDBDHM
O=C(NCc1ccc(-c2nn[n-]n2)cc1F)c1ccc([N+](=O)[O-])o1	ZINC000738101042	579159939	/nfs/dbraw/zinc/15/99/39/579159939.db2.gz	DLNPAFFRVGQXLO-UHFFFAOYSA-N	-1	3	332.251	1.437	20	5		EDBDHM
O=C(Nc1ccc(-c2nnn[n-]2)cn1)c1cc(F)c(F)cc1[N+](=O)[O-]	ZINC000738150802	579164760	/nfs/dbraw/zinc/16/47/60/579164760.db2.gz	GLZSWMVMIPDHLL-UHFFFAOYSA-N	-1	3	347.241	1.700	20	5		EDBDHM
O=C(Nc1ccc(-c2nn[n-]n2)cn1)c1cc(F)c(F)cc1[N+](=O)[O-]	ZINC000738150802	579164761	/nfs/dbraw/zinc/16/47/61/579164761.db2.gz	GLZSWMVMIPDHLL-UHFFFAOYSA-N	-1	3	347.241	1.700	20	5		EDBDHM
O=C(Nc1ccncc1-c1nnn[n-]1)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000738195819	579170273	/nfs/dbraw/zinc/17/02/73/579170273.db2.gz	HXYBMBZNJYHLMM-UHFFFAOYSA-N	-1	3	345.706	1.498	20	5		EDBDHM
O=C(Nc1ccncc1-c1nn[n-]n1)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000738195819	579170274	/nfs/dbraw/zinc/17/02/74/579170274.db2.gz	HXYBMBZNJYHLMM-UHFFFAOYSA-N	-1	3	345.706	1.498	20	5		EDBDHM
COC(=O)c1cnccc1[N-]C(=O)c1cc(F)c([N+](=O)[O-])cc1F	ZINC000788121268	579247170	/nfs/dbraw/zinc/24/71/70/579247170.db2.gz	CWGDCWKWHWLPHT-UHFFFAOYSA-N	-1	3	337.238	1.729	20	5		EDBDHM
Cc1ccc([C@@H](O)C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)o1	ZINC000767791859	580199672	/nfs/dbraw/zinc/19/96/72/580199672.db2.gz	FOQILCCTWSQQOV-JTQLQIEISA-N	-1	3	346.386	1.878	20	5		EDBDHM
COC(=O)C[C@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C1CC1	ZINC000768852641	580222496	/nfs/dbraw/zinc/22/24/96/580222496.db2.gz	INNKJFMUNXKINE-VIFPVBQESA-N	-1	3	334.375	1.276	20	5		EDBDHM
COC(=O)CC1([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CCC1	ZINC000768854879	580222573	/nfs/dbraw/zinc/22/25/73/580222573.db2.gz	UEEHDJYLQYONQQ-UHFFFAOYSA-N	-1	3	334.375	1.420	20	5		EDBDHM
O=C(NCc1nnc(C(F)(F)F)[n-]1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000775907540	580403938	/nfs/dbraw/zinc/40/39/38/580403938.db2.gz	ICEBGTSFILXJKB-UHFFFAOYSA-N	-1	3	333.201	1.801	20	5		EDBDHM
O=C(NCc1n[n-]c(C(F)(F)F)n1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000775907540	580403939	/nfs/dbraw/zinc/40/39/39/580403939.db2.gz	ICEBGTSFILXJKB-UHFFFAOYSA-N	-1	3	333.201	1.801	20	5		EDBDHM
O=C(NCc1nc(C(F)(F)F)n[n-]1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000775907540	580403940	/nfs/dbraw/zinc/40/39/40/580403940.db2.gz	ICEBGTSFILXJKB-UHFFFAOYSA-N	-1	3	333.201	1.801	20	5		EDBDHM
CCN(CC[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-])C(C)C	ZINC000780855091	580535063	/nfs/dbraw/zinc/53/50/63/580535063.db2.gz	FEMQRGLBXCYFQK-UHFFFAOYSA-N	-1	3	333.385	1.743	20	5		EDBDHM
C[C@H]1CCCN1CC[N-]S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000780867303	580535944	/nfs/dbraw/zinc/53/59/44/580535944.db2.gz	PICGAAOSIXBHDF-JTQLQIEISA-N	-1	3	331.369	1.497	20	5		EDBDHM
COCCOC[C@H]1CCN(Cc2ccc([O-])c(OC)c2[N+](=O)[O-])C1	ZINC000892133257	590816210	/nfs/dbraw/zinc/81/62/10/590816210.db2.gz	MUUCNDDUNZQCBY-LBPRGKRZSA-N	-1	3	340.376	1.794	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@@H](C)OC(=O)c2cc(C)cc([N+](=O)[O-])c2N)on1	ZINC000727898996	591432668	/nfs/dbraw/zinc/43/26/68/591432668.db2.gz	DBPIFUMGHYJFHS-SECBINFHSA-N	-1	3	348.315	1.966	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1CCOC12CCCC2	ZINC000908186898	592366142	/nfs/dbraw/zinc/36/61/42/592366142.db2.gz	NLTUZUQCJXGWQW-CYBMUJFWSA-N	-1	3	326.374	1.975	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])n[nH]1	ZINC000765187231	593434096	/nfs/dbraw/zinc/43/40/96/593434096.db2.gz	SDYWHLHAMPYMBF-UHFFFAOYSA-N	-1	3	338.389	1.976	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])[nH]n1	ZINC000765187231	593434098	/nfs/dbraw/zinc/43/40/98/593434098.db2.gz	SDYWHLHAMPYMBF-UHFFFAOYSA-N	-1	3	338.389	1.976	20	5		EDBDHM
CCn1c(=O)c2ccc(C(=O)OCC(C)[N+](=O)[O-])cc2[n-]c1=S	ZINC000813111449	593518563	/nfs/dbraw/zinc/51/85/63/593518563.db2.gz	HJTMZSJGUVIFPO-QMMMGPOBSA-N	-1	3	337.357	1.527	20	5		EDBDHM
O=C(Cc1cncc([O-])c1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000816811901	593551515	/nfs/dbraw/zinc/55/15/15/593551515.db2.gz	UEIVAQKEMXNBNV-UHFFFAOYSA-N	-1	3	342.355	1.587	20	5		EDBDHM
C[C@@H](C(=O)OC(C)(C)C)N(C)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000819884181	593773461	/nfs/dbraw/zinc/77/34/61/593773461.db2.gz	SWRGDEOFLBIICV-VIFPVBQESA-N	-1	3	348.363	1.941	20	5		EDBDHM
C[C@@H](C(=O)OC(C)(C)C)N(C)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000819884181	593773462	/nfs/dbraw/zinc/77/34/62/593773462.db2.gz	SWRGDEOFLBIICV-VIFPVBQESA-N	-1	3	348.363	1.941	20	5		EDBDHM
CC(C)COC[C@H](O)CNc1ccc(-c2nnn[n-]2)c([N+](=O)[O-])c1	ZINC000820103194	593791461	/nfs/dbraw/zinc/79/14/61/593791461.db2.gz	PDCQRUAUQOOBRB-LLVKDONJSA-N	-1	3	336.352	1.220	20	5		EDBDHM
CC(C)COC[C@@H](O)COc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-]	ZINC000824270388	593973396	/nfs/dbraw/zinc/97/33/96/593973396.db2.gz	DURWREKTTVDEIH-SNVBAGLBSA-N	-1	3	337.336	1.187	20	5		EDBDHM
CC(C)COC[C@@H](O)COc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-]	ZINC000824270388	593973397	/nfs/dbraw/zinc/97/33/97/593973397.db2.gz	DURWREKTTVDEIH-SNVBAGLBSA-N	-1	3	337.336	1.187	20	5		EDBDHM
Cc1nc(NC(=O)c2cc(-c3nnn[n-]3)cn2C)ccc1[N+](=O)[O-]	ZINC000822449867	594050437	/nfs/dbraw/zinc/05/04/37/594050437.db2.gz	SGBLUHHWDPJSLH-UHFFFAOYSA-N	-1	3	328.292	1.069	20	5		EDBDHM
Cc1nc(NC(=O)c2cc(-c3nn[n-]n3)cn2C)ccc1[N+](=O)[O-]	ZINC000822449867	594050439	/nfs/dbraw/zinc/05/04/39/594050439.db2.gz	SGBLUHHWDPJSLH-UHFFFAOYSA-N	-1	3	328.292	1.069	20	5		EDBDHM
Cc1nnc(NCCc2ccccc2[N+](=O)[O-])c(-c2nnn[n-]2)c1C	ZINC000822516373	594060909	/nfs/dbraw/zinc/06/09/09/594060909.db2.gz	XIYSBBYOGMYGMN-UHFFFAOYSA-N	-1	3	340.347	1.836	20	5		EDBDHM
Cc1nnc(NCCc2ccccc2[N+](=O)[O-])c(-c2nn[n-]n2)c1C	ZINC000822516373	594060911	/nfs/dbraw/zinc/06/09/11/594060911.db2.gz	XIYSBBYOGMYGMN-UHFFFAOYSA-N	-1	3	340.347	1.836	20	5		EDBDHM
C[C@H](OC(=O)c1nn(C)cc1[N+](=O)[O-])c1cccc(-c2nnn[n-]2)c1	ZINC000824731717	594064318	/nfs/dbraw/zinc/06/43/18/594064318.db2.gz	XUZHCPUOUFNZRA-QMMMGPOBSA-N	-1	3	343.303	1.426	20	5		EDBDHM
C[C@H](OC(=O)c1nn(C)cc1[N+](=O)[O-])c1cccc(-c2nn[n-]n2)c1	ZINC000824731717	594064320	/nfs/dbraw/zinc/06/43/20/594064320.db2.gz	XUZHCPUOUFNZRA-QMMMGPOBSA-N	-1	3	343.303	1.426	20	5		EDBDHM
Cn1c(C(=O)Oc2ccc(-c3nnn[n-]3)cc2F)ccc1[N+](=O)[O-]	ZINC000822596469	594071467	/nfs/dbraw/zinc/07/14/67/594071467.db2.gz	KYZKPMXZXAMHJT-UHFFFAOYSA-N	-1	3	332.251	1.472	20	5		EDBDHM
Cn1c(C(=O)Oc2ccc(-c3nn[n-]n3)cc2F)ccc1[N+](=O)[O-]	ZINC000822596469	594071470	/nfs/dbraw/zinc/07/14/70/594071470.db2.gz	KYZKPMXZXAMHJT-UHFFFAOYSA-N	-1	3	332.251	1.472	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccc(F)cc1-c1nnn[n-]1	ZINC000822685143	594085699	/nfs/dbraw/zinc/08/56/99/594085699.db2.gz	SWIDMNGLQVEJIW-UHFFFAOYSA-N	-1	3	331.267	1.505	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccc(F)cc1-c1nn[n-]n1	ZINC000822685143	594085700	/nfs/dbraw/zinc/08/57/00/594085700.db2.gz	SWIDMNGLQVEJIW-UHFFFAOYSA-N	-1	3	331.267	1.505	20	5		EDBDHM
COc1cc(-c2nnn[n-]2)ccc1COC(=O)c1ccc([N+](=O)[O-])o1	ZINC000826172803	594361975	/nfs/dbraw/zinc/36/19/75/594361975.db2.gz	XWJNKZMZBIOVEF-UHFFFAOYSA-N	-1	3	345.271	1.734	20	5		EDBDHM
COc1cc(-c2nn[n-]n2)ccc1COC(=O)c1ccc([N+](=O)[O-])o1	ZINC000826172803	594361978	/nfs/dbraw/zinc/36/19/78/594361978.db2.gz	XWJNKZMZBIOVEF-UHFFFAOYSA-N	-1	3	345.271	1.734	20	5		EDBDHM
CN1CCN(C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3[O-])CC2)CC1	ZINC000827445585	594672897	/nfs/dbraw/zinc/67/28/97/594672897.db2.gz	TYOGQOACIDNUFH-UHFFFAOYSA-N	-1	3	348.403	1.152	20	5		EDBDHM
O=C([O-])N1CCC[C@H]1[C@@H]1CCCCN1CCn1ccc([N+](=O)[O-])n1	ZINC000831995597	594717689	/nfs/dbraw/zinc/71/76/89/594717689.db2.gz	CRWQRPOMBKCSAT-STQMWFEESA-N	-1	3	337.380	1.788	20	5		EDBDHM
CN(C)c1cc(F)c(C(=O)[N-]c2nc3n(n2)CCCC3)cc1[N+](=O)[O-]	ZINC000837197487	595056377	/nfs/dbraw/zinc/05/63/77/595056377.db2.gz	NPPYGFGQCQYJEQ-UHFFFAOYSA-N	-1	3	348.338	1.980	20	5		EDBDHM
CN1CC[C@@H]([N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)CC1=O	ZINC000848590423	595411567	/nfs/dbraw/zinc/41/15/67/595411567.db2.gz	PEXACDIGUXPUMD-SECBINFHSA-N	-1	3	343.286	1.303	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cs1	ZINC000120133111	596279447	/nfs/dbraw/zinc/27/94/47/596279447.db2.gz	PMZGEGXOQKZPGJ-JLLWLGSASA-N	-1	3	344.414	1.892	20	5		EDBDHM
CC(C)(C)[S@](=O)CC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000119778817	596741365	/nfs/dbraw/zinc/74/13/65/596741365.db2.gz	KBCJASBZZWYXFS-IBGZPJMESA-N	-1	3	340.448	1.482	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]3OCC[C@@H]32)cs1	ZINC000119996785	596840898	/nfs/dbraw/zinc/84/08/98/596840898.db2.gz	JCTZZPQTTNFFRX-MXWKQRLJSA-N	-1	3	332.403	1.892	20	5		EDBDHM
CC(C)[C@H](CO)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000344832845	535034411	/nfs/dbraw/zinc/03/44/11/535034411.db2.gz	QVFCOPAPOVTOTQ-VIFPVBQESA-N	-1	3	336.797	1.791	20	5		EDBDHM
O=C(Nc1ccc(-n2ccnc2)cc1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000030608786	138098088	/nfs/dbraw/zinc/09/80/88/138098088.db2.gz	PXJPLIQMNAUHBV-UHFFFAOYSA-N	-1	3	325.284	1.721	20	5		EDBDHM
CC1(C)[C@H](O)C[C@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000130222437	138340422	/nfs/dbraw/zinc/34/04/22/138340422.db2.gz	JCWRHKBDNSDPFQ-GHMZBOCLSA-N	-1	3	334.781	1.686	20	5		EDBDHM
CCc1ncc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)o1	ZINC000451956261	305373925	/nfs/dbraw/zinc/37/39/25/305373925.db2.gz	GRQIXXHVBGUSDA-UHFFFAOYSA-N	-1	3	325.346	1.932	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C2CCC(O)CC2)cc1C	ZINC000097335880	219014011	/nfs/dbraw/zinc/01/40/11/219014011.db2.gz	SLCQZDWRVVKGRY-UHFFFAOYSA-N	-1	3	328.390	1.793	20	5		EDBDHM
O=C(Nc1ccc(N2CCOC2=O)cc1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000495512909	255292184	/nfs/dbraw/zinc/29/21/84/255292184.db2.gz	JSNOQZCEHVWDNM-UHFFFAOYSA-N	-1	3	344.283	1.904	20	5		EDBDHM
O=[N+]([O-])c1cc(Br)cc([N-]S(=O)(=O)N2CCC2)c1	ZINC000332422753	141179539	/nfs/dbraw/zinc/17/95/39/141179539.db2.gz	GLKUNVQTWMHUCD-UHFFFAOYSA-N	-1	3	336.167	1.720	20	5		EDBDHM
CNC(=O)[C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000345510813	143100124	/nfs/dbraw/zinc/10/01/24/143100124.db2.gz	NUPKZNSSTSLXNF-GHMZBOCLSA-N	-1	3	341.389	1.096	20	5		EDBDHM
Cn1cnc(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c1	ZINC000416525997	304328757	/nfs/dbraw/zinc/32/87/57/304328757.db2.gz	ATSFUYSPSPONKO-UHFFFAOYSA-N	-1	3	344.780	1.503	20	5		EDBDHM
COC(=O)[C@H](CC1CC1)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000416582622	304334044	/nfs/dbraw/zinc/33/40/44/304334044.db2.gz	KMHNGBMHOSRKSS-NSHDSACASA-N	-1	3	342.373	1.523	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@@H]2CCOC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000352633828	149095081	/nfs/dbraw/zinc/09/50/81/149095081.db2.gz	SIICKCOHGLFYBN-RYUDHWBXSA-N	-1	3	328.390	1.854	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H](CO)CC2CCC2)c(F)c1	ZINC000360364471	152008149	/nfs/dbraw/zinc/00/81/49/152008149.db2.gz	UWQHOUOGURVJIX-JTQLQIEISA-N	-1	3	332.353	1.563	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]c2cc(C)cn(C)c2=O)c([N+](=O)[O-])c1	ZINC000360628836	152131112	/nfs/dbraw/zinc/13/11/12/152131112.db2.gz	JDSCZKLAJYLYKV-UHFFFAOYSA-N	-1	3	337.357	1.711	20	5		EDBDHM
C/C=C\C[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OCC	ZINC000361421078	152390499	/nfs/dbraw/zinc/39/04/99/152390499.db2.gz	RBCAXDLFKJUOSD-USEMIUTHSA-N	-1	3	342.373	1.771	20	5		EDBDHM
COc1cc(CN[C@@H]2CCN(c3ccn(C)n3)C2)c([N+](=O)[O-])cc1[O-]	ZINC000367701821	154234796	/nfs/dbraw/zinc/23/47/96/154234796.db2.gz	UEHSQHSFVNSYCW-GFCCVEGCSA-N	-1	3	347.375	1.411	20	5		EDBDHM
O=[N+]([O-])c1cccc(OC[C@H](O)COc2ccc3c([O-])coc3c2)c1	ZINC000575938968	306674588	/nfs/dbraw/zinc/67/45/88/306674588.db2.gz	KXJHFDSKFPXDMH-LBPRGKRZSA-N	-1	3	345.307	1.989	20	5		EDBDHM
Cc1nc([C@H](C)[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)n[nH]1	ZINC000352537819	162238846	/nfs/dbraw/zinc/23/88/46/162238846.db2.gz	APCDYEXXZMFKIG-YFKPBYRVSA-N	-1	3	331.379	1.431	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@H](CO)C2CC2)cc1[N+](=O)[O-]	ZINC000352558788	162252512	/nfs/dbraw/zinc/25/25/12/162252512.db2.gz	DOFFHAYMLVZZOQ-SECBINFHSA-N	-1	3	348.352	1.039	20	5		EDBDHM
CC(C)[C@H](O)CC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000122038377	287376916	/nfs/dbraw/zinc/37/69/16/287376916.db2.gz	SXSVFFJFSIOYFN-LLVKDONJSA-N	-1	3	336.797	1.934	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCCN2CCCC2=O)cc1[N+](=O)[O-]	ZINC000122942604	222187186	/nfs/dbraw/zinc/18/71/86/222187186.db2.gz	AJUPTCLUYAWCRH-UHFFFAOYSA-N	-1	3	347.418	1.256	20	5		EDBDHM
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])[C@H]1OC	ZINC000274831049	268217878	/nfs/dbraw/zinc/21/78/78/268217878.db2.gz	ZEALARNRFSDPRT-IACUBPJLSA-N	-1	3	344.389	1.207	20	5		EDBDHM
CS[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])C[C@H]1N(C)C	ZINC000274873049	268227898	/nfs/dbraw/zinc/22/78/98/268227898.db2.gz	ZSDIUCUULKKOGA-DGCLKSJQSA-N	-1	3	325.390	1.418	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@H]1CCc2nccn2C1	ZINC000275351125	268327775	/nfs/dbraw/zinc/32/77/75/268327775.db2.gz	UCHOAXUKYNFRSI-LLVKDONJSA-N	-1	3	336.373	1.332	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2CCO[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000275360465	268329823	/nfs/dbraw/zinc/32/98/23/268329823.db2.gz	IPNQHFSRDRUFMP-IUCAKERBSA-N	-1	3	348.352	1.588	20	5		EDBDHM
COc1cc([N+](=O)[O-])c(C(=O)[N-]OCC(C)(C)O)cc1SC	ZINC000279127334	273282072	/nfs/dbraw/zinc/28/20/72/273282072.db2.gz	DMYWQXXKQACEHW-UHFFFAOYSA-N	-1	3	330.362	1.758	20	5		EDBDHM
C[C@@]1(C[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2)NC(=O)[N-]C1=O	ZINC000286102622	287935981	/nfs/dbraw/zinc/93/59/81/287935981.db2.gz	FKPPFPMBCDYNLW-WBMJQRKESA-N	-1	3	346.343	1.188	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C1CC1	ZINC000152385995	293155655	/nfs/dbraw/zinc/15/56/55/293155655.db2.gz	JFHQCUWTPPSYMD-LBPRGKRZSA-N	-1	3	328.390	1.915	20	5		EDBDHM
CN(C)CCn1nccc1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000295262742	303196482	/nfs/dbraw/zinc/19/64/82/303196482.db2.gz	YGBKKQCYHAUDAH-UHFFFAOYSA-N	-1	3	339.377	1.154	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](CO)CC(C)(C)C	ZINC000393482816	303852415	/nfs/dbraw/zinc/85/24/15/303852415.db2.gz	JLPQJDBRWFWBCH-SNVBAGLBSA-N	-1	3	346.405	1.679	20	5		EDBDHM
C[C@@H]1COCC[C@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000432322711	305091296	/nfs/dbraw/zinc/09/12/96/305091296.db2.gz	BZXMKYOCMVDAAT-PSASIEDQSA-N	-1	3	334.781	1.952	20	5		EDBDHM
CO[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C1(C)C	ZINC000440406422	305205868	/nfs/dbraw/zinc/20/58/68/305205868.db2.gz	XRAMKFCPJJENAY-QWHCGFSZSA-N	-1	3	328.390	1.995	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1C[C@@H](OC)C1(C)C	ZINC000440411960	305206024	/nfs/dbraw/zinc/20/60/24/305206024.db2.gz	FVAUYZVWMGSTRB-QWHCGFSZSA-N	-1	3	344.389	1.695	20	5		EDBDHM
CO[C@H]1COCC[C@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000451780992	305368609	/nfs/dbraw/zinc/36/86/09/305368609.db2.gz	WTDPKSGUKFWLET-CABZTGNLSA-N	-1	3	348.352	1.064	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)[C@H](OC)C1CC1	ZINC000451981561	305376151	/nfs/dbraw/zinc/37/61/51/305376151.db2.gz	FADKCHRJLKOJBG-XPTSAGLGSA-N	-1	3	344.389	1.695	20	5		EDBDHM
CO[C@H]([C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000451990933	305376826	/nfs/dbraw/zinc/37/68/26/305376826.db2.gz	MPKOLHZFFPKUTK-ISVAXAHUSA-N	-1	3	332.353	1.826	20	5		EDBDHM
Cc1c(C(=O)N2CCC[C@H]2c2nc(=N)n(C)[n-]2)cccc1[N+](=O)[O-]	ZINC000550114994	306150823	/nfs/dbraw/zinc/15/08/23/306150823.db2.gz	JDQVWCLHQIOIAJ-LBPRGKRZSA-N	-1	3	330.348	1.422	20	5		EDBDHM
CCOc1ncccc1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000028041816	441423506	/nfs/dbraw/zinc/42/35/06/441423506.db2.gz	KTDOJTCLRTULCZ-UHFFFAOYSA-N	-1	3	337.357	1.867	20	5		EDBDHM
C[N-]S(=O)(=O)c1ccc(CNc2c([N+](=O)[O-])c(C)nn2C)s1	ZINC000076575148	441659827	/nfs/dbraw/zinc/65/98/27/441659827.db2.gz	APFGWAPYANSBDO-UHFFFAOYSA-N	-1	3	345.406	1.218	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCOC[C@H]1CCOC1	ZINC000068942598	441872960	/nfs/dbraw/zinc/87/29/60/441872960.db2.gz	DXSKHRJRAGRYPG-LBPRGKRZSA-N	-1	3	344.389	1.235	20	5		EDBDHM
CN(C)CC[N-]S(=O)(=O)c1c(Cl)ccc([N+](=O)[O-])c1Cl	ZINC000144750638	441884908	/nfs/dbraw/zinc/88/49/08/441884908.db2.gz	GABWKIHOYHYLGX-UHFFFAOYSA-N	-1	3	342.204	1.742	20	5		EDBDHM
CN1CCC[C@H]1C(=O)N1CCN(Cc2cc([O-])ccc2[N+](=O)[O-])CC1	ZINC000093820891	441897386	/nfs/dbraw/zinc/89/73/86/441897386.db2.gz	GILWTSYPNUABHF-INIZCTEOSA-N	-1	3	348.403	1.039	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]Cc1cccc(C(N)=O)c1	ZINC000126663757	442131883	/nfs/dbraw/zinc/13/18/83/442131883.db2.gz	YQSGJTSQMVQUSF-UHFFFAOYSA-N	-1	3	349.368	1.481	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H](C)CCCO)c1	ZINC000180127364	442545540	/nfs/dbraw/zinc/54/55/40/442545540.db2.gz	NXHWGRVTQIFDCB-SECBINFHSA-N	-1	3	336.797	1.996	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H](C)c2nc[nH]n2)c1	ZINC000180271793	442570829	/nfs/dbraw/zinc/57/08/29/442570829.db2.gz	DHIICXKRIVHDKX-SSDOTTSWSA-N	-1	3	345.768	1.714	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@]2(C1)NC(=O)[N-]C2=O	ZINC000192661816	442674363	/nfs/dbraw/zinc/67/43/63/442674363.db2.gz	GWPXDSWTZVEYJT-MEDUHNTESA-N	-1	3	332.360	1.638	20	5		EDBDHM
CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000181984611	442725546	/nfs/dbraw/zinc/72/55/46/442725546.db2.gz	GURUXAMCNHGCAK-ZDUSSCGKSA-N	-1	3	337.376	1.483	20	5		EDBDHM
O=C(c1ccc([O-])cc1)N1CCN(c2ccc([N+](=O)[O-])cn2)CC1	ZINC000267920775	442787721	/nfs/dbraw/zinc/78/77/21/442787721.db2.gz	ITYOZKJKQTXIJU-UHFFFAOYSA-N	-1	3	328.328	1.658	20	5		EDBDHM
Cn1c(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)nc2cc(F)ccc21	ZINC000193651859	442764202	/nfs/dbraw/zinc/76/42/02/442764202.db2.gz	VMZBEADBLYEVCU-UHFFFAOYSA-N	-1	3	331.263	1.974	20	5		EDBDHM
CCN(C)CC[N-]S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl	ZINC000182532086	442782970	/nfs/dbraw/zinc/78/29/70/442782970.db2.gz	QNKVAXZWBOESQO-UHFFFAOYSA-N	-1	3	335.813	1.787	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)c1cnn(C)c1	ZINC000266169388	443043873	/nfs/dbraw/zinc/04/38/73/443043873.db2.gz	IWSVFMPZXUPDPH-SECBINFHSA-N	-1	3	340.361	1.376	20	5		EDBDHM
O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCN(C(=O)c2ccccc2[O-])CC1	ZINC000268689359	443078275	/nfs/dbraw/zinc/07/82/75/443078275.db2.gz	ZPVMQQWNGHHWNW-UHFFFAOYSA-N	-1	3	344.327	1.227	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H](O)C(C)(C)C	ZINC000324378179	318943356	/nfs/dbraw/zinc/94/33/56/318943356.db2.gz	VQXDKEHIYOXSIT-GFCCVEGCSA-N	-1	3	332.378	1.289	20	5		EDBDHM
C[C@H]1CN(CCCNC(=O)c2cc([O-])cc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000269149831	443213745	/nfs/dbraw/zinc/21/37/45/443213745.db2.gz	RQMIYJIJOBRLIW-RYUDHWBXSA-N	-1	3	337.376	1.530	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CCC[C@H]1O	ZINC000269307695	443275687	/nfs/dbraw/zinc/27/56/87/443275687.db2.gz	UPUZHCKIKUNIAA-MWLCHTKSSA-N	-1	3	330.362	1.043	20	5		EDBDHM
CCc1nc([N-]C(=O)c2n[nH]c(C)c2[N+](=O)[O-])sc1C(=O)OC	ZINC000269657393	443383259	/nfs/dbraw/zinc/38/32/59/443383259.db2.gz	BOLPIMDYTLHCHY-UHFFFAOYSA-N	-1	3	339.333	1.684	20	5		EDBDHM
CCN1CCN([C@H]2CCN(C(=O)c3cc([O-])cc([N+](=O)[O-])c3)C2)CC1	ZINC000272537701	443355079	/nfs/dbraw/zinc/35/50/79/443355079.db2.gz	NMMPDLQVNLPWJM-AWEZNQCLSA-N	-1	3	348.403	1.152	20	5		EDBDHM
CC[C@H](NC(=O)CC[C@@H]1NC(=O)[N-]C1=O)c1cccc([N+](=O)[O-])c1	ZINC000267254349	443394889	/nfs/dbraw/zinc/39/48/89/443394889.db2.gz	DULKDCCHMXQNGC-RYUDHWBXSA-N	-1	3	334.332	1.150	20	5		EDBDHM
CN(C)CCOC1CCN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC1	ZINC000436960828	320028363	/nfs/dbraw/zinc/02/83/63/320028363.db2.gz	FNDDWQIXYZKJIW-UHFFFAOYSA-N	-1	3	337.376	1.483	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C)c1ncnn1C	ZINC000276751268	443813454	/nfs/dbraw/zinc/81/34/54/443813454.db2.gz	SZZPXVVPWXUMQM-SECBINFHSA-N	-1	3	325.350	1.071	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCC2(OC)CCC2)c([N+](=O)[O-])c1	ZINC000292854344	443861199	/nfs/dbraw/zinc/86/11/99/443861199.db2.gz	QVTYSFIKPALQCC-UHFFFAOYSA-N	-1	3	344.389	1.841	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@]2(C)CCOC2=O)cc1C	ZINC000289453720	444148192	/nfs/dbraw/zinc/14/81/92/444148192.db2.gz	FWOQWQTYPXFOGA-ZDUSSCGKSA-N	-1	3	328.346	1.196	20	5		EDBDHM
COC(=O)CCCO[N-]C(=O)c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000296226529	444213475	/nfs/dbraw/zinc/21/34/75/444213475.db2.gz	WLBWMQDDWFOVLY-UHFFFAOYSA-N	-1	3	330.268	1.357	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCOCC(F)(F)F)c([N+](=O)[O-])c1	ZINC000337813989	444419711	/nfs/dbraw/zinc/41/97/11/444419711.db2.gz	PLVZPODWIMGGCO-UHFFFAOYSA-N	-1	3	342.295	1.760	20	5		EDBDHM
CCOC(=O)C[C@H](C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000340606407	444457834	/nfs/dbraw/zinc/45/78/34/444457834.db2.gz	PNOPATQZWFNQTM-VIFPVBQESA-N	-1	3	348.352	1.602	20	5		EDBDHM
COC(=O)[C@](C)([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000611033014	450415360	/nfs/dbraw/zinc/41/53/60/450415360.db2.gz	OPWZUTSDFSZMDD-CQSZACIVSA-N	-1	3	342.373	1.356	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@]1(C)CCO[C@@H]1C	ZINC000343994836	444715921	/nfs/dbraw/zinc/71/59/21/444715921.db2.gz	WOLGBIMCPUJPRX-NOZJJQNGSA-N	-1	3	330.362	1.449	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CCO[C@@H]2C2CC2)cc1[N+](=O)[O-]	ZINC000342546973	444739479	/nfs/dbraw/zinc/73/94/79/444739479.db2.gz	GCUDRTTXVVNOCJ-JOYOIKCWSA-N	-1	3	332.403	1.811	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC1(CO)CCC1	ZINC000344150025	444809167	/nfs/dbraw/zinc/80/91/67/444809167.db2.gz	FTLWVWGVQWPOJD-UHFFFAOYSA-N	-1	3	330.362	1.044	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@](C)(O)C(C)C	ZINC000336865057	444810641	/nfs/dbraw/zinc/81/06/41/444810641.db2.gz	IUHXVHRZISEJKK-ZDUSSCGKSA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cc1c(CNC(=O)c2cc(=O)[n-]c(N(C)C)n2)cccc1[N+](=O)[O-]	ZINC000338887858	444914035	/nfs/dbraw/zinc/91/40/35/444914035.db2.gz	NPZMHMNHSPYYBZ-UHFFFAOYSA-N	-1	3	331.332	1.395	20	5		EDBDHM
CC[C@H]1CN(Cc2cc([O-])ccc2[N+](=O)[O-])C[C@@H]1N1CCOCC1	ZINC000339024978	444993683	/nfs/dbraw/zinc/99/36/83/444993683.db2.gz	UEYSTZWASFIGNS-GUYCJALGSA-N	-1	3	335.404	1.843	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](C)C(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000342003182	445118305	/nfs/dbraw/zinc/11/83/05/445118305.db2.gz	GIFWAGYZURPZSF-SNVBAGLBSA-N	-1	3	344.389	1.912	20	5		EDBDHM
Cc1noc(CCC[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)n1	ZINC000343511381	445236317	/nfs/dbraw/zinc/23/63/17/445236317.db2.gz	TYRVRGXSFVVQKS-UHFFFAOYSA-N	-1	3	346.390	1.567	20	5		EDBDHM
CC(C)C1(NC(=O)C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000357154194	445458030	/nfs/dbraw/zinc/45/80/30/445458030.db2.gz	CSPLLODFBLIOKQ-UHFFFAOYSA-N	-1	3	341.389	1.178	20	5		EDBDHM
O=C(CNC(=O)c1cccc([O-])c1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000348982546	445464843	/nfs/dbraw/zinc/46/48/43/445464843.db2.gz	XNDGGAILQYHBNA-UHFFFAOYSA-N	-1	3	341.323	1.620	20	5		EDBDHM
O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCc2nc[n-]c(=O)c2C1	ZINC000357231512	445495100	/nfs/dbraw/zinc/49/51/00/445495100.db2.gz	NIDYBSHCOCHGEG-UHFFFAOYSA-N	-1	3	339.311	1.770	20	5		EDBDHM
CN(C)Cc1ccc(S(=O)(=O)[N-]c2ccncc2[N+](=O)[O-])cc1	ZINC000359385736	446189483	/nfs/dbraw/zinc/18/94/83/446189483.db2.gz	BTXXQVBFWGJIBA-UHFFFAOYSA-N	-1	3	336.373	1.274	20	5		EDBDHM
O=C(Nc1cc([N+](=O)[O-])ccc1[O-])c1cn[n-]c1[C@@H]1CCC[NH2+]C1	ZINC000423722323	446659868	/nfs/dbraw/zinc/65/98/68/446659868.db2.gz	FYFJBLKSFTYPGR-SECBINFHSA-N	-1	3	331.332	1.743	20	5		EDBDHM
CCN(CC[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-])C(C)C	ZINC000444168100	447085323	/nfs/dbraw/zinc/08/53/23/447085323.db2.gz	NMTSBIFBBHXELN-UHFFFAOYSA-N	-1	3	333.385	1.743	20	5		EDBDHM
O=[N+]([O-])c1ccc2[nH]c(=NCc3nnc(C(F)(F)F)[n-]3)[nH]c2c1	ZINC000447685375	447288518	/nfs/dbraw/zinc/28/85/18/447288518.db2.gz	KRAUZEJQIUFZQC-UHFFFAOYSA-N	-1	3	327.226	1.642	20	5		EDBDHM
O=[N+]([O-])c1ccc2[nH]c(=NCc3n[n-]c(C(F)(F)F)n3)[nH]c2c1	ZINC000447685375	447288523	/nfs/dbraw/zinc/28/85/23/447288523.db2.gz	KRAUZEJQIUFZQC-UHFFFAOYSA-N	-1	3	327.226	1.642	20	5		EDBDHM
O=[N+]([O-])c1ccc2[nH]c(=NCc3nc(C(F)(F)F)n[n-]3)[nH]c2c1	ZINC000447685375	447288528	/nfs/dbraw/zinc/28/85/28/447288528.db2.gz	KRAUZEJQIUFZQC-UHFFFAOYSA-N	-1	3	327.226	1.642	20	5		EDBDHM
Cc1ncc(C[N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)o1	ZINC000416540265	447640511	/nfs/dbraw/zinc/64/05/11/447640511.db2.gz	AALGQKQTQLFSNH-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
CC[C@@H](CO)[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000416474678	447615875	/nfs/dbraw/zinc/61/58/75/447615875.db2.gz	RPUKIBGMFBKEAT-QMMMGPOBSA-N	-1	3	342.295	1.663	20	5		EDBDHM
Cc1ccc([C@@H](C)NC(=O)c2[nH]c(=O)[n-]c(=O)c2N)cc1[N+](=O)[O-]	ZINC000488036876	447840388	/nfs/dbraw/zinc/84/03/88/447840388.db2.gz	BVDXNARJVPCFRZ-SSDOTTSWSA-N	-1	3	333.304	1.178	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1CS[C@H](C)C1	ZINC000591331926	448326942	/nfs/dbraw/zinc/32/69/42/448326942.db2.gz	XKMSMGHYTHDISC-RKDXNWHRSA-N	-1	3	332.403	1.776	20	5		EDBDHM
C[C@@H]1CN(CCCNc2nccc(C(=O)[O-])c2[N+](=O)[O-])CCCO1	ZINC000582912218	448378605	/nfs/dbraw/zinc/37/86/05/448378605.db2.gz	WQULIIGBAMBVQX-LLVKDONJSA-N	-1	3	338.364	1.601	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000535051907	448480779	/nfs/dbraw/zinc/48/07/79/448480779.db2.gz	GPMNBSMWFZXGJJ-JGPRNRPPSA-N	-1	3	344.389	1.838	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCS[C@H]2C)c([N+](=O)[O-])c1	ZINC000592109730	448689147	/nfs/dbraw/zinc/68/91/47/448689147.db2.gz	CHXNTEUAVUCUFD-WPRPVWTQSA-N	-1	3	332.403	1.776	20	5		EDBDHM
CCC[C@]1([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2OC)CCOC1	ZINC000586773544	448807619	/nfs/dbraw/zinc/80/76/19/448807619.db2.gz	JPNARHNLXWWGDJ-AWEZNQCLSA-N	-1	3	344.389	1.841	20	5		EDBDHM
CN(C)CCOCCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000592788993	448988276	/nfs/dbraw/zinc/98/82/76/448988276.db2.gz	TXKIYVKNTQDWAJ-UHFFFAOYSA-N	-1	3	331.756	1.262	20	5		EDBDHM
CC(C)(C)[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCO1	ZINC000593569040	449077549	/nfs/dbraw/zinc/07/75/49/449077549.db2.gz	LWEMUDXUHLMXRS-ZYHUDNBSSA-N	-1	3	343.405	1.862	20	5		EDBDHM
CC(C)O[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1(C)C	ZINC000593578326	449086453	/nfs/dbraw/zinc/08/64/53/449086453.db2.gz	SJDNTVOOCNLGNP-NWDGAFQWSA-N	-1	3	343.405	1.860	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)c1nccs1	ZINC000593549778	449340907	/nfs/dbraw/zinc/34/09/07/449340907.db2.gz	WXQMRTZZAHYENJ-SECBINFHSA-N	-1	3	328.375	1.876	20	5		EDBDHM
CCc1cnc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)s1	ZINC000593551729	449342158	/nfs/dbraw/zinc/34/21/58/449342158.db2.gz	KOXAKZNDMJSXNQ-UHFFFAOYSA-N	-1	3	328.375	1.487	20	5		EDBDHM
O=c1[n-]ccc(N2CCC[C@H](c3nnc4n3CCC4)C2)c1[N+](=O)[O-]	ZINC000596116830	449370107	/nfs/dbraw/zinc/37/01/07/449370107.db2.gz	PVCWFHHDMLJSGX-JTQLQIEISA-N	-1	3	330.348	1.617	20	5		EDBDHM
CC(C)CN1C[C@H]2CN(c3cc[n-]c(=O)c3[N+](=O)[O-])CCN2C1=O	ZINC000596214168	449419403	/nfs/dbraw/zinc/41/94/03/449419403.db2.gz	NZWHIZVLBROMAU-LLVKDONJSA-N	-1	3	335.364	1.278	20	5		EDBDHM
O=C(N1CCCC1)N1CCC[C@@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C1	ZINC000596229387	449428249	/nfs/dbraw/zinc/42/82/49/449428249.db2.gz	AGXWDSBNEMQASJ-LLVKDONJSA-N	-1	3	335.364	1.788	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-][C@H]1[C@@H]2COC[C@@H]21	ZINC000594771806	449684987	/nfs/dbraw/zinc/68/49/87/449684987.db2.gz	FRQBUVIRTKDQFH-IWIIMEHWSA-N	-1	3	335.341	1.066	20	5		EDBDHM
CO[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CCOC1	ZINC000594791465	449700635	/nfs/dbraw/zinc/70/06/35/449700635.db2.gz	NLCTYBCUSFFMEY-BXKDBHETSA-N	-1	3	348.352	1.064	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@]12C[C@@H]1CCC2	ZINC000594804892	449717790	/nfs/dbraw/zinc/71/77/90/449717790.db2.gz	RAAGJPSABHSWRA-XPTSAGLGSA-N	-1	3	340.357	1.602	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-][C@]13C[C@H]1CCC3)OCCO2	ZINC000594806203	449718780	/nfs/dbraw/zinc/71/87/80/449718780.db2.gz	ZAOUOROAWGSBOQ-YMTOWFKASA-N	-1	3	340.357	1.587	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)C2(CO)CC2)c1C	ZINC000594827614	449734360	/nfs/dbraw/zinc/73/43/60/449734360.db2.gz	RQNIPNRPIUQRDM-LLVKDONJSA-N	-1	3	328.390	1.651	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H](CO)CC1CC1	ZINC000594864709	449777411	/nfs/dbraw/zinc/77/74/11/449777411.db2.gz	LRKYHFGMSHFPDL-LBPRGKRZSA-N	-1	3	328.390	1.590	20	5		EDBDHM
O=[N+]([O-])c1cccc(CS(=O)(=O)[N-]CC(O)(C2CC2)C2CC2)c1	ZINC000594865671	449778862	/nfs/dbraw/zinc/77/88/62/449778862.db2.gz	KRKDMSAHWRFMJC-UHFFFAOYSA-N	-1	3	340.401	1.565	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2CCN(C)[C@H](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000601357789	449870830	/nfs/dbraw/zinc/87/08/30/449870830.db2.gz	WUZUTVCYYBQXEU-GHMZBOCLSA-N	-1	3	345.396	1.803	20	5		EDBDHM
COCC(C)(C)C[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F	ZINC000601419009	449935635	/nfs/dbraw/zinc/93/56/35/449935635.db2.gz	DSWDGAPQSCOAIW-UHFFFAOYSA-N	-1	3	334.369	1.993	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2CCCOCC2)c(F)cc1[N+](=O)[O-]	ZINC000601386695	449903023	/nfs/dbraw/zinc/90/30/23/449903023.db2.gz	BJLQTEIBZCDITP-SNVBAGLBSA-N	-1	3	332.353	1.890	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC[C@@H]1CCCOC1	ZINC000599364137	449919706	/nfs/dbraw/zinc/91/97/06/449919706.db2.gz	HHLKTIKQIDNKHB-LBPRGKRZSA-N	-1	3	328.390	1.998	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CO[C@@H](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000599486170	450015259	/nfs/dbraw/zinc/01/52/59/450015259.db2.gz	ZQKOFYJPGAEZLK-ZWNOBZJWSA-N	-1	3	342.373	1.449	20	5		EDBDHM
Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1cncc([O-])c1	ZINC000732391101	578708970	/nfs/dbraw/zinc/70/89/70/578708970.db2.gz	DMTUGSHUABILQI-UHFFFAOYSA-N	-1	3	331.284	1.799	20	5		EDBDHM
CN(CCc1ccncc1)c1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000736805973	579022462	/nfs/dbraw/zinc/02/24/62/579022462.db2.gz	KYMKNWLJWCKBHV-UHFFFAOYSA-N	-1	3	326.320	1.244	20	5		EDBDHM
CN(CCc1ccncc1)c1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000736805973	579022463	/nfs/dbraw/zinc/02/24/63/579022463.db2.gz	KYMKNWLJWCKBHV-UHFFFAOYSA-N	-1	3	326.320	1.244	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2nnn[n-]2)cn1	ZINC000737372930	579080460	/nfs/dbraw/zinc/08/04/60/579080460.db2.gz	MUXCRXHFXPPFHP-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2nn[n-]n2)cn1	ZINC000737372930	579080461	/nfs/dbraw/zinc/08/04/61/579080461.db2.gz	MUXCRXHFXPPFHP-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)OCc1ccc(F)cc1-c1nnn[n-]1	ZINC000737612762	579120188	/nfs/dbraw/zinc/12/01/88/579120188.db2.gz	ZQHOPHXXSKYWFU-UHFFFAOYSA-N	-1	3	346.278	1.610	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)OCc1ccc(F)cc1-c1nn[n-]n1	ZINC000737612762	579120189	/nfs/dbraw/zinc/12/01/89/579120189.db2.gz	ZQHOPHXXSKYWFU-UHFFFAOYSA-N	-1	3	346.278	1.610	20	5		EDBDHM
O=C([O-])/C=C/c1ccc(NC[C@@H]2CN3CCC[C@H]3CO2)c([N+](=O)[O-])c1	ZINC000739622359	579227451	/nfs/dbraw/zinc/22/74/51/579227451.db2.gz	AWSROUWYKRQCIT-CNPQOGTOSA-N	-1	3	347.371	1.968	20	5		EDBDHM
Cc1cc([N-]C(=O)c2cc(S(N)(=O)=O)cc([N+](=O)[O-])c2C)no1	ZINC000746102133	579571941	/nfs/dbraw/zinc/57/19/41/579571941.db2.gz	NBPZBNCTRFAXHS-UHFFFAOYSA-N	-1	3	340.317	1.099	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@@H](C)OC(=O)c2c(N)cccc2[N+](=O)[O-])on1	ZINC000778144997	580457520	/nfs/dbraw/zinc/45/75/20/580457520.db2.gz	GIHMJUQUFNHKJC-MRVPVSSYSA-N	-1	3	334.288	1.657	20	5		EDBDHM
CCO[C@@H]1COCC[C@@H]1[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000759181449	580000272	/nfs/dbraw/zinc/00/02/72/580000272.db2.gz	WMIYZIWEAJIAMK-QWHCGFSZSA-N	-1	3	344.314	1.997	20	5		EDBDHM
O=C(COC(=O)c1ccc([N+](=O)[O-])cn1)[N-]C(=O)c1cccs1	ZINC000761987840	580064901	/nfs/dbraw/zinc/06/49/01/580064901.db2.gz	ZRJFXSZDIXBGQC-UHFFFAOYSA-N	-1	3	335.297	1.165	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]CCOC[C@@H]2CCCO2)cs1	ZINC000768833903	580221721	/nfs/dbraw/zinc/22/17/21/580221721.db2.gz	OHPYCOPZWSJYGV-VIFPVBQESA-N	-1	3	336.391	1.130	20	5		EDBDHM
Cc1ncc(CC[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)s1	ZINC000768860978	580222805	/nfs/dbraw/zinc/22/28/05/580222805.db2.gz	CHQSBPHCNSGIRB-UHFFFAOYSA-N	-1	3	333.416	1.942	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CC2(O)CCC2)c1	ZINC000779897394	580501784	/nfs/dbraw/zinc/50/17/84/580501784.db2.gz	WFSYLHMWJMACCL-UHFFFAOYSA-N	-1	3	334.781	1.750	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCN2CCC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000780866594	580535760	/nfs/dbraw/zinc/53/57/60/580535760.db2.gz	SFLVSWQKCVNXOG-NSHDSACASA-N	-1	3	343.405	1.366	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]N=c2[nH]cccc2[N+](=O)[O-])c(F)c1	ZINC000790398574	580768562	/nfs/dbraw/zinc/76/85/62/580768562.db2.gz	ISHVDLBFHLMKJU-UHFFFAOYSA-N	-1	3	342.308	1.443	20	5		EDBDHM
COc1ccc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])c(F)c1	ZINC000790398574	580768563	/nfs/dbraw/zinc/76/85/63/580768563.db2.gz	ISHVDLBFHLMKJU-UHFFFAOYSA-N	-1	3	342.308	1.443	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@H](C)OC(=O)c2ccc(N)c([N+](=O)[O-])c2)on1	ZINC000010645728	590789654	/nfs/dbraw/zinc/78/96/54/590789654.db2.gz	AREVIMQQHCUIKH-QMMMGPOBSA-N	-1	3	334.288	1.657	20	5		EDBDHM
CCN1CCN(Cc2ccc([O-])c(OC)c2[N+](=O)[O-])C(C)(C)C1=O	ZINC000893712329	591059077	/nfs/dbraw/zinc/05/90/77/591059077.db2.gz	UNYOMICXAMSNGU-UHFFFAOYSA-N	-1	3	337.376	1.752	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN2CCC(C)(C)C2)c([N+](=O)[O-])s1	ZINC000908083626	592291330	/nfs/dbraw/zinc/29/13/30/592291330.db2.gz	VPJZGMCYIUPPNP-UHFFFAOYSA-N	-1	3	347.462	1.975	20	5		EDBDHM
CCn1nc(C)c(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2C)n1	ZINC000819891154	593774425	/nfs/dbraw/zinc/77/44/25/593774425.db2.gz	MFYVCNBDLADVCA-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
CC(C)(C)C(=O)NCCNc1ccc(-c2nnn[n-]2)c([N+](=O)[O-])c1	ZINC000819899362	593775583	/nfs/dbraw/zinc/77/55/83/593775583.db2.gz	SUAYQMLACCPEHW-UHFFFAOYSA-N	-1	3	333.352	1.349	20	5		EDBDHM
CC(C)n1nnnc1Sc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820220527	593800227	/nfs/dbraw/zinc/80/02/27/593800227.db2.gz	WFJAFWNPUGKAMH-UHFFFAOYSA-N	-1	3	333.337	1.494	20	5		EDBDHM
CC(C)n1nnnc1Sc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820220527	593800228	/nfs/dbraw/zinc/80/02/28/593800228.db2.gz	WFJAFWNPUGKAMH-UHFFFAOYSA-N	-1	3	333.337	1.494	20	5		EDBDHM
O=C(Nc1ccc(F)c(-c2nnn[n-]2)c1)c1ccc([N+](=O)[O-])cn1	ZINC000823337525	594188046	/nfs/dbraw/zinc/18/80/46/594188046.db2.gz	NDNKLJLYNKGFBX-UHFFFAOYSA-N	-1	3	329.251	1.561	20	5		EDBDHM
O=C(Nc1ccc(F)c(-c2nn[n-]n2)c1)c1ccc([N+](=O)[O-])cn1	ZINC000823337525	594188048	/nfs/dbraw/zinc/18/80/48/594188048.db2.gz	NDNKLJLYNKGFBX-UHFFFAOYSA-N	-1	3	329.251	1.561	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CC(OCC(F)F)C2)c(-c2nnn[n-]2)c1	ZINC000823639514	594223970	/nfs/dbraw/zinc/22/39/70/594223970.db2.gz	BSSPNGCHIDFJOQ-UHFFFAOYSA-N	-1	3	326.263	1.245	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CC(OCC(F)F)C2)c(-c2nn[n-]n2)c1	ZINC000823639514	594223971	/nfs/dbraw/zinc/22/39/71/594223971.db2.gz	BSSPNGCHIDFJOQ-UHFFFAOYSA-N	-1	3	326.263	1.245	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H]2CC2(Cl)Cl)c(-c2nnn[n-]2)c1	ZINC000823651152	594224683	/nfs/dbraw/zinc/22/46/83/594224683.db2.gz	GZUDSUGONPKZFS-YFKPBYRVSA-N	-1	3	330.135	1.776	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H]2CC2(Cl)Cl)c(-c2nn[n-]n2)c1	ZINC000823651152	594224684	/nfs/dbraw/zinc/22/46/84/594224684.db2.gz	GZUDSUGONPKZFS-YFKPBYRVSA-N	-1	3	330.135	1.776	20	5		EDBDHM
CN(C[C@@H](O)C(F)(F)F)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000825901810	594273449	/nfs/dbraw/zinc/27/34/49/594273449.db2.gz	KZLVAFXDTPULOU-SECBINFHSA-N	-1	3	332.242	1.134	20	5		EDBDHM
CN(C[C@@H](O)C(F)(F)F)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000825901810	594273452	/nfs/dbraw/zinc/27/34/52/594273452.db2.gz	KZLVAFXDTPULOU-SECBINFHSA-N	-1	3	332.242	1.134	20	5		EDBDHM
CN(C[C@@H]1CCCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825909372	594276015	/nfs/dbraw/zinc/27/60/15/594276015.db2.gz	XFANNEYEKULLLP-HZMBPMFUSA-N	-1	3	332.364	1.762	20	5		EDBDHM
CN(C[C@@H]1CCCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825909372	594276017	/nfs/dbraw/zinc/27/60/17/594276017.db2.gz	XFANNEYEKULLLP-HZMBPMFUSA-N	-1	3	332.364	1.762	20	5		EDBDHM
C[C@@]1(C(=O)[O-])CCN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000828028784	594325529	/nfs/dbraw/zinc/32/55/29/594325529.db2.gz	BQTSUXSUBVPUOW-OAHLLOKOSA-N	-1	3	331.332	1.607	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@H]2CCCn3ccnc32)c(-c2nnn[n-]2)c1	ZINC000826498808	594502697	/nfs/dbraw/zinc/50/26/97/594502697.db2.gz	KMAXPRKVYWFPJG-SNVBAGLBSA-N	-1	3	340.347	1.961	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@H]2CCCn3ccnc32)c(-c2nn[n-]n2)c1	ZINC000826498808	594502699	/nfs/dbraw/zinc/50/26/99/594502699.db2.gz	KMAXPRKVYWFPJG-SNVBAGLBSA-N	-1	3	340.347	1.961	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC[C@H]([C@H]3CCOC3)C2)c(-c2nnn[n-]2)c1	ZINC000826500676	594503237	/nfs/dbraw/zinc/50/32/37/594503237.db2.gz	HWPUFDJAXLBRGU-UWVGGRQHSA-N	-1	3	331.336	1.033	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CC[C@H]([C@H]3CCOC3)C2)c(-c2nn[n-]n2)c1	ZINC000826500676	594503239	/nfs/dbraw/zinc/50/32/39/594503239.db2.gz	HWPUFDJAXLBRGU-UWVGGRQHSA-N	-1	3	331.336	1.033	20	5		EDBDHM
COC(=O)[C@@H](CC1CC1)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000841555591	594922063	/nfs/dbraw/zinc/92/20/63/594922063.db2.gz	KAMNEMLOOGTNAQ-SECBINFHSA-N	-1	3	334.375	1.276	20	5		EDBDHM
C[C@@H](NC(=O)[O-])[C@@H]1CCCN(CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000833814102	594936176	/nfs/dbraw/zinc/93/61/76/594936176.db2.gz	RHXGADHQBOYWSB-VXGBXAGGSA-N	-1	3	338.364	1.125	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CN1C[C@H]2COCC[C@@]2(C(=O)[O-])C1	ZINC000846287313	595199096	/nfs/dbraw/zinc/19/90/96/595199096.db2.gz	VWAZFXRQIHADMQ-BLLLJJGKSA-N	-1	3	336.344	1.527	20	5		EDBDHM
Cc1c(Cc2noc([C@@H]3CCS(=O)(=O)[N-]3)n2)cccc1[N+](=O)[O-]	ZINC000844859433	595403695	/nfs/dbraw/zinc/40/36/95/595403695.db2.gz	QPLIRNAYHRKFHV-JTQLQIEISA-N	-1	3	338.345	1.241	20	5		EDBDHM
C[C@H](C[S@](C)=O)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848586572	595410212	/nfs/dbraw/zinc/41/02/12/595410212.db2.gz	MZXOEMUAXTZWNW-PJLCYMMNSA-N	-1	3	336.316	1.450	20	5		EDBDHM
CCOC(=O)[C@@]1(F)CN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC12CCC2	ZINC000853760149	595873261	/nfs/dbraw/zinc/87/32/61/595873261.db2.gz	IPMLBUFZZOTGJJ-HNNXBMFYSA-N	-1	3	339.323	1.957	20	5		EDBDHM
Cc1cc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])cnc1Cl	ZINC000125588627	596981427	/nfs/dbraw/zinc/98/14/27/596981427.db2.gz	KJIZGUMKIWVOPT-UHFFFAOYSA-N	-1	3	343.752	1.652	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]N=c2[nH]cccc2[N+](=O)[O-])cnc1Cl	ZINC000125588627	596981429	/nfs/dbraw/zinc/98/14/29/596981429.db2.gz	KJIZGUMKIWVOPT-UHFFFAOYSA-N	-1	3	343.752	1.652	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@H](n3ccnc3)C2)c(-c2nnn[n-]2)c1	ZINC000738370043	598673932	/nfs/dbraw/zinc/67/39/32/598673932.db2.gz	NDQRIAGRNBHJPL-LBPRGKRZSA-N	-1	3	340.347	1.813	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@H](n3ccnc3)C2)c(-c2nn[n-]n2)c1	ZINC000738370043	598673934	/nfs/dbraw/zinc/67/39/34/598673934.db2.gz	NDQRIAGRNBHJPL-LBPRGKRZSA-N	-1	3	340.347	1.813	20	5		EDBDHM
CC[C@H](O)CCNc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820932610	606879615	/nfs/dbraw/zinc/87/96/15/606879615.db2.gz	PMGMRJULTPXZOP-JTQLQIEISA-N	-1	3	343.347	1.896	20	5		EDBDHM
CC[C@H](O)CCNc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820932610	606879617	/nfs/dbraw/zinc/87/96/17/606879617.db2.gz	PMGMRJULTPXZOP-JTQLQIEISA-N	-1	3	343.347	1.896	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H]2CCCOC2)c1C	ZINC000178308637	232132454	/nfs/dbraw/zinc/13/24/54/232132454.db2.gz	LXRSWAKBYACDJA-LBPRGKRZSA-N	-1	3	328.390	1.917	20	5		EDBDHM
NC(=O)[C@@H]([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000130001549	138339534	/nfs/dbraw/zinc/33/95/34/138339534.db2.gz	JLTYLCAERGDWHW-AWEZNQCLSA-N	-1	3	349.368	1.241	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]Cc1nn(C)cc1Cl	ZINC000451817202	305370969	/nfs/dbraw/zinc/37/09/69/305370969.db2.gz	YUZYSFVWGIJIIX-UHFFFAOYSA-N	-1	3	344.780	1.769	20	5		EDBDHM
O=C(CNC[C@H]1CCCO1)Nc1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000423736155	252067315	/nfs/dbraw/zinc/06/73/15/252067315.db2.gz	CVICDFRLJLGXLL-SECBINFHSA-N	-1	3	329.740	1.661	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1occc1C	ZINC000490332932	255084916	/nfs/dbraw/zinc/08/49/16/255084916.db2.gz	SFSLCHUBLXIEBJ-UHFFFAOYSA-N	-1	3	326.330	1.983	20	5		EDBDHM
CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCN2C(=O)[N-]C(=O)[C@@H]2C1	ZINC000347378095	533382182	/nfs/dbraw/zinc/38/21/82/533382182.db2.gz	NEWIEFVEDVIIHW-JOHMGYAOSA-N	-1	3	330.344	1.234	20	5		EDBDHM
C[C@](O)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(F)(F)F	ZINC000270577150	140127387	/nfs/dbraw/zinc/12/73/87/140127387.db2.gz	VTMKSFWOVBQGHS-VIFPVBQESA-N	-1	3	328.268	1.186	20	5		EDBDHM
Cc1cnc(C[N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)o1	ZINC000416414251	304317055	/nfs/dbraw/zinc/31/70/55/304317055.db2.gz	HIMGOBPZOCNRTJ-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
CN(C)c1nc(-c2nc(-c3ccc([N+](=O)[O-])s3)no2)cc(=O)[n-]1	ZINC000347081473	143280270	/nfs/dbraw/zinc/28/02/70/143280270.db2.gz	ATDDYLPGAVOSPV-UHFFFAOYSA-N	-1	3	334.317	1.935	20	5		EDBDHM
C[C@@H](CC(=O)OC(C)(C)C)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000352883769	149203143	/nfs/dbraw/zinc/20/31/43/149203143.db2.gz	DJAKTXRHBAARMW-JTQLQIEISA-N	-1	3	344.389	1.993	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C)[C@@H]1CCCOC1	ZINC000355754572	150387410	/nfs/dbraw/zinc/38/74/10/150387410.db2.gz	IUHUZFPSXGGLHW-NWDGAFQWSA-N	-1	3	328.390	1.997	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC(C)(C)CCCO)c([N+](=O)[O-])c1	ZINC000357412028	151024198	/nfs/dbraw/zinc/02/41/98/151024198.db2.gz	KRYGOEGUGBVDDG-UHFFFAOYSA-N	-1	3	330.406	1.980	20	5		EDBDHM
CN1CCC[C@H]1C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000357666115	151108672	/nfs/dbraw/zinc/10/86/72/151108672.db2.gz	VTFSQJHABVMLHY-JTQLQIEISA-N	-1	3	333.797	1.621	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C(C)(C)CC(N)=O)c1C	ZINC000186710579	292291919	/nfs/dbraw/zinc/29/19/19/292291919.db2.gz	VKOCWYWQBBXVKM-UHFFFAOYSA-N	-1	3	329.378	1.144	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]Cc1ccc2cc[nH]c2n1	ZINC000352516173	162225137	/nfs/dbraw/zinc/22/51/37/162225137.db2.gz	VWEHBMSNPCWUOQ-UHFFFAOYSA-N	-1	3	332.341	1.950	20	5		EDBDHM
COc1nnc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)[n-]1	ZINC000158937860	225112933	/nfs/dbraw/zinc/11/29/33/225112933.db2.gz	ILZUGSQZVYQIEE-UHFFFAOYSA-N	-1	3	342.109	1.736	20	5		EDBDHM
COc1nc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)n[n-]1	ZINC000158937860	225112937	/nfs/dbraw/zinc/11/29/37/225112937.db2.gz	ILZUGSQZVYQIEE-UHFFFAOYSA-N	-1	3	342.109	1.736	20	5		EDBDHM
COc1n[n-]c(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)n1	ZINC000158937860	225112940	/nfs/dbraw/zinc/11/29/40/225112940.db2.gz	ILZUGSQZVYQIEE-UHFFFAOYSA-N	-1	3	342.109	1.736	20	5		EDBDHM
CCOc1cc([N+](=O)[O-])c(C(=O)[N-]c2nnc(C)n2C)cc1OC	ZINC000273152217	273029866	/nfs/dbraw/zinc/02/98/66/273029866.db2.gz	HYSTUUWDBFZOAI-UHFFFAOYSA-N	-1	3	335.320	1.691	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H](C)[C@@H]2CCOC2)cc1[N+](=O)[O-]	ZINC000275076957	273099560	/nfs/dbraw/zinc/09/95/60/273099560.db2.gz	MGNRSIBSURONRT-DTWKUNHWSA-N	-1	3	348.352	1.446	20	5		EDBDHM
Cc1noc(C(C)(C)[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])n1	ZINC000284760267	274321279	/nfs/dbraw/zinc/32/12/79/274321279.db2.gz	VETBCWIUFVTRDP-UHFFFAOYSA-N	-1	3	340.361	1.641	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@](C)(C(N)=O)C(C)C)cc1C	ZINC000285305486	274506747	/nfs/dbraw/zinc/50/67/47/274506747.db2.gz	LOELLEXESWMXGW-AWEZNQCLSA-N	-1	3	343.405	1.390	20	5		EDBDHM
CCN1CCC[C@H]([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C1	ZINC000330410329	279323011	/nfs/dbraw/zinc/32/30/11/279323011.db2.gz	JLRUFQFAEADIEO-LBPRGKRZSA-N	-1	3	327.406	1.666	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCCCC[C@@H]1O	ZINC000322853648	295255370	/nfs/dbraw/zinc/25/53/70/295255370.db2.gz	QPNQLJVUWSLIGW-NEPJUHHUSA-N	-1	3	344.389	1.575	20	5		EDBDHM
Cc1cc(C(=O)N2CCOC[C@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000376224538	301106888	/nfs/dbraw/zinc/10/68/88/301106888.db2.gz	BISSQYLGCMNXKI-RYUDHWBXSA-N	-1	3	337.332	1.024	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2CO)c1C	ZINC000452031803	301860296	/nfs/dbraw/zinc/86/02/96/301860296.db2.gz	UKEWMIJBEXMXRE-VXGBXAGGSA-N	-1	3	328.390	1.651	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCc2c[nH]nc2C1	ZINC000362823377	302049214	/nfs/dbraw/zinc/04/92/14/302049214.db2.gz	RKJVTIJGXVWPHT-LLVKDONJSA-N	-1	3	336.373	1.462	20	5		EDBDHM
CC1=C([O-])N(C)S(=O)(=O)N1Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000295396552	303213476	/nfs/dbraw/zinc/21/34/76/303213476.db2.gz	RLBZUCVMROXKDG-ZETCQYMHSA-N	-1	3	333.753	1.156	20	5		EDBDHM
CCC[C@](C)([N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C(=O)OC	ZINC000298266836	303511278	/nfs/dbraw/zinc/51/12/78/303511278.db2.gz	DTUXKJVMZFERGQ-AWEZNQCLSA-N	-1	3	344.389	1.746	20	5		EDBDHM
CSC[C@H](CCO)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000443235249	305237491	/nfs/dbraw/zinc/23/74/91/305237491.db2.gz	UDTBBDAHSHXGKL-JTQLQIEISA-N	-1	3	334.419	1.296	20	5		EDBDHM
CSCC[C@@H](CO)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000443492654	305238576	/nfs/dbraw/zinc/23/85/76/305238576.db2.gz	USUPNSJFOPYJLP-NSHDSACASA-N	-1	3	348.446	1.604	20	5		EDBDHM
Cc1n[nH]cc1-c1nnc([N-]C(=O)c2cc([N+](=O)[O-])nn2C)s1	ZINC000444470404	305249135	/nfs/dbraw/zinc/24/91/35/305249135.db2.gz	ZZYITECYVBNBOS-UHFFFAOYSA-N	-1	3	334.321	1.131	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2COCC2(C)C)c1C	ZINC000451961179	305374279	/nfs/dbraw/zinc/37/42/79/305374279.db2.gz	CUFGVADMWKUVKK-GFCCVEGCSA-N	-1	3	328.390	1.915	20	5		EDBDHM
CO[C@@H]([C@@H](C)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C1CC1	ZINC000451979664	305375941	/nfs/dbraw/zinc/37/59/41/305375941.db2.gz	CIKYLLUWENJMGC-YGRLFVJLSA-N	-1	3	328.390	1.995	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](O)C2CCC2)c1C	ZINC000452045034	305379824	/nfs/dbraw/zinc/37/98/24/305379824.db2.gz	KCYMNGFWPABWOJ-CYBMUJFWSA-N	-1	3	328.390	1.651	20	5		EDBDHM
Cc1nnc([C@H](C)[N-]S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)o1	ZINC000531839640	305969111	/nfs/dbraw/zinc/96/91/11/305969111.db2.gz	XVCDZYSXLPKJOS-VIFPVBQESA-N	-1	3	340.361	1.943	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C1CCN(C2CC2)CC1	ZINC000014102412	441171822	/nfs/dbraw/zinc/17/18/22/441171822.db2.gz	HBPWCDHDZOOGDQ-UHFFFAOYSA-N	-1	3	325.390	1.500	20	5		EDBDHM
CN(C)C(=O)C(C)(C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000108403040	441451307	/nfs/dbraw/zinc/45/13/07/441451307.db2.gz	CMVJPWCGKKKGGM-UHFFFAOYSA-N	-1	3	349.796	1.393	20	5		EDBDHM
CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000160271950	441869450	/nfs/dbraw/zinc/86/94/50/441869450.db2.gz	PJZVTPFHGRWWNJ-ZDUSSCGKSA-N	-1	3	337.376	1.483	20	5		EDBDHM
COc1ccc(C(=O)Nc2cc(-c3nccn3C)[n-]n2)cc1[N+](=O)[O-]	ZINC000119901497	441972063	/nfs/dbraw/zinc/97/20/63/441972063.db2.gz	INQKGFQHVPTNHA-UHFFFAOYSA-N	-1	3	342.315	1.979	20	5		EDBDHM
COc1ccc(C(=O)Nc2cc(-c3nccn3C)n[n-]2)cc1[N+](=O)[O-]	ZINC000119901497	441972066	/nfs/dbraw/zinc/97/20/66/441972066.db2.gz	INQKGFQHVPTNHA-UHFFFAOYSA-N	-1	3	342.315	1.979	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2C[C@H]3CC[C@@H]2O3)c(Cl)c1	ZINC000151070495	442000716	/nfs/dbraw/zinc/00/07/16/442000716.db2.gz	OFGLXSXASYHGAM-IEBDPFPHSA-N	-1	3	332.765	1.846	20	5		EDBDHM
O=C(NCCc1nc2ccc(F)cc2[nH]1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000176153879	442183310	/nfs/dbraw/zinc/18/33/10/442183310.db2.gz	NPWPLVZXQBEYNW-UHFFFAOYSA-N	-1	3	345.290	1.683	20	5		EDBDHM
CC(C)c1nc(S(=O)(=O)[N-]CCc2cccc([N+](=O)[O-])c2)c[nH]1	ZINC000154288333	442330492	/nfs/dbraw/zinc/33/04/92/442330492.db2.gz	FYTCJIJUSUCLDN-UHFFFAOYSA-N	-1	3	338.389	1.962	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]3OCC[C@@H]32)c(F)c1	ZINC000129298244	442310386	/nfs/dbraw/zinc/31/03/86/442310386.db2.gz	CZNRKGFUAFSFGU-RTXFEEFZSA-N	-1	3	344.364	1.970	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)Nc1ccccc1	ZINC000178674365	442455208	/nfs/dbraw/zinc/45/52/08/442455208.db2.gz	QIARSLINLWQYOA-UHFFFAOYSA-N	-1	3	349.368	1.653	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H](O)CC(C)(C)C	ZINC000178778371	442482443	/nfs/dbraw/zinc/48/24/43/442482443.db2.gz	BWAZBJVLZNLQPA-NSHDSACASA-N	-1	3	330.406	1.979	20	5		EDBDHM
CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C(=O)[N-]c1cnns1	ZINC000192084661	442588295	/nfs/dbraw/zinc/58/82/95/442588295.db2.gz	VXIZZSBITLVOOU-UHFFFAOYSA-N	-1	3	349.372	1.822	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)C[S@@](C)=O)cc1C	ZINC000183189296	442898851	/nfs/dbraw/zinc/89/88/51/442898851.db2.gz	BZRQCLAUWPTQRN-WVDJIFEKSA-N	-1	3	334.419	1.257	20	5		EDBDHM
Cc1nc(S(=O)(=O)[N-]Cc2cc([N+](=O)[O-])ccc2Cl)cn1C	ZINC000268220229	442904490	/nfs/dbraw/zinc/90/44/90/442904490.db2.gz	JFEAJLIMDJAVAZ-UHFFFAOYSA-N	-1	3	344.780	1.769	20	5		EDBDHM
Cn1cc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc(Cl)c1=O	ZINC000194647267	442930734	/nfs/dbraw/zinc/93/07/34/442930734.db2.gz	AGKQXZJICOUNGI-UHFFFAOYSA-N	-1	3	343.748	1.748	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H]2CCCN(C)C2)c1[N+](=O)[O-]	ZINC000189958316	443037828	/nfs/dbraw/zinc/03/78/28/443037828.db2.gz	JMRQIQZOJXKBIQ-ZDUSSCGKSA-N	-1	3	341.433	1.832	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCC[S@@](C)=O)c1[N+](=O)[O-]	ZINC000189976112	443041522	/nfs/dbraw/zinc/04/15/22/443041522.db2.gz	BFIUGMBGTCTVJS-HXUWFJFHSA-N	-1	3	334.419	1.259	20	5		EDBDHM
CC[C@@]([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])(C(N)=O)C(C)C	ZINC000184872154	443089487	/nfs/dbraw/zinc/08/94/87/443089487.db2.gz	SALOHMUXXCBZKM-AWEZNQCLSA-N	-1	3	343.405	1.304	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2C[C@@H]3OCCC[C@H]23)c(F)c1	ZINC000190619226	443149842	/nfs/dbraw/zinc/14/98/42/443149842.db2.gz	DALMSUKOJAPERL-JLLWLGSASA-N	-1	3	330.337	1.580	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)CCCCO	ZINC000398693902	319136989	/nfs/dbraw/zinc/13/69/89/319136989.db2.gz	VAMHCFDOPDSLCA-SNVBAGLBSA-N	-1	3	332.378	1.433	20	5		EDBDHM
O=C(c1ccc([O-])cc1)N1CCN(c2ncc([N+](=O)[O-])cc2F)CC1	ZINC000413051443	319260907	/nfs/dbraw/zinc/26/09/07/319260907.db2.gz	KUMWZTATSNUZMF-UHFFFAOYSA-N	-1	3	346.318	1.797	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC[C@H]1CCCCO1	ZINC000272439252	443316838	/nfs/dbraw/zinc/31/68/38/443316838.db2.gz	QRAKDXKOIMJOLP-GFCCVEGCSA-N	-1	3	344.389	1.841	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1CCCC1	ZINC000273193339	443558554	/nfs/dbraw/zinc/55/85/54/443558554.db2.gz	RMEBENMZQCYDDG-UHFFFAOYSA-N	-1	3	342.373	1.850	20	5		EDBDHM
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)[N-][C@@H]1CCN2CCCC[C@H]12	ZINC000299409146	444038882	/nfs/dbraw/zinc/03/88/82/444038882.db2.gz	OGQARSUEHCVZEI-VXGBXAGGSA-N	-1	3	343.380	1.639	20	5		EDBDHM
O=[N+]([O-])c1ccccc1OC[C@@H](O)COc1ccc2c([O-])coc2c1	ZINC000566759860	321233342	/nfs/dbraw/zinc/23/33/42/321233342.db2.gz	AKHOLXDGELVPSK-NSHDSACASA-N	-1	3	345.307	1.989	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC1CCOCC1	ZINC000299685449	444115264	/nfs/dbraw/zinc/11/52/64/444115264.db2.gz	YUHJOPNJTTXMCV-UHFFFAOYSA-N	-1	3	330.362	1.308	20	5		EDBDHM
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)[N-]O[C@@H]1CCCCO1	ZINC000299714976	444123530	/nfs/dbraw/zinc/12/35/30/444123530.db2.gz	SENRBOKININOHF-CQSZACIVSA-N	-1	3	337.332	1.289	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCC[C@@H](C)CO	ZINC000319950818	444326783	/nfs/dbraw/zinc/32/67/83/444326783.db2.gz	JJDGIPVQSMZMOG-SNVBAGLBSA-N	-1	3	332.378	1.290	20	5		EDBDHM
CC(C)OC(=O)C[C@@H](NC(=O)c1c[n-]nn1)c1ccccc1[N+](=O)[O-]	ZINC000341798487	445006443	/nfs/dbraw/zinc/00/64/43/445006443.db2.gz	XCUGEMFOZKORFI-LLVKDONJSA-N	-1	3	347.331	1.526	20	5		EDBDHM
CC(C)OC(=O)C[C@@H](NC(=O)c1cnn[n-]1)c1ccccc1[N+](=O)[O-]	ZINC000341798487	445006447	/nfs/dbraw/zinc/00/64/47/445006447.db2.gz	XCUGEMFOZKORFI-LLVKDONJSA-N	-1	3	347.331	1.526	20	5		EDBDHM
CC(C)OC(=O)C[C@@H](NC(=O)c1cn[n-]n1)c1ccccc1[N+](=O)[O-]	ZINC000341798487	445006451	/nfs/dbraw/zinc/00/64/51/445006451.db2.gz	XCUGEMFOZKORFI-LLVKDONJSA-N	-1	3	347.331	1.526	20	5		EDBDHM
O=[N+]([O-])c1ccc([O-])cc1CN[C@H]1CCCC[C@H]1n1cc(CO)nn1	ZINC000339121319	445041303	/nfs/dbraw/zinc/04/13/03/445041303.db2.gz	ZYLVZYULTOBRJL-GOEBONIOSA-N	-1	3	347.375	1.658	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCN(C3CC3)C2)cc1[N+](=O)[O-]	ZINC000343465269	445227648	/nfs/dbraw/zinc/22/76/48/445227648.db2.gz	PAECDUCNBSWFBL-SECBINFHSA-N	-1	3	331.419	1.480	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@]2(C)CCOC2)c([N+](=O)[O-])c1	ZINC000354497319	445263447	/nfs/dbraw/zinc/26/34/47/445263447.db2.gz	PKXDWHIBLRVODY-CYBMUJFWSA-N	-1	3	330.362	1.308	20	5		EDBDHM
CCCC[C@H]([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)C(=O)OC	ZINC000354703856	445345917	/nfs/dbraw/zinc/34/59/17/445345917.db2.gz	HJJBURBIQVXFNK-ZDUSSCGKSA-N	-1	3	344.389	1.746	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C)[nH]c1=O	ZINC000359662240	445363153	/nfs/dbraw/zinc/36/31/53/445363153.db2.gz	QNGIAQLRTCQTCH-UHFFFAOYSA-N	-1	3	339.329	1.813	20	5		EDBDHM
CCOc1ccc(C(=O)N2CCc3nc[n-]c(=O)c3C2)cc1[N+](=O)[O-]	ZINC000356991299	445364222	/nfs/dbraw/zinc/36/42/22/445364222.db2.gz	CFQJCWAHTMIJEN-UHFFFAOYSA-N	-1	3	344.327	1.688	20	5		EDBDHM
CC(C)n1ncnc1C[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000357234073	445496995	/nfs/dbraw/zinc/49/69/95/445496995.db2.gz	GHKJQTKYKJXUMV-UHFFFAOYSA-N	-1	3	325.350	1.246	20	5		EDBDHM
CCC[C@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(=O)OC	ZINC000358592392	445665391	/nfs/dbraw/zinc/66/53/91/445665391.db2.gz	AXODKWBGJXLMOP-NSHDSACASA-N	-1	3	344.389	1.832	20	5		EDBDHM
CN(C)CCn1cc(NC(=O)c2cc([O-])ccc2[N+](=O)[O-])ccc1=O	ZINC000354324284	446113641	/nfs/dbraw/zinc/11/36/41/446113641.db2.gz	LZFQZFKKAIOMDU-UHFFFAOYSA-N	-1	3	346.343	1.276	20	5		EDBDHM
O=C(CNC(=O)c1cccc([O-])c1)NCCc1cccc([N+](=O)[O-])c1	ZINC000354332276	446119690	/nfs/dbraw/zinc/11/96/90/446119690.db2.gz	HVBPYPZOUXBLKS-UHFFFAOYSA-N	-1	3	343.339	1.389	20	5		EDBDHM
CCc1nc2n(n1)CCC[C@@H]2NC(=O)c1cc(C)[n-]c(=O)c1[N+](=O)[O-]	ZINC000375085592	446570012	/nfs/dbraw/zinc/57/00/12/446570012.db2.gz	TZBKEJKHWTYFFP-JTQLQIEISA-N	-1	3	346.347	1.423	20	5		EDBDHM
Cc1nnc2n1CCC[C@H]2[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000368117693	446650355	/nfs/dbraw/zinc/65/03/55/446650355.db2.gz	DKCOXKLBDFULNE-GFCCVEGCSA-N	-1	3	337.361	1.308	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1C(=O)[N-]c1nncn1-c1cccnc1	ZINC000377171461	446968710	/nfs/dbraw/zinc/96/87/10/446968710.db2.gz	HJWXXPYZNLYBGG-UHFFFAOYSA-N	-1	3	340.299	1.831	20	5		EDBDHM
CSCC[C@@H](CO)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000443481057	447058034	/nfs/dbraw/zinc/05/80/34/447058034.db2.gz	DKWFCTPFHIIRPK-JTQLQIEISA-N	-1	3	334.419	1.296	20	5		EDBDHM
CC[C@H](C)[C@@](C)(O)C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000443299542	447026634	/nfs/dbraw/zinc/02/66/34/447026634.db2.gz	RQTALIIPPMEBEY-FZMZJTMJSA-N	-1	3	330.406	1.979	20	5		EDBDHM
O=C(Nc1ccc(N2CCCC2=O)cn1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000444965708	447151431	/nfs/dbraw/zinc/15/14/31/447151431.db2.gz	LSXSDGHCTBCZFF-UHFFFAOYSA-N	-1	3	343.299	1.470	20	5		EDBDHM
CC(=O)c1sc2[n-]c(Cn3cc([N+](=O)[O-])c(C)n3)nc(=O)c2c1C	ZINC000450964670	447636806	/nfs/dbraw/zinc/63/68/06/447636806.db2.gz	VWPNVFIORRBHDB-UHFFFAOYSA-N	-1	3	347.356	1.957	20	5		EDBDHM
O=C(CNC(=O)c1cccc([O-])c1)N1CCc2c1cccc2[N+](=O)[O-]	ZINC000427454699	447599749	/nfs/dbraw/zinc/59/97/49/447599749.db2.gz	CNKWRZGHLCLSDR-UHFFFAOYSA-N	-1	3	341.323	1.620	20	5		EDBDHM
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC[C@]2(N(C)C)CCSC2)n1	ZINC000576043718	447957076	/nfs/dbraw/zinc/95/70/76/447957076.db2.gz	WZOYIJPUUMVZMT-CQSZACIVSA-N	-1	3	340.405	1.846	20	5		EDBDHM
COC(=O)[C@@H](C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])CC1CC1	ZINC000576996401	448188316	/nfs/dbraw/zinc/18/83/16/448188316.db2.gz	GJJOZODBOZTMQO-LLVKDONJSA-N	-1	3	342.373	1.462	20	5		EDBDHM
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1c1nc(=N)n(C)[n-]1	ZINC000577499389	448314025	/nfs/dbraw/zinc/31/40/25/448314025.db2.gz	ZIJPNNNAOYKUJN-LBPRGKRZSA-N	-1	3	344.375	1.730	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](C)C1(OC)CCC1	ZINC000591332489	448326812	/nfs/dbraw/zinc/32/68/12/448326812.db2.gz	TUTHUFBGKZJVFI-SNVBAGLBSA-N	-1	3	344.389	1.839	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1CSC[C@@H]1C	ZINC000586773093	448807705	/nfs/dbraw/zinc/80/77/05/448807705.db2.gz	ACHAANONTOKNOS-DTWKUNHWSA-N	-1	3	332.403	1.633	20	5		EDBDHM
CCn1cc(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2OC)cn1	ZINC000586774518	448807889	/nfs/dbraw/zinc/80/78/89/448807889.db2.gz	RMXDPFGMCGRVTN-UHFFFAOYSA-N	-1	3	340.361	1.298	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)n[n-]1	ZINC000544942984	448771190	/nfs/dbraw/zinc/77/11/90/448771190.db2.gz	IDASPEOWJWRSFL-UHFFFAOYSA-N	-1	3	343.299	2.228	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)[n-]n1	ZINC000544942984	448771193	/nfs/dbraw/zinc/77/11/93/448771193.db2.gz	IDASPEOWJWRSFL-UHFFFAOYSA-N	-1	3	343.299	2.228	20	5		EDBDHM
CCc1nc(C)c(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)o1	ZINC000593601761	449101344	/nfs/dbraw/zinc/10/13/44/449101344.db2.gz	XGJFLVPRJHCAHC-UHFFFAOYSA-N	-1	3	326.334	1.327	20	5		EDBDHM
CC(C)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C1(O)CCCC1	ZINC000593604432	449103287	/nfs/dbraw/zinc/10/32/87/449103287.db2.gz	KRFXPNGQGVQHJM-UHFFFAOYSA-N	-1	3	343.405	1.599	20	5		EDBDHM
CC[C@H](C)CCNC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000597979511	449172171	/nfs/dbraw/zinc/17/21/71/449172171.db2.gz	WYAMSFJVPLKNCT-NSHDSACASA-N	-1	3	343.405	1.426	20	5		EDBDHM
CN(C[C@H](O)COCc1ccccc1)c1cc[n-]c(=O)c1[N+](=O)[O-]	ZINC000596124896	449375058	/nfs/dbraw/zinc/37/50/58/449375058.db2.gz	IHCBHAOHUPYUCF-ZDUSSCGKSA-N	-1	3	333.344	1.709	20	5		EDBDHM
O=C(NC[C@H]1CCN1C1CCCCC1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000600833243	449569619	/nfs/dbraw/zinc/56/96/19/449569619.db2.gz	CADZRVRRZCQSPN-GFCCVEGCSA-N	-1	3	334.376	1.832	20	5		EDBDHM
COCC1([N-]S(=O)(=O)c2ccc3ncccc3c2[N+](=O)[O-])CC1	ZINC000594764860	449677889	/nfs/dbraw/zinc/67/78/89/449677889.db2.gz	STKNHZZWFIUONM-UHFFFAOYSA-N	-1	3	337.357	1.600	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H](C)C(C)(C)O)cc1[N+](=O)[O-]	ZINC000614546346	449679473	/nfs/dbraw/zinc/67/94/73/449679473.db2.gz	DETKDLTXWWUFQT-SSDOTTSWSA-N	-1	3	336.341	1.180	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)C2(CO)CC2)c([N+](=O)[O-])c1	ZINC000594826662	449733907	/nfs/dbraw/zinc/73/39/07/449733907.db2.gz	HVHILOQYTLMSLD-SECBINFHSA-N	-1	3	330.362	1.043	20	5		EDBDHM
CCO[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000594829121	449736289	/nfs/dbraw/zinc/73/62/89/449736289.db2.gz	OPRRVVCPGUDXMF-HOMQSWHASA-N	-1	3	330.362	1.449	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1C[C@H](O)C12CCC2	ZINC000594865891	449780601	/nfs/dbraw/zinc/78/06/01/449780601.db2.gz	STXWSVJXQKZCAE-STQMWFEESA-N	-1	3	342.373	1.185	20	5		EDBDHM
COC(=O)[C@@](C)(CCF)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000594863773	449775755	/nfs/dbraw/zinc/77/57/55/449775755.db2.gz	RYPGAPAWCQKIQP-GFCCVEGCSA-N	-1	3	334.325	1.164	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CN(C(C)C)C[C@@H]2C)c([N+](=O)[O-])s1	ZINC000601359234	449873026	/nfs/dbraw/zinc/87/30/26/449873026.db2.gz	SCZRWBFQCIALJP-ONGXEEELSA-N	-1	3	347.462	1.972	20	5		EDBDHM
C[C@@H](O)C1([N-]S(=O)(=O)c2ccc3ncccc3c2[N+](=O)[O-])CC1	ZINC000595362270	450075405	/nfs/dbraw/zinc/07/54/05/450075405.db2.gz	XJZJIZRJRFBHKM-SECBINFHSA-N	-1	3	337.357	1.335	20	5		EDBDHM
CC[C@@H]1CCCCN1CC[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000610263703	450175390	/nfs/dbraw/zinc/17/53/90/450175390.db2.gz	BFMZIDYPDWDPSY-GFCCVEGCSA-N	-1	3	342.421	1.533	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C)C[C@@H]1CCOC1	ZINC000610740008	450317452	/nfs/dbraw/zinc/31/74/52/450317452.db2.gz	ZVGCXKIRKPMGNL-RYUDHWBXSA-N	-1	3	328.390	1.997	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1CCCC[C@@H]1O	ZINC000619485319	450486962	/nfs/dbraw/zinc/48/69/62/450486962.db2.gz	FTJASRZONHIJPE-ONGXEEELSA-N	-1	3	330.362	1.185	20	5		EDBDHM
COC(=O)CC1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000575927690	485914787	/nfs/dbraw/zinc/91/47/87/485914787.db2.gz	LREJSHIOZWWLDN-UHFFFAOYSA-N	-1	3	348.764	1.622	20	5		EDBDHM
Cn1nc([N-]c2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])cc1C1CC1	ZINC000291055148	491019403	/nfs/dbraw/zinc/01/94/03/491019403.db2.gz	FEMNDZSOBRZILF-UHFFFAOYSA-N	-1	3	337.361	1.597	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)[C@H]1CCCO1	ZINC000339448947	535806949	/nfs/dbraw/zinc/80/69/49/535806949.db2.gz	JLEYQCQGMOPOLI-VXGBXAGGSA-N	-1	3	344.389	1.839	20	5		EDBDHM
COC(=O)c1sc([N-]C(=O)c2nn(C)cc2[N+](=O)[O-])nc1C	ZINC000270793909	536873117	/nfs/dbraw/zinc/87/31/17/536873117.db2.gz	BIXLPDYKGGOUPE-UHFFFAOYSA-N	-1	3	325.306	1.132	20	5		EDBDHM
CO[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(F)(F)F	ZINC000733321619	578759406	/nfs/dbraw/zinc/75/94/06/578759406.db2.gz	IZGUIUQFBBKGIW-SECBINFHSA-N	-1	3	328.268	1.450	20	5		EDBDHM
C[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)[C@H](C)N1CCOCC1	ZINC000736139718	578956452	/nfs/dbraw/zinc/95/64/52/578956452.db2.gz	QTKOQTQGUPDQLS-MNOVXSKESA-N	-1	3	347.379	1.296	20	5		EDBDHM
C[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)[C@H](C)N1CCOCC1	ZINC000736139718	578956453	/nfs/dbraw/zinc/95/64/53/578956453.db2.gz	QTKOQTQGUPDQLS-MNOVXSKESA-N	-1	3	347.379	1.296	20	5		EDBDHM
C[C@H]1CN2CCCC[C@H]2CN1c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000736292177	578974620	/nfs/dbraw/zinc/97/46/20/578974620.db2.gz	IOBMGJIVYABFOU-AAEUAGOBSA-N	-1	3	343.391	1.838	20	5		EDBDHM
O=C(OCc1cc(=O)c([O-])co1)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000736816324	579023578	/nfs/dbraw/zinc/02/35/78/579023578.db2.gz	LUPAUQWQEZBPAO-UHFFFAOYSA-N	-1	3	349.251	1.382	20	5		EDBDHM
Cn1cc([C@@H]2CCCN2c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)cn1	ZINC000737606993	579119200	/nfs/dbraw/zinc/11/92/00/579119200.db2.gz	VJPXKBPBBKKLQH-ZDUSSCGKSA-N	-1	3	340.347	1.850	20	5		EDBDHM
Cn1cc([C@@H]2CCCN2c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)cn1	ZINC000737606993	579119202	/nfs/dbraw/zinc/11/92/02/579119202.db2.gz	VJPXKBPBBKKLQH-ZDUSSCGKSA-N	-1	3	340.347	1.850	20	5		EDBDHM
NC(=O)CC[C@H]1CCCN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000737748998	579127868	/nfs/dbraw/zinc/12/78/68/579127868.db2.gz	UQMSFFSETPIXBA-SNVBAGLBSA-N	-1	3	345.363	1.257	20	5		EDBDHM
NC(=O)CC[C@H]1CCCN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1	ZINC000737748998	579127869	/nfs/dbraw/zinc/12/78/69/579127869.db2.gz	UQMSFFSETPIXBA-SNVBAGLBSA-N	-1	3	345.363	1.257	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]CCCO[C@@H]2CCOC2)cs1	ZINC000768847947	580222328	/nfs/dbraw/zinc/22/23/28/580222328.db2.gz	HSRVIRHXBBJDDR-SECBINFHSA-N	-1	3	336.391	1.130	20	5		EDBDHM
O=C(NCc1nnc(-c2ccccc2)[nH]1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000770346543	580258575	/nfs/dbraw/zinc/25/85/75/580258575.db2.gz	QVCMZFYYHQGNRT-UHFFFAOYSA-N	-1	3	340.299	1.411	20	5		EDBDHM
O=C(OCc1cc(=O)c([O-])co1)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000778901083	580475287	/nfs/dbraw/zinc/47/52/87/580475287.db2.gz	WYTWXULXXSCLAS-UHFFFAOYSA-N	-1	3	335.224	1.339	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@H](C)C(C)(C)O)c1	ZINC000779895368	580501628	/nfs/dbraw/zinc/50/16/28/580501628.db2.gz	ANKDIRULSSLZED-QMMMGPOBSA-N	-1	3	336.797	1.994	20	5		EDBDHM
CSc1nnc(NC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)[n-]1	ZINC000781956349	580561348	/nfs/dbraw/zinc/56/13/48/580561348.db2.gz	DFUPXVJZCASHNN-SNVBAGLBSA-N	-1	3	348.344	1.567	20	5		EDBDHM
CSc1n[n-]c(NC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)n1	ZINC000781956349	580561349	/nfs/dbraw/zinc/56/13/49/580561349.db2.gz	DFUPXVJZCASHNN-SNVBAGLBSA-N	-1	3	348.344	1.567	20	5		EDBDHM
CSc1nc(NC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)n[n-]1	ZINC000781956349	580561350	/nfs/dbraw/zinc/56/13/50/580561350.db2.gz	DFUPXVJZCASHNN-SNVBAGLBSA-N	-1	3	348.344	1.567	20	5		EDBDHM
O=C1CCc2cc([N+](=O)[O-])c(N3CCc4c(=O)[n-]cnc4C3)cc2N1	ZINC000784171029	580614765	/nfs/dbraw/zinc/61/47/65/580614765.db2.gz	IKFGUQQWCZOBCD-UHFFFAOYSA-N	-1	3	341.327	1.538	20	5		EDBDHM
Cn1ncc([N+](=O)[O-])c1[N-]C(=O)c1nc(Br)ccc1F	ZINC000791722918	580800512	/nfs/dbraw/zinc/80/05/12/580800512.db2.gz	XUKYOLBLXDBOSO-UHFFFAOYSA-N	-1	3	344.100	1.877	20	5		EDBDHM
O=C([N-]O[C@H]1CCCCO1)c1cc([N+](=O)[O-])ncc1Br	ZINC000798166769	580989378	/nfs/dbraw/zinc/98/93/78/580989378.db2.gz	GNFQLJVAZRUJIQ-JTQLQIEISA-N	-1	3	346.137	1.940	20	5		EDBDHM
CCOc1cccc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])c1	ZINC000799922991	581039069	/nfs/dbraw/zinc/03/90/69/581039069.db2.gz	XZGSKJJAAAGDSP-UHFFFAOYSA-N	-1	3	338.345	1.694	20	5		EDBDHM
O=C([O-])c1cc(N2CCCN(C[C@@H]3CCCO3)CC2)ccc1[N+](=O)[O-]	ZINC000910343871	592838690	/nfs/dbraw/zinc/83/86/90/592838690.db2.gz	KGHAWHGSKOTGTQ-AWEZNQCLSA-N	-1	3	349.387	1.984	20	5		EDBDHM
C[N-]S(=O)(=O)c1ccc(CNc2ccc(N)cc2[N+](=O)[O-])s1	ZINC000804379998	593409847	/nfs/dbraw/zinc/40/98/47/593409847.db2.gz	DIXHUILSBNUDHG-UHFFFAOYSA-N	-1	3	342.402	1.759	20	5		EDBDHM
O=c1ccn(CCOc2ccc(-c3nnn[n-]3)cc2)cc1[N+](=O)[O-]	ZINC000823665748	593829073	/nfs/dbraw/zinc/82/90/73/593829073.db2.gz	URTFUTOWPNUDMA-UHFFFAOYSA-N	-1	3	328.288	1.016	20	5		EDBDHM
O=c1ccn(CCOc2ccc(-c3nn[n-]n3)cc2)cc1[N+](=O)[O-]	ZINC000823665748	593829076	/nfs/dbraw/zinc/82/90/76/593829076.db2.gz	URTFUTOWPNUDMA-UHFFFAOYSA-N	-1	3	328.288	1.016	20	5		EDBDHM
C[C@@H]1C[C@@H]1N1C[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1=O	ZINC000820674914	593859741	/nfs/dbraw/zinc/85/97/41/593859741.db2.gz	HHEJUPYRWDRMJT-KKFJDGPESA-N	-1	3	343.347	1.196	20	5		EDBDHM
C[C@@H]1C[C@@H]1N1C[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1=O	ZINC000820674914	593859743	/nfs/dbraw/zinc/85/97/43/593859743.db2.gz	HHEJUPYRWDRMJT-KKFJDGPESA-N	-1	3	343.347	1.196	20	5		EDBDHM
C[C@@H]1C[C@H]1N1C[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1=O	ZINC000820674915	593859775	/nfs/dbraw/zinc/85/97/75/593859775.db2.gz	HHEJUPYRWDRMJT-VYUIOLGVSA-N	-1	3	343.347	1.196	20	5		EDBDHM
C[C@@H]1C[C@H]1N1C[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1=O	ZINC000820674915	593859776	/nfs/dbraw/zinc/85/97/76/593859776.db2.gz	HHEJUPYRWDRMJT-VYUIOLGVSA-N	-1	3	343.347	1.196	20	5		EDBDHM
COC(=O)[C@@]1(C)CCN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000821653767	593897736	/nfs/dbraw/zinc/89/77/36/593897736.db2.gz	KKZITXWVPZOLCO-AWEZNQCLSA-N	-1	3	332.320	1.164	20	5		EDBDHM
COC(=O)[C@@]1(C)CCN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1	ZINC000821653767	593897737	/nfs/dbraw/zinc/89/77/37/593897737.db2.gz	KKZITXWVPZOLCO-AWEZNQCLSA-N	-1	3	332.320	1.164	20	5		EDBDHM
CC(C)[C@@H](O)C1(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000824198227	593953629	/nfs/dbraw/zinc/95/36/29/593953629.db2.gz	AANBZXYFCSCWRV-LLVKDONJSA-N	-1	3	333.352	1.379	20	5		EDBDHM
CC(C)[C@@H](O)C1(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000824198227	593953630	/nfs/dbraw/zinc/95/36/30/593953630.db2.gz	AANBZXYFCSCWRV-LLVKDONJSA-N	-1	3	333.352	1.379	20	5		EDBDHM
CCOC(=O)C1CCN(c2ccc(-c3nnn[n-]3)c([N+](=O)[O-])c2)CC1	ZINC000821326416	594017718	/nfs/dbraw/zinc/01/77/18/594017718.db2.gz	WXJWLTWDRIWYIE-UHFFFAOYSA-N	-1	3	346.347	1.554	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@]3(CCCOC3)C2)c(-c2nnn[n-]2)c1	ZINC000823651241	594224676	/nfs/dbraw/zinc/22/46/76/594224676.db2.gz	IYLHBUXZXRQOPH-HNNXBMFYSA-N	-1	3	345.363	1.567	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@]3(CCCOC3)C2)c(-c2nn[n-]n2)c1	ZINC000823651241	594224677	/nfs/dbraw/zinc/22/46/77/594224677.db2.gz	IYLHBUXZXRQOPH-HNNXBMFYSA-N	-1	3	345.363	1.567	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2ccc3c(c2)COC3)c(-c2nnn[n-]2)c1	ZINC000823651950	594224887	/nfs/dbraw/zinc/22/48/87/594224887.db2.gz	SPJCPCBCXIYBTO-UHFFFAOYSA-N	-1	3	339.315	1.812	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCc2ccc3c(c2)COC3)c(-c2nn[n-]n2)c1	ZINC000823651950	594224888	/nfs/dbraw/zinc/22/48/88/594224888.db2.gz	SPJCPCBCXIYBTO-UHFFFAOYSA-N	-1	3	339.315	1.812	20	5		EDBDHM
CN(Cc1ncc(Cl)n1C)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000825999202	594301426	/nfs/dbraw/zinc/30/14/26/594301426.db2.gz	QJLIWFISBMMRTA-UHFFFAOYSA-N	-1	3	348.754	1.798	20	5		EDBDHM
CN(Cc1ncc(Cl)n1C)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000825999202	594301429	/nfs/dbraw/zinc/30/14/29/594301429.db2.gz	QJLIWFISBMMRTA-UHFFFAOYSA-N	-1	3	348.754	1.798	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NCCc1ccc(CO)cc1	ZINC000826497625	594502079	/nfs/dbraw/zinc/50/20/79/594502079.db2.gz	NRTUXBPAOHUDOS-UHFFFAOYSA-N	-1	3	340.343	1.922	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NCCc1ccc(CO)cc1	ZINC000826497625	594502081	/nfs/dbraw/zinc/50/20/81/594502081.db2.gz	NRTUXBPAOHUDOS-UHFFFAOYSA-N	-1	3	340.343	1.922	20	5		EDBDHM
O=C([O-])N1CCC[C@@H]1[C@H]1CCCN(CCn2cc([N+](=O)[O-])cn2)C1	ZINC000832007142	594718879	/nfs/dbraw/zinc/71/88/79/594718879.db2.gz	XXABJTSLCNKMHT-GXTWGEPZSA-N	-1	3	337.380	1.646	20	5		EDBDHM
C[C@@]1(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])CCCC[C@H]1C(=O)[O-]	ZINC000833568128	594876120	/nfs/dbraw/zinc/87/61/20/594876120.db2.gz	DSWYEXVIZITENE-BLLLJJGKSA-N	-1	3	335.360	1.817	20	5		EDBDHM
CC(C)[C@@H](CO)O[N-]C(=O)CCCNc1ccc([N+](=O)[O-])cc1	ZINC000836902571	595012804	/nfs/dbraw/zinc/01/28/04/595012804.db2.gz	SKZKJTAXEXASBF-CQSZACIVSA-N	-1	3	325.365	1.852	20	5		EDBDHM
O=C([O-])NC[C@H]1CCCN1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000834220564	595059923	/nfs/dbraw/zinc/05/99/23/595059923.db2.gz	LYZWWSFTWHIYGT-NEPJUHHUSA-N	-1	3	339.348	1.067	20	5		EDBDHM
O=C([N-]CCCn1cncn1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848581004	595408379	/nfs/dbraw/zinc/40/83/79/595408379.db2.gz	IWRCOZAHKWZERW-UHFFFAOYSA-N	-1	3	341.274	1.364	20	5		EDBDHM
Cc1noc(CC[N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)n1	ZINC000848582666	595408988	/nfs/dbraw/zinc/40/89/88/595408988.db2.gz	ORFPTLVCROIJFC-UHFFFAOYSA-N	-1	3	342.258	1.617	20	5		EDBDHM
Cc1nnc(CC[N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)[nH]1	ZINC000848583468	595409633	/nfs/dbraw/zinc/40/96/33/595409633.db2.gz	RMHFNILGUQZOPE-UHFFFAOYSA-N	-1	3	341.274	1.352	20	5		EDBDHM
C[C@H](C[S@](C)=O)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848587442	595410529	/nfs/dbraw/zinc/41/05/29/595410529.db2.gz	UXIPAPDXRAPTDX-PJLCYMMNSA-N	-1	3	336.316	1.450	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)Cn1cccn1	ZINC000119594197	596656864	/nfs/dbraw/zinc/65/68/64/596656864.db2.gz	AKAYWKKAKKBLCS-SECBINFHSA-N	-1	3	330.391	1.467	20	5		EDBDHM
O=C(N[C@@H]1[C@H]2CN(c3cc[n-]c(=O)c3[N+](=O)[O-])C[C@H]21)c1ccsn1	ZINC001060447224	695126190	/nfs/dbraw/zinc/12/61/90/695126190.db2.gz	KZXNTAJWMCMKQI-VROVMSAKSA-N	-1	3	347.356	1.017	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2CCCOC2)c(Cl)c1	ZINC000056130074	214361255	/nfs/dbraw/zinc/36/12/55/214361255.db2.gz	NGKIZPJGOXIKNX-VIFPVBQESA-N	-1	3	334.781	1.953	20	5		EDBDHM
CCN1CCCC[C@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000111352915	220144012	/nfs/dbraw/zinc/14/40/12/220144012.db2.gz	CGCVFSCIPHGWJZ-LBPRGKRZSA-N	-1	3	345.396	1.887	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2C[C@@H](C)O[C@H]2C)c([N+](=O)[O-])c1	ZINC000416613050	251082404	/nfs/dbraw/zinc/08/24/04/251082404.db2.gz	ZQIXGFLEJONNIO-VWYCJHECSA-N	-1	3	344.389	1.695	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCNCc1cscn1	ZINC000116922524	221010914	/nfs/dbraw/zinc/01/09/14/221010914.db2.gz	UKBPDCLMAIAODB-UHFFFAOYSA-N	-1	3	342.402	1.119	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CN(C3CC3)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000331416886	141022091	/nfs/dbraw/zinc/02/20/91/141022091.db2.gz	AGCMNJRLXIBXTL-WCQYABFASA-N	-1	3	339.417	1.664	20	5		EDBDHM
CS[C@@H](CO)[C@@H](C)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000340348449	142353290	/nfs/dbraw/zinc/35/32/90/142353290.db2.gz	AIDGGZBRFHKJLA-KOLCDFICSA-N	-1	3	334.419	1.294	20	5		EDBDHM
Cc1ncc(CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(=O)[n-]1	ZINC000343790863	142889912	/nfs/dbraw/zinc/88/99/12/142889912.db2.gz	CVCGSFNFIOGIAW-SECBINFHSA-N	-1	3	331.332	1.959	20	5		EDBDHM
CCOc1cc(C(=O)[N-]c2nnc(C)n2C)c([N+](=O)[O-])cc1OC	ZINC000345400507	143086710	/nfs/dbraw/zinc/08/67/10/143086710.db2.gz	YQWJWVAAAVPEOL-UHFFFAOYSA-N	-1	3	335.320	1.691	20	5		EDBDHM
CN(C)CC(C)(C)[N-]S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000416505933	304326179	/nfs/dbraw/zinc/32/61/79/304326179.db2.gz	CYPOZJQIHGMOOT-UHFFFAOYSA-N	-1	3	335.813	1.867	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)[C@@H](O)C(C)C	ZINC000416610570	304337860	/nfs/dbraw/zinc/33/78/60/304337860.db2.gz	BGCUKYVNHQDGQN-FZMZJTMJSA-N	-1	3	346.405	1.677	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)C(=O)NC(C)C)c1C	ZINC000416625597	304338142	/nfs/dbraw/zinc/33/81/42/304338142.db2.gz	RZGXXFNIVLEFRU-LLVKDONJSA-N	-1	3	343.405	1.403	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CC12CC2	ZINC000416639458	304340108	/nfs/dbraw/zinc/34/01/08/304340108.db2.gz	ASLBEOYWGMRXLR-SECBINFHSA-N	-1	3	340.357	1.460	20	5		EDBDHM
C[C@@H]1CN(CCCNC(=O)c2cc([O-])ccc2[N+](=O)[O-])CCCO1	ZINC000355234751	150176787	/nfs/dbraw/zinc/17/67/87/150176787.db2.gz	IBAFJHKJVBZAGR-GFCCVEGCSA-N	-1	3	337.376	1.531	20	5		EDBDHM
Cc1noc([C@@H](C)[N-]S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)n1	ZINC000355619933	150340043	/nfs/dbraw/zinc/34/00/43/150340043.db2.gz	PCMMOMXODWERHO-SECBINFHSA-N	-1	3	340.361	1.509	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1nnc(C(F)(F)F)[n-]1	ZINC000360823391	152220968	/nfs/dbraw/zinc/22/09/68/152220968.db2.gz	VMJOOWCMRLAAEI-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1n[n-]c(C(F)(F)F)n1	ZINC000360823391	152220970	/nfs/dbraw/zinc/22/09/70/152220970.db2.gz	VMJOOWCMRLAAEI-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1nc(C(F)(F)F)n[n-]1	ZINC000360823391	152220971	/nfs/dbraw/zinc/22/09/71/152220971.db2.gz	VMJOOWCMRLAAEI-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H](C)C(=O)NC(C)(C)C)cc1[N+](=O)[O-]	ZINC000123311976	222254352	/nfs/dbraw/zinc/25/43/52/222254352.db2.gz	OWUSOXSGOIRWCR-ZETCQYMHSA-N	-1	3	349.434	1.546	20	5		EDBDHM
CCC[C@@H](CCO)C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000123797058	222332869	/nfs/dbraw/zinc/33/28/69/222332869.db2.gz	TYYRUCFIYLHPSL-LBPRGKRZSA-N	-1	3	330.406	1.980	20	5		EDBDHM
O=C(Nc1cccnc1N1CCOCC1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000274988060	268258007	/nfs/dbraw/zinc/25/80/07/268258007.db2.gz	YSXJDFJJTJLIQK-UHFFFAOYSA-N	-1	3	345.315	1.179	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2C[C@H](O)C2(C)C)cc1[N+](=O)[O-]	ZINC000275404598	268338129	/nfs/dbraw/zinc/33/81/29/268338129.db2.gz	ONQLPJGEWIDVFJ-QWRGUYRKSA-N	-1	3	348.352	1.180	20	5		EDBDHM
CCOC(CC[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])OCC	ZINC000276087219	268395325	/nfs/dbraw/zinc/39/53/25/268395325.db2.gz	AINKLODMTLXAST-UHFFFAOYSA-N	-1	3	346.405	1.971	20	5		EDBDHM
COCCC(C)(C)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000273649061	273048937	/nfs/dbraw/zinc/04/89/37/273048937.db2.gz	WDIWRHWDQKIMLI-UHFFFAOYSA-N	-1	3	346.405	1.944	20	5		EDBDHM
CO[C@@H](C)[C@H](C)[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000276210447	273153015	/nfs/dbraw/zinc/15/30/15/273153015.db2.gz	ZZCNVJPVADBDGS-IUCAKERBSA-N	-1	3	346.361	1.068	20	5		EDBDHM
O=C1[N-]C(=O)[C@]2(CCCN(c3ccc4ncccc4c3[N+](=O)[O-])C2)N1	ZINC000279084979	273279398	/nfs/dbraw/zinc/27/93/98/273279398.db2.gz	MZMBMJLZGIKYNE-MRXNPFEDSA-N	-1	3	341.327	1.321	20	5		EDBDHM
C[C@@H](CN1CCCCC1)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000193096190	277573329	/nfs/dbraw/zinc/57/33/29/277573329.db2.gz	XKVRMXFQRUFVKY-LBPRGKRZSA-N	-1	3	327.406	1.748	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCCCC[C@H]2O)c(F)c1	ZINC000287146952	288166768	/nfs/dbraw/zinc/16/67/68/288166768.db2.gz	CFUGNSCRRLOQEO-VXGBXAGGSA-N	-1	3	332.353	1.706	20	5		EDBDHM
C[C@@H](CN(C)C)[N-]S(=O)(=O)c1cc(Cl)c([N+](=O)[O-])cc1F	ZINC000289985212	288816112	/nfs/dbraw/zinc/81/61/12/288816112.db2.gz	VKKUFCYYXNMMGQ-ZETCQYMHSA-N	-1	3	339.776	1.616	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@](C)(OC)C1CC1	ZINC000291642466	289135719	/nfs/dbraw/zinc/13/57/19/289135719.db2.gz	HKWSOMOMMBSXBJ-CQSZACIVSA-N	-1	3	344.389	1.697	20	5		EDBDHM
Cc1nnsc1C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000292101621	289261416	/nfs/dbraw/zinc/26/14/16/289261416.db2.gz	ULTKOEJZDCQUHC-UHFFFAOYSA-N	-1	3	328.375	1.542	20	5		EDBDHM
Cc1cc(C(=O)N2CCC[C@@H](c3cc[nH]n3)C2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000367121792	301095189	/nfs/dbraw/zinc/09/51/89/301095189.db2.gz	SRVHCWVHOOQNBD-SNVBAGLBSA-N	-1	3	331.332	1.747	20	5		EDBDHM
Cc1cc(C(=O)N2CCOC[C@@H]2c2cccn2C)c([N+](=O)[O-])c(=O)[n-]1	ZINC000367160240	301105407	/nfs/dbraw/zinc/10/54/07/301105407.db2.gz	ZFSKBGGIMDBPOX-CYBMUJFWSA-N	-1	3	346.343	1.556	20	5		EDBDHM
CN(C)C(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)ccn1	ZINC000439514378	305199264	/nfs/dbraw/zinc/19/92/64/305199264.db2.gz	BXMWHHBEBVGVEN-UHFFFAOYSA-N	-1	3	331.288	1.045	20	5		EDBDHM
COC(=O)c1cc(C(=O)Nc2c(C)[nH]c(=O)[n-]c2=O)cc([N+](=O)[O-])c1	ZINC000440377003	305205016	/nfs/dbraw/zinc/20/50/16/305205016.db2.gz	RYPFEZHPWGGXPS-UHFFFAOYSA-N	-1	3	348.271	1.143	20	5		EDBDHM
CCc1nc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)n[nH]1	ZINC000451594527	305355423	/nfs/dbraw/zinc/35/54/23/305355423.db2.gz	JOGQPWBBMKTSSK-UHFFFAOYSA-N	-1	3	331.379	1.124	20	5		EDBDHM
CO[C@H]1COCC[C@@H]1C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000451771002	305368224	/nfs/dbraw/zinc/36/82/24/305368224.db2.gz	GQTPJTXYPPHVAP-YPMHNXCESA-N	-1	3	344.389	1.233	20	5		EDBDHM
CC[C@](C)(C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)OC	ZINC000451803475	305370030	/nfs/dbraw/zinc/37/00/30/305370030.db2.gz	QLLDJFIUUVKWGN-CYBMUJFWSA-N	-1	3	332.378	1.697	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C2(C3CC3)CC2)cc1[N+](=O)[O-]	ZINC000547966828	306116239	/nfs/dbraw/zinc/11/62/39/306116239.db2.gz	LSLQKZDWHMEVGA-UHFFFAOYSA-N	-1	3	330.337	1.963	20	5		EDBDHM
COc1ccc(CC(=O)Nc2c(C)[nH]c(=O)[n-]c2=O)cc1[N+](=O)[O-]	ZINC000548633324	306133226	/nfs/dbraw/zinc/13/32/26/306133226.db2.gz	WCWJYNIOXCYYGY-UHFFFAOYSA-N	-1	3	334.288	1.294	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2CCCOCC2)cc1[N+](=O)[O-]	ZINC000493739545	447383308	/nfs/dbraw/zinc/38/33/08/447383308.db2.gz	SAOAJWZADSONLR-VIFPVBQESA-N	-1	3	348.352	1.590	20	5		EDBDHM
Nc1c(C(=O)Nc2ccc(Cc3nnn[n-]3)cc2)cccc1[N+](=O)[O-]	ZINC000136983283	441737019	/nfs/dbraw/zinc/73/70/19/441737019.db2.gz	DWYJJTYQTIQRJS-UHFFFAOYSA-N	-1	3	339.315	1.533	20	5		EDBDHM
Nc1c(C(=O)Nc2ccc(Cc3nn[n-]n3)cc2)cccc1[N+](=O)[O-]	ZINC000136983283	441737025	/nfs/dbraw/zinc/73/70/25/441737025.db2.gz	DWYJJTYQTIQRJS-UHFFFAOYSA-N	-1	3	339.315	1.533	20	5		EDBDHM
CN(C)Cc1cc(CNC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)ccc1F	ZINC000115716009	441773140	/nfs/dbraw/zinc/77/31/40/441773140.db2.gz	ILVCAUBKTPHLSQ-UHFFFAOYSA-N	-1	3	348.334	1.826	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2ncc(C)s2)c([N+](=O)[O-])c1	ZINC000173638353	441809606	/nfs/dbraw/zinc/80/96/06/441809606.db2.gz	JIJCBBWKLLXJJY-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CCC[C@@H]2CCO)cc1[N+](=O)[O-]	ZINC000494545472	447446374	/nfs/dbraw/zinc/44/63/74/447446374.db2.gz	GVQCIRKZAKUNQN-ZJUUUORDSA-N	-1	3	334.419	1.794	20	5		EDBDHM
CCN(CC)[C@H](C)C[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000128582663	442276571	/nfs/dbraw/zinc/27/65/71/442276571.db2.gz	BIFWWGRDMPCLBZ-SNVBAGLBSA-N	-1	3	333.385	1.743	20	5		EDBDHM
CC1(C)C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCO1	ZINC000156349780	442471679	/nfs/dbraw/zinc/47/16/79/442471679.db2.gz	TYDSXQPQNDGEDN-SECBINFHSA-N	-1	3	332.353	1.970	20	5		EDBDHM
C[C@@H](CN1CCCCC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000193878494	442804270	/nfs/dbraw/zinc/80/42/70/442804270.db2.gz	DUDHZXZVZVDYSD-NSHDSACASA-N	-1	3	345.396	1.887	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCN2CCCC2)c(Cl)c1	ZINC000194136210	442850617	/nfs/dbraw/zinc/85/06/17/442850617.db2.gz	WRDLNXDHIFVJPR-UHFFFAOYSA-N	-1	3	333.797	1.622	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)C[S@](C)=O)cc1C	ZINC000183189279	442899102	/nfs/dbraw/zinc/89/91/02/442899102.db2.gz	BZRQCLAUWPTQRN-SBKAZYGRSA-N	-1	3	334.419	1.257	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)CC(C)(C)O	ZINC000295526095	318650053	/nfs/dbraw/zinc/65/00/53/318650053.db2.gz	PSYSCMWEWFXWMH-VIFPVBQESA-N	-1	3	332.378	1.431	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H](O)C1CCC1	ZINC000315961091	318933709	/nfs/dbraw/zinc/93/37/09/318933709.db2.gz	CZWJZAQAMSBPHD-LLVKDONJSA-N	-1	3	330.362	1.043	20	5		EDBDHM
CCOC(=O)[C@H](C)C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000269273662	443261203	/nfs/dbraw/zinc/26/12/03/443261203.db2.gz	HMSHISFIJMNJTL-SNVBAGLBSA-N	-1	3	344.389	1.689	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1CCC(OC)CC1	ZINC000416545435	319441386	/nfs/dbraw/zinc/44/13/86/319441386.db2.gz	QUHQIURMFJSXSI-UHFFFAOYSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cn1cnc(S(=O)(=O)[N-]CCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000272169359	443546636	/nfs/dbraw/zinc/54/66/36/443546636.db2.gz	PPQRDMQRCVYVSP-UHFFFAOYSA-N	-1	3	344.780	1.503	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC[C@@H]2CCCCO2)c([N+](=O)[O-])c1	ZINC000272385106	443609823	/nfs/dbraw/zinc/60/98/23/443609823.db2.gz	HJGCRMHSUHAMMT-NSHDSACASA-N	-1	3	344.389	1.841	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2CCSC2)c([N+](=O)[O-])c1	ZINC000447933530	320147715	/nfs/dbraw/zinc/14/77/15/320147715.db2.gz	XEHKMLDLXQFJED-VIFPVBQESA-N	-1	3	332.403	1.635	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)[C@H](C)OC	ZINC000276316280	443686363	/nfs/dbraw/zinc/68/63/63/443686363.db2.gz	GFWYNWHFGUIOEA-IUCAKERBSA-N	-1	3	346.361	1.083	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)Cn1ccnc1	ZINC000298523763	443791570	/nfs/dbraw/zinc/79/15/70/443791570.db2.gz	WPLIASACCNORPJ-JTQLQIEISA-N	-1	3	340.361	1.167	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1CC[C@@H](O)C1	ZINC000276745477	443810598	/nfs/dbraw/zinc/81/05/98/443810598.db2.gz	SGWZGBFLZSQDRY-MWLCHTKSSA-N	-1	3	330.362	1.043	20	5		EDBDHM
CN(Cc1ccccc1)C1CN(C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)C1	ZINC000288348706	443852153	/nfs/dbraw/zinc/85/21/53/443852153.db2.gz	KDIJLIFFFUJNKP-UHFFFAOYSA-N	-1	3	342.355	1.652	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C(C)C)C(C)(C)O	ZINC000277071332	443902139	/nfs/dbraw/zinc/90/21/39/443902139.db2.gz	PSCSVIYQZWZMHY-ZDUSSCGKSA-N	-1	3	346.405	1.677	20	5		EDBDHM
CC[C@H](C)c1nc([C@H](C)NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)n[nH]1	ZINC000277076144	443903868	/nfs/dbraw/zinc/90/38/68/443903868.db2.gz	OALUDGFEFLWORP-YUMQZZPRSA-N	-1	3	334.336	1.818	20	5		EDBDHM
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)[N-][C@H]1CCN2CCCC[C@H]12	ZINC000299409142	444038996	/nfs/dbraw/zinc/03/89/96/444038996.db2.gz	OGQARSUEHCVZEI-NWDGAFQWSA-N	-1	3	343.380	1.639	20	5		EDBDHM
CC[C@@H](C)[C@@H](C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)OC	ZINC000295321861	444178350	/nfs/dbraw/zinc/17/83/50/444178350.db2.gz	PRVVPRXTDOVIOF-ZWNOBZJWSA-N	-1	3	346.405	1.943	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1ccco1	ZINC000322558428	444340181	/nfs/dbraw/zinc/34/01/81/444340181.db2.gz	QXHXZBQPGMGABB-UHFFFAOYSA-N	-1	3	340.313	1.453	20	5		EDBDHM
CSc1nnc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)[n-]1	ZINC000340265790	444374933	/nfs/dbraw/zinc/37/49/33/444374933.db2.gz	GTMTYELRDAGKAY-UHFFFAOYSA-N	-1	3	345.344	1.873	20	5		EDBDHM
CSc1n[n-]c(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)n1	ZINC000340265790	444374939	/nfs/dbraw/zinc/37/49/39/444374939.db2.gz	GTMTYELRDAGKAY-UHFFFAOYSA-N	-1	3	345.344	1.873	20	5		EDBDHM
CSc1nc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)n[n-]1	ZINC000340265790	444374944	/nfs/dbraw/zinc/37/49/44/444374944.db2.gz	GTMTYELRDAGKAY-UHFFFAOYSA-N	-1	3	345.344	1.873	20	5		EDBDHM
CCOC(=O)C[C@@H](C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000340606404	444457816	/nfs/dbraw/zinc/45/78/16/444457816.db2.gz	PNOPATQZWFNQTM-SECBINFHSA-N	-1	3	348.352	1.602	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H](C)CN2CCCC2=O)c([N+](=O)[O-])c1	ZINC000337933586	444464353	/nfs/dbraw/zinc/46/43/53/444464353.db2.gz	ASCGPCOFGKODCU-NSHDSACASA-N	-1	3	341.389	1.192	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCC[C@]1(C)CO	ZINC000331188682	444436555	/nfs/dbraw/zinc/43/65/55/444436555.db2.gz	PQTCVIWXWWTFNB-TZMCWYRMSA-N	-1	3	328.390	1.733	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CN(C3CC3)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000342511902	444724140	/nfs/dbraw/zinc/72/41/40/444724140.db2.gz	JPHWRGOWORUUEH-GZMMTYOYSA-N	-1	3	345.446	1.726	20	5		EDBDHM
C[C@@](O)(C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C1CC1	ZINC000336847678	444801496	/nfs/dbraw/zinc/80/14/96/444801496.db2.gz	FXQFKMXPRHYTEW-GFCCVEGCSA-N	-1	3	334.781	1.688	20	5		EDBDHM
CCC[C@H]([N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C(=O)OC	ZINC000360021929	445533324	/nfs/dbraw/zinc/53/33/24/445533324.db2.gz	GHDXMIZNPMSQMV-NSHDSACASA-N	-1	3	344.389	1.832	20	5		EDBDHM
COc1c(=O)[n-]c(=O)[nH]c1C(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000357222392	445490435	/nfs/dbraw/zinc/49/04/35/445490435.db2.gz	XKEBYTOPSMEJPI-UHFFFAOYSA-N	-1	3	332.272	1.008	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000360069969	445553723	/nfs/dbraw/zinc/55/37/23/445553723.db2.gz	SAMJGZUCUXZMSC-UHFFFAOYSA-N	-1	3	330.362	1.523	20	5		EDBDHM
CN(C)c1nc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc(=O)[n-]1	ZINC000361484178	445782294	/nfs/dbraw/zinc/78/22/94/445782294.db2.gz	JAOOREAECXHSCU-UHFFFAOYSA-N	-1	3	329.316	1.359	20	5		EDBDHM
Cn1c(C(=O)Nc2ccccc2[N-]S(C)(=O)=O)ccc1[N+](=O)[O-]	ZINC000354030236	445863608	/nfs/dbraw/zinc/86/36/08/445863608.db2.gz	YRNMXVNJTQPWMJ-UHFFFAOYSA-N	-1	3	338.345	1.557	20	5		EDBDHM
Cc1nnnn1-c1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000376942222	446812199	/nfs/dbraw/zinc/81/21/99/446812199.db2.gz	ZOVMKLGDRFAIJN-UHFFFAOYSA-N	-1	3	341.287	1.232	20	5		EDBDHM
O=C(Nc1ccn(CCC(F)(F)F)n1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000425105355	447023896	/nfs/dbraw/zinc/02/38/96/447023896.db2.gz	YFKVHMGYNNVIOH-UHFFFAOYSA-N	-1	3	345.237	2.097	20	5		EDBDHM
Cc1c([N-]c2ncc([N+](=O)[O-])cc2C(N)=O)cnn1[C@@H]1CCOC1	ZINC000450799250	447580879	/nfs/dbraw/zinc/58/08/79/447580879.db2.gz	WIOZFFKSWKNMPF-SECBINFHSA-N	-1	3	332.320	1.299	20	5		EDBDHM
CCc1[nH]n(C)c2nnc([N-]C(=O)c3nn(CC)cc3[N+](=O)[O-])c1-2	ZINC000427835947	447658326	/nfs/dbraw/zinc/65/83/26/447658326.db2.gz	BHJLVIPCIIAIBE-UHFFFAOYSA-N	-1	3	332.324	1.236	20	5		EDBDHM
NC(=O)c1coc(C[N-]c2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1	ZINC000489924666	447880502	/nfs/dbraw/zinc/88/05/02/447880502.db2.gz	QGKDCCPNDXKQNO-UHFFFAOYSA-N	-1	3	329.272	1.949	20	5		EDBDHM
O=C(NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])OCC1CC1	ZINC000496998839	448109367	/nfs/dbraw/zinc/10/93/67/448109367.db2.gz	ZEZRGSVQEUJRTD-UHFFFAOYSA-N	-1	3	343.361	1.009	20	5		EDBDHM
COC1([C@@H](C(=O)[O-])N2CCN(c3ccccc3[N+](=O)[O-])CC2)CCC1	ZINC000514945358	448231149	/nfs/dbraw/zinc/23/11/49/448231149.db2.gz	WLBDFFLTZUDUTE-OAHLLOKOSA-N	-1	3	349.387	1.739	20	5		EDBDHM
O=C(/C=C\c1cncc([O-])c1)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000492522079	448232042	/nfs/dbraw/zinc/23/20/42/448232042.db2.gz	RYDGXELJIUAWIB-BHQIHCQQSA-N	-1	3	328.328	1.937	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1C[C@H](C)O[C@@H](C)C1	ZINC000536607630	448533642	/nfs/dbraw/zinc/53/36/42/448533642.db2.gz	QBVITSCBZXGLQE-UWVGGRQHSA-N	-1	3	344.389	1.838	20	5		EDBDHM
COc1ccc(CC(=O)NCc2cnc(C)[n-]c2=O)cc1[N+](=O)[O-]	ZINC000541462706	448675005	/nfs/dbraw/zinc/67/50/05/448675005.db2.gz	QDXSIPSZVKQYGW-UHFFFAOYSA-N	-1	3	332.316	1.266	20	5		EDBDHM
CC[C@H](C)C[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000592066129	448657337	/nfs/dbraw/zinc/65/73/37/448657337.db2.gz	DGVWKERZAPVSSX-QWRGUYRKSA-N	-1	3	344.389	1.851	20	5		EDBDHM
CC1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)Cc2ccccc2C1	ZINC000593568331	449076946	/nfs/dbraw/zinc/07/69/46/449076946.db2.gz	HXZYTSLOFZAQIA-UHFFFAOYSA-N	-1	3	333.369	1.826	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1occc1C	ZINC000589929701	449082378	/nfs/dbraw/zinc/08/23/78/449082378.db2.gz	VTQWGHQFDHZPAO-UHFFFAOYSA-N	-1	3	326.330	1.983	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCO[C@@H](C3CC3)C2)nc1	ZINC000593578273	449086344	/nfs/dbraw/zinc/08/63/44/449086344.db2.gz	RDPSUZABYWXOBW-CMPLNLGQSA-N	-1	3	327.362	1.226	20	5		EDBDHM
Cc1noc(C)c1CN1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596079223	449353609	/nfs/dbraw/zinc/35/36/09/449353609.db2.gz	MIXLWLMNXWAWST-UHFFFAOYSA-N	-1	3	333.348	1.622	20	5		EDBDHM
CO[C@@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)c2ccc([N+](=O)[O-])cc2[O-])C1	ZINC000600628708	449465856	/nfs/dbraw/zinc/46/58/56/449465856.db2.gz	KAGNUPNMWVBOFH-VHDGCEQUSA-N	-1	3	349.387	1.672	20	5		EDBDHM
CO[C@@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)c2ccc([O-])c([N+](=O)[O-])c2)C1	ZINC000600629353	449466264	/nfs/dbraw/zinc/46/62/64/449466264.db2.gz	RRBBHDNSNLYQMO-HZSPNIEDSA-N	-1	3	349.387	1.672	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H]1CCCN2CCCC[C@H]12	ZINC000594482712	449547648	/nfs/dbraw/zinc/54/76/48/449547648.db2.gz	CTFRSEYAWDSGIN-QWHCGFSZSA-N	-1	3	339.417	1.890	20	5		EDBDHM
Cc1nccn1CCCC[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594761335	449675695	/nfs/dbraw/zinc/67/56/95/449675695.db2.gz	WTFDLBIIBLEPRM-UHFFFAOYSA-N	-1	3	339.377	1.253	20	5		EDBDHM
CC[C@@H](O)CC[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594764101	449676860	/nfs/dbraw/zinc/67/68/60/449676860.db2.gz	GLMSFPNZRCSWCQ-SNVBAGLBSA-N	-1	3	339.373	1.582	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2CCCN(C)C2)cc1[N+](=O)[O-]	ZINC000614539169	449677323	/nfs/dbraw/zinc/67/73/23/449677323.db2.gz	ABFIJXYLJOJWKS-VIFPVBQESA-N	-1	3	347.368	1.115	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1COC(C)(C)C1	ZINC000594797445	449708633	/nfs/dbraw/zinc/70/86/33/449708633.db2.gz	WLVZCNJTIUDITO-SECBINFHSA-N	-1	3	330.362	1.449	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H](CO)C2CCC2)cc1[N+](=O)[O-]	ZINC000594804133	449716317	/nfs/dbraw/zinc/71/63/17/449716317.db2.gz	KZSGUJGQAACQMD-LLVKDONJSA-N	-1	3	348.352	1.182	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-])[C@@H](C)O	ZINC000594779000	449690941	/nfs/dbraw/zinc/69/09/41/449690941.db2.gz	HAPDUJIVFCODKJ-MWLCHTKSSA-N	-1	3	339.373	1.581	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2C[C@H](O)C23CCC3)cc1[N+](=O)[O-]	ZINC000594865537	449779289	/nfs/dbraw/zinc/77/92/89/449779289.db2.gz	UUSKESAIKKMABG-UWVGGRQHSA-N	-1	3	332.403	1.547	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2CCN(C)[C@H](C)C2)c([N+](=O)[O-])s1	ZINC000601357088	449870438	/nfs/dbraw/zinc/87/04/38/449870438.db2.gz	LFVFTXCYMKFPCK-PSASIEDQSA-N	-1	3	333.435	1.726	20	5		EDBDHM
CO[C@H](C[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F)C1CC1	ZINC000601421623	449939050	/nfs/dbraw/zinc/93/90/50/449939050.db2.gz	ILYHCENFJIIQRY-GFCCVEGCSA-N	-1	3	332.353	1.746	20	5		EDBDHM
COc1cc(C[N-]S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)on1	ZINC000595345117	450058744	/nfs/dbraw/zinc/05/87/44/450058744.db2.gz	MXSWPYYWWUQBBJ-UHFFFAOYSA-N	-1	3	341.345	1.687	20	5		EDBDHM
COc1cc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)on1	ZINC000595344864	450059307	/nfs/dbraw/zinc/05/93/07/450059307.db2.gz	JTCHQNMTSNCUTR-UHFFFAOYSA-N	-1	3	327.318	1.378	20	5		EDBDHM
C[C@@H]1CCN(CC[N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000524790482	486871839	/nfs/dbraw/zinc/87/18/39/486871839.db2.gz	UZWPFSMEUFAJKJ-SNVBAGLBSA-N	-1	3	331.369	1.354	20	5		EDBDHM
C[C@H](OC(=O)c1cncc([O-])c1)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000731914305	578683038	/nfs/dbraw/zinc/68/30/38/578683038.db2.gz	DDZGFMJNHKKNAP-VIFPVBQESA-N	-1	3	331.284	1.879	20	5		EDBDHM
C[C@@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)c1cccc(-c2nnn[n-]2)c1	ZINC000736158331	578958037	/nfs/dbraw/zinc/95/80/37/578958037.db2.gz	FTNAMKCQJBIGSZ-SECBINFHSA-N	-1	3	343.303	1.276	20	5		EDBDHM
C[C@@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)c1cccc(-c2nn[n-]n2)c1	ZINC000736158331	578958038	/nfs/dbraw/zinc/95/80/38/578958038.db2.gz	FTNAMKCQJBIGSZ-SECBINFHSA-N	-1	3	343.303	1.276	20	5		EDBDHM
CCCO[C@@H]1CCCN(c2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000736487361	578992599	/nfs/dbraw/zinc/99/25/99/578992599.db2.gz	GHZGKVIJSIOZJV-GFCCVEGCSA-N	-1	3	347.379	1.955	20	5		EDBDHM
CCCO[C@@H]1CCCN(c2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000736487361	578992600	/nfs/dbraw/zinc/99/26/00/578992600.db2.gz	GHZGKVIJSIOZJV-GFCCVEGCSA-N	-1	3	347.379	1.955	20	5		EDBDHM
Cc1nc(C)c(-c2nnn[n-]2)c(SCCn2cc([N+](=O)[O-])cn2)n1	ZINC000737470584	579095375	/nfs/dbraw/zinc/09/53/75/579095375.db2.gz	JDJSHWQPFWVFAD-UHFFFAOYSA-N	-1	3	347.364	1.171	20	5		EDBDHM
Cc1nc(C)c(-c2nn[n-]n2)c(SCCn2cc([N+](=O)[O-])cn2)n1	ZINC000737470584	579095376	/nfs/dbraw/zinc/09/53/76/579095376.db2.gz	JDJSHWQPFWVFAD-UHFFFAOYSA-N	-1	3	347.364	1.171	20	5		EDBDHM
NC(=O)[C@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C1	ZINC000737742820	579127379	/nfs/dbraw/zinc/12/73/79/579127379.db2.gz	HKDIXYNFZQIXBH-DTWKUNHWSA-N	-1	3	331.336	1.231	20	5		EDBDHM
NC(=O)[C@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C1	ZINC000737742820	579127380	/nfs/dbraw/zinc/12/73/80/579127380.db2.gz	HKDIXYNFZQIXBH-DTWKUNHWSA-N	-1	3	331.336	1.231	20	5		EDBDHM
C[C@H](C1CC1)n1[n-]ccc1=NC(=O)COC(=O)c1ccc([N+](=O)[O-])o1	ZINC000744473728	579511914	/nfs/dbraw/zinc/51/19/14/579511914.db2.gz	JZOGAQPXFBVVIJ-SECBINFHSA-N	-1	3	348.315	1.573	20	5		EDBDHM
COC(=O)C[C@]1(NCc2cc(Cl)cc([N+](=O)[O-])c2[O-])CCOC1	ZINC000766465679	580167567	/nfs/dbraw/zinc/16/75/67/580167567.db2.gz	CEWAPSMTAXRJNF-CQSZACIVSA-N	-1	3	344.751	1.766	20	5		EDBDHM
COC(=O)N1CCC[C@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000768836449	580221867	/nfs/dbraw/zinc/22/18/67/580221867.db2.gz	BGAXOPXINWQYNR-QMMMGPOBSA-N	-1	3	349.390	1.165	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@H]2CCO[C@@]3(CCOC3)C2)cs1	ZINC000768882560	580223394	/nfs/dbraw/zinc/22/33/94/580223394.db2.gz	PIBCSCKGXUYSIN-CABZTGNLSA-N	-1	3	348.402	1.273	20	5		EDBDHM
CCO[C@H]1COCC[C@@H]1[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768890996	580223632	/nfs/dbraw/zinc/22/36/32/580223632.db2.gz	KOXLIJAGZZKXQP-UWVGGRQHSA-N	-1	3	336.391	1.129	20	5		EDBDHM
COCCOc1cc([N+](=O)[O-])c(C(=O)[N-]c2ccon2)cc1OC	ZINC000771480881	580287709	/nfs/dbraw/zinc/28/77/09/580287709.db2.gz	WROXQKHPEBRNFZ-UHFFFAOYSA-N	-1	3	337.288	1.869	20	5		EDBDHM
CCOC(=O)[C@@H](C)[N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1	ZINC000779879858	580500789	/nfs/dbraw/zinc/50/07/89/580500789.db2.gz	QANOQCWMWKNKSG-SNVBAGLBSA-N	-1	3	330.362	1.008	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]CC1(C)OCCCO1	ZINC000795187965	580915320	/nfs/dbraw/zinc/91/53/20/580915320.db2.gz	AJDZWMUDKVXCIY-UHFFFAOYSA-N	-1	3	346.361	1.035	20	5		EDBDHM
COc1c([O-])ccc(CN2CCN(C(=O)N(C)C)CC2)c1[N+](=O)[O-]	ZINC000891609047	591148458	/nfs/dbraw/zinc/14/84/58/591148458.db2.gz	JQHDEPZJVVUFKW-UHFFFAOYSA-N	-1	3	338.364	1.108	20	5		EDBDHM
COC[C@@]1(C)CN(Cc2ccc([O-])c(OC)c2[N+](=O)[O-])CCO1	ZINC000895673841	591244452	/nfs/dbraw/zinc/24/44/52/591244452.db2.gz	SKYNVBIYNNPTMO-OAHLLOKOSA-N	-1	3	326.349	1.546	20	5		EDBDHM
O=C([N-]CCO[C@H]1CCOC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000902980794	592092357	/nfs/dbraw/zinc/09/23/57/592092357.db2.gz	SOGDNAAIDLVURB-LBPRGKRZSA-N	-1	3	346.286	1.488	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2COC[C@@H]2C2CC2)c1C	ZINC000908409586	592484329	/nfs/dbraw/zinc/48/43/29/592484329.db2.gz	LIMQMUMJOWBBRQ-OLZOCXBDSA-N	-1	3	340.401	1.915	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2COC[C@@H]2C2CC2)cc1C	ZINC000908411509	592485560	/nfs/dbraw/zinc/48/55/60/592485560.db2.gz	NPKBTCODHRKKQL-CHWSQXEVSA-N	-1	3	340.401	1.915	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H]2C[C@@H](C)OC2=O)c1	ZINC000841521599	593153741	/nfs/dbraw/zinc/15/37/41/593153741.db2.gz	FOZIVFOLLMWLCD-SFYZADRCSA-N	-1	3	348.764	1.539	20	5		EDBDHM
CC(C)(C)OC(=O)CCNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000819928458	593777748	/nfs/dbraw/zinc/77/77/48/593777748.db2.gz	PVESLKMRFVUEQP-UHFFFAOYSA-N	-1	3	334.336	1.919	20	5		EDBDHM
CC(C)(C)OC(=O)CCNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000819928458	593777749	/nfs/dbraw/zinc/77/77/49/593777749.db2.gz	PVESLKMRFVUEQP-UHFFFAOYSA-N	-1	3	334.336	1.919	20	5		EDBDHM
C[C@H](CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)c1ccncc1	ZINC000820280707	593805733	/nfs/dbraw/zinc/80/57/33/593805733.db2.gz	NADDOLHYENIDJH-SECBINFHSA-N	-1	3	326.320	1.781	20	5		EDBDHM
C[C@H](CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)c1ccncc1	ZINC000820280707	593805734	/nfs/dbraw/zinc/80/57/34/593805734.db2.gz	NADDOLHYENIDJH-SECBINFHSA-N	-1	3	326.320	1.781	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@]1(C)CC(C)(C)OC1=O	ZINC000820735252	593875778	/nfs/dbraw/zinc/87/57/78/593875778.db2.gz	PTTCWPKIOWFQQG-CQSZACIVSA-N	-1	3	342.373	1.666	20	5		EDBDHM
COC(=O)[C@@]1(C)CCN(c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C1	ZINC000821654247	593898538	/nfs/dbraw/zinc/89/85/38/593898538.db2.gz	YAPCAZBQWNGLNS-AWEZNQCLSA-N	-1	3	332.320	1.164	20	5		EDBDHM
COC(=O)[C@@]1(C)CCN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C1	ZINC000821654247	593898539	/nfs/dbraw/zinc/89/85/39/593898539.db2.gz	YAPCAZBQWNGLNS-AWEZNQCLSA-N	-1	3	332.320	1.164	20	5		EDBDHM
CCC(=O)N1CC[C@@H](Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000820838274	593902810	/nfs/dbraw/zinc/90/28/10/593902810.db2.gz	RCQCNGZGHMPUML-SNVBAGLBSA-N	-1	3	331.336	1.198	20	5		EDBDHM
CCC(=O)N1CC[C@@H](Nc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1	ZINC000820838274	593902812	/nfs/dbraw/zinc/90/28/12/593902812.db2.gz	RCQCNGZGHMPUML-SNVBAGLBSA-N	-1	3	331.336	1.198	20	5		EDBDHM
COC(=O)c1cc(Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)cn1C	ZINC000821668125	593904527	/nfs/dbraw/zinc/90/45/27/593904527.db2.gz	PTLSUAARZOULRR-UHFFFAOYSA-N	-1	3	343.303	1.644	20	5		EDBDHM
COC(=O)c1cc(Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)cn1C	ZINC000821668125	593904529	/nfs/dbraw/zinc/90/45/29/593904529.db2.gz	PTLSUAARZOULRR-UHFFFAOYSA-N	-1	3	343.303	1.644	20	5		EDBDHM
COc1ccc(CNc2ccc(-c3nnn[n-]3)c([N+](=O)[O-])c2)cn1	ZINC000821821479	593948523	/nfs/dbraw/zinc/94/85/23/593948523.db2.gz	HUPYAAJUCFQNEE-UHFFFAOYSA-N	-1	3	327.304	1.791	20	5		EDBDHM
C[C@H](CO)N(C)c1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000824442073	594013154	/nfs/dbraw/zinc/01/31/54/594013154.db2.gz	UBYLOGBDEOGRNM-MRVPVSSYSA-N	-1	3	329.320	1.140	20	5		EDBDHM
C[C@H](CO)N(C)c1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000824442073	594013157	/nfs/dbraw/zinc/01/31/57/594013157.db2.gz	UBYLOGBDEOGRNM-MRVPVSSYSA-N	-1	3	329.320	1.140	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(-c2nnn[n-]2)cn1C	ZINC000822271268	594022013	/nfs/dbraw/zinc/02/20/13/594022013.db2.gz	UJCQCEWORBDHDK-UHFFFAOYSA-N	-1	3	327.304	1.674	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(-c2nn[n-]n2)cn1C	ZINC000822271268	594022016	/nfs/dbraw/zinc/02/20/16/594022016.db2.gz	UJCQCEWORBDHDK-UHFFFAOYSA-N	-1	3	327.304	1.674	20	5		EDBDHM
CCO[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)C12CCC2	ZINC000821361430	594027810	/nfs/dbraw/zinc/02/78/10/594027810.db2.gz	USWIONWONJYILS-RYUDHWBXSA-N	-1	3	345.363	1.930	20	5		EDBDHM
CCO[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)C12CCC2	ZINC000821361430	594027813	/nfs/dbraw/zinc/02/78/13/594027813.db2.gz	USWIONWONJYILS-RYUDHWBXSA-N	-1	3	345.363	1.930	20	5		EDBDHM
Cn1cc(-c2nnn[n-]2)cc1C(=O)OCc1ccc([N+](=O)[O-])cc1	ZINC000822665340	594081831	/nfs/dbraw/zinc/08/18/31/594081831.db2.gz	OKJUGNMWYYWVAF-UHFFFAOYSA-N	-1	3	328.288	1.470	20	5		EDBDHM
Cn1cc(-c2nn[n-]n2)cc1C(=O)OCc1ccc([N+](=O)[O-])cc1	ZINC000822665340	594081833	/nfs/dbraw/zinc/08/18/33/594081833.db2.gz	OKJUGNMWYYWVAF-UHFFFAOYSA-N	-1	3	328.288	1.470	20	5		EDBDHM
NC(=O)[C@H]1CCCCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000822860083	594112676	/nfs/dbraw/zinc/11/26/76/594112676.db2.gz	MXDVHTRUSGIXQE-JQWIXIFHSA-N	-1	3	345.363	1.621	20	5		EDBDHM
NC(=O)[C@H]1CCCCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000822860083	594112677	/nfs/dbraw/zinc/11/26/77/594112677.db2.gz	MXDVHTRUSGIXQE-JQWIXIFHSA-N	-1	3	345.363	1.621	20	5		EDBDHM
CCC1(CO)CCN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1	ZINC000825171393	594141418	/nfs/dbraw/zinc/14/14/18/594141418.db2.gz	OTOHVVHYUDDHDZ-UHFFFAOYSA-N	-1	3	332.364	1.764	20	5		EDBDHM
CCC1(CO)CCN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1	ZINC000825171393	594141419	/nfs/dbraw/zinc/14/14/19/594141419.db2.gz	OTOHVVHYUDDHDZ-UHFFFAOYSA-N	-1	3	332.364	1.764	20	5		EDBDHM
Cc1ccc([C@H](C)NCCN2CCN(C(=O)[O-])CC2)cc1[N+](=O)[O-]	ZINC000830256952	594363089	/nfs/dbraw/zinc/36/30/89/594363089.db2.gz	ODHBYHBXIGRMGK-ZDUSSCGKSA-N	-1	3	336.392	1.849	20	5		EDBDHM
O=C(NCCc1cccc([N+](=O)[O-])c1)c1sccc1-c1nnn[n-]1	ZINC000826439646	594477455	/nfs/dbraw/zinc/47/74/55/594477455.db2.gz	DBQSZKAUFOHDSV-UHFFFAOYSA-N	-1	3	344.356	1.809	20	5		EDBDHM
O=C(NCCc1cccc([N+](=O)[O-])c1)c1sccc1-c1nn[n-]n1	ZINC000826439646	594477458	/nfs/dbraw/zinc/47/74/58/594477458.db2.gz	DBQSZKAUFOHDSV-UHFFFAOYSA-N	-1	3	344.356	1.809	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCCCN2CCOCC2)cc1-c1nnn[n-]1	ZINC000826498714	594502670	/nfs/dbraw/zinc/50/26/70/594502670.db2.gz	GRXDOAVYMCRCHY-UHFFFAOYSA-N	-1	3	347.379	1.299	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCCCN2CCOCC2)cc1-c1nn[n-]n1	ZINC000826498714	594502672	/nfs/dbraw/zinc/50/26/72/594502672.db2.gz	GRXDOAVYMCRCHY-UHFFFAOYSA-N	-1	3	347.379	1.299	20	5		EDBDHM
O=[N+]([O-])c1ccccc1NCCNc1cnccc1-c1nnn[n-]1	ZINC000826501044	594503188	/nfs/dbraw/zinc/50/31/88/594503188.db2.gz	XFAVEBBNEXIPRU-UHFFFAOYSA-N	-1	3	326.320	1.694	20	5		EDBDHM
O=[N+]([O-])c1ccccc1NCCNc1cnccc1-c1nn[n-]n1	ZINC000826501044	594503190	/nfs/dbraw/zinc/50/31/90/594503190.db2.gz	XFAVEBBNEXIPRU-UHFFFAOYSA-N	-1	3	326.320	1.694	20	5		EDBDHM
O=C([N-]c1nc2n(n1)CCCC2)c1cc2nsnc2c([N+](=O)[O-])c1	ZINC000837198628	595057040	/nfs/dbraw/zinc/05/70/40/595057040.db2.gz	VTUJURSSHLPPQO-UHFFFAOYSA-N	-1	3	345.344	1.780	20	5		EDBDHM
COCC[C@@H](CO)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848589605	595411035	/nfs/dbraw/zinc/41/10/35/595411035.db2.gz	GFLVQJZYONBFBQ-VIFPVBQESA-N	-1	3	334.275	1.080	20	5		EDBDHM
C[C@H]1OCC[C@]1(O)C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848592056	595411857	/nfs/dbraw/zinc/41/18/57/595411857.db2.gz	WGAQIGSOJUMXCV-RNCFNFMXSA-N	-1	3	346.286	1.223	20	5		EDBDHM
CON(C)CC[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl	ZINC000849408317	595522249	/nfs/dbraw/zinc/52/22/49/595522249.db2.gz	FAXBNMKJDVHKLJ-UHFFFAOYSA-N	-1	3	337.785	1.328	20	5		EDBDHM
O=C([N-][C@H](CO)C1CCC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853820863	595891091	/nfs/dbraw/zinc/89/10/91/595891091.db2.gz	UKWLELFQWPLLBC-GFCCVEGCSA-N	-1	3	330.287	1.844	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCOc2cccnc2)c(F)c1	ZINC000114497942	596042598	/nfs/dbraw/zinc/04/25/98/596042598.db2.gz	RJSPSGCUUQWOQU-UHFFFAOYSA-N	-1	3	341.320	1.486	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](C)N2CCCC2)cc1F	ZINC000866490410	596892790	/nfs/dbraw/zinc/89/27/90/596892790.db2.gz	OQZQBNDSKAINGT-LLVKDONJSA-N	-1	3	345.396	1.805	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCc2ccc(O)cc2)c(-c2nnn[n-]2)c1	ZINC000738374998	598499832	/nfs/dbraw/zinc/49/98/32/598499832.db2.gz	XFVVJXVGZXDCSP-UHFFFAOYSA-N	-1	3	327.304	1.530	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCc2ccc(O)cc2)c(-c2nn[n-]n2)c1	ZINC000738374998	598499834	/nfs/dbraw/zinc/49/98/34/598499834.db2.gz	XFVVJXVGZXDCSP-UHFFFAOYSA-N	-1	3	327.304	1.530	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)Cn1cccn1	ZINC000056072718	138149744	/nfs/dbraw/zinc/14/97/44/138149744.db2.gz	UWCLFXVEAJLRHE-JTQLQIEISA-N	-1	3	342.352	1.545	20	5		EDBDHM
Cn1ccnc1-c1cc(NC(=O)COc2ccccc2[N+](=O)[O-])n[n-]1	ZINC000119341819	138313925	/nfs/dbraw/zinc/31/39/25/138313925.db2.gz	NEEZTBVXSBIYSA-UHFFFAOYSA-N	-1	3	342.315	1.736	20	5		EDBDHM
Cn1ccnc1-c1cc(NC(=O)COc2ccccc2[N+](=O)[O-])[n-]n1	ZINC000119341819	138313926	/nfs/dbraw/zinc/31/39/26/138313926.db2.gz	NEEZTBVXSBIYSA-UHFFFAOYSA-N	-1	3	342.315	1.736	20	5		EDBDHM
C[C@@H](CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[S@@](C)=O	ZINC000124133209	138324062	/nfs/dbraw/zinc/32/40/62/138324062.db2.gz	DAEXUZVWGJRPIF-FHZGZLOMSA-N	-1	3	338.382	1.169	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H](CO)c1ccccc1	ZINC000125425373	138333736	/nfs/dbraw/zinc/33/37/36/138333736.db2.gz	KMRIMZALJMEIJQ-ZDUSSCGKSA-N	-1	3	336.369	1.649	20	5		EDBDHM
Cc1csc(C[N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)n1	ZINC000108390863	204261640	/nfs/dbraw/zinc/26/16/40/204261640.db2.gz	IJYIRYLPQZKKNZ-UHFFFAOYSA-N	-1	3	327.387	1.979	20	5		EDBDHM
COCCNC(=O)Cn1cc([N-]c2nc(C)ccc2[N+](=O)[O-])cn1	ZINC000127351188	205096223	/nfs/dbraw/zinc/09/62/23/205096223.db2.gz	DEVZUQWUIWXZQX-UHFFFAOYSA-N	-1	3	334.336	1.001	20	5		EDBDHM
Cc1cnc(C[N-]S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)o1	ZINC000175601570	207142660	/nfs/dbraw/zinc/14/26/60/207142660.db2.gz	RXQWMJIGCYBPSS-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
Cc1nn(CCC(=O)Nc2nnc(C(F)(F)F)[n-]2)c(C)c1[N+](=O)[O-]	ZINC000263862083	139365413	/nfs/dbraw/zinc/36/54/13/139365413.db2.gz	XUMQZRMQNPFIIJ-UHFFFAOYSA-N	-1	3	347.257	1.574	20	5		EDBDHM
Cc1nn(CCC(=O)Nc2nc(C(F)(F)F)n[n-]2)c(C)c1[N+](=O)[O-]	ZINC000263862083	139365414	/nfs/dbraw/zinc/36/54/14/139365414.db2.gz	XUMQZRMQNPFIIJ-UHFFFAOYSA-N	-1	3	347.257	1.574	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)nc1=N	ZINC000493314987	255203507	/nfs/dbraw/zinc/20/35/07/255203507.db2.gz	FAGDUIRZTGWAFL-XURPKSDJSA-N	-1	3	342.359	1.513	20	5		EDBDHM
CCC[C@@H](CCO)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000269908275	140016729	/nfs/dbraw/zinc/01/67/29/140016729.db2.gz	ZSCDMQCEFKUCKW-NSHDSACASA-N	-1	3	346.405	1.680	20	5		EDBDHM
C[C@@](O)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(F)(F)F	ZINC000270577146	140127459	/nfs/dbraw/zinc/12/74/59/140127459.db2.gz	VTMKSFWOVBQGHS-SECBINFHSA-N	-1	3	328.268	1.186	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC1([C@H](O)C(C)C)CC1	ZINC000271745549	140343610	/nfs/dbraw/zinc/34/36/10/140343610.db2.gz	AVJPAPKHPVHJAF-CQSZACIVSA-N	-1	3	342.417	1.979	20	5		EDBDHM
CCOCC[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000416373660	304312897	/nfs/dbraw/zinc/31/28/97/304312897.db2.gz	OXDGTZKERGXOJQ-UHFFFAOYSA-N	-1	3	342.295	1.928	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H](CO)CC(F)(F)F)cc1	ZINC000339784562	142155470	/nfs/dbraw/zinc/15/54/70/142155470.db2.gz	FOQQKSQBBSVBBO-ZETCQYMHSA-N	-1	3	328.268	1.186	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CC[C@@H](F)C1	ZINC000344907386	143025744	/nfs/dbraw/zinc/02/57/44/143025744.db2.gz	IFECTHIYLBFJCT-RKDXNWHRSA-N	-1	3	346.336	1.550	20	5		EDBDHM
C[C@H]1C[C@@H]1N1CCN(C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)C[C@@H](C)C1	ZINC000346205709	143178735	/nfs/dbraw/zinc/17/87/35/143178735.db2.gz	VHNWLWXIKLGVCZ-GVXVVHGQSA-N	-1	3	334.376	1.498	20	5		EDBDHM
O=C(CNC(=O)c1cccc([O-])c1)NCCc1ccccc1[N+](=O)[O-]	ZINC000347817202	143366594	/nfs/dbraw/zinc/36/65/94/143366594.db2.gz	CBPGLFCBPMFIJI-UHFFFAOYSA-N	-1	3	343.339	1.389	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CCC[C@H](CO)C2)cc1[N+](=O)[O-]	ZINC000416645957	304340955	/nfs/dbraw/zinc/34/09/55/304340955.db2.gz	GJTJDVADQLXZGI-UWVGGRQHSA-N	-1	3	334.419	1.794	20	5		EDBDHM
CC[C@H](C)[C@@](C)(O)C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000352869575	149197012	/nfs/dbraw/zinc/19/70/12/149197012.db2.gz	HSUUAJUMAOLLPG-FZMZJTMJSA-N	-1	3	330.406	1.811	20	5		EDBDHM
C[C@H](CC(=O)OC(C)(C)C)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000352883770	149203260	/nfs/dbraw/zinc/20/32/60/149203260.db2.gz	DJAKTXRHBAARMW-SNVBAGLBSA-N	-1	3	344.389	1.993	20	5		EDBDHM
CCO[C@@H]1COCC[C@@H]1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000352977577	149236779	/nfs/dbraw/zinc/23/67/79/149236779.db2.gz	PGXUOHXWSJQXTG-CMPLNLGQSA-N	-1	3	330.362	1.067	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(C(=O)NCc2nnc(C(F)(F)F)[n-]2)c1	ZINC000360993411	152272859	/nfs/dbraw/zinc/27/28/59/152272859.db2.gz	YCBNOJLLRVLNAT-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(C(=O)NCc2n[n-]c(C(F)(F)F)n2)c1	ZINC000360993411	152272860	/nfs/dbraw/zinc/27/28/60/152272860.db2.gz	YCBNOJLLRVLNAT-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(C(=O)NCc2nc(C(F)(F)F)n[n-]2)c1	ZINC000360993411	152272862	/nfs/dbraw/zinc/27/28/62/152272862.db2.gz	YCBNOJLLRVLNAT-UHFFFAOYSA-N	-1	3	329.238	1.970	20	5		EDBDHM
O=C(c1cc([O-])ccc1[N+](=O)[O-])N1CCCN(C2CCOCC2)CC1	ZINC000367602960	154194961	/nfs/dbraw/zinc/19/49/61/154194961.db2.gz	XDWRSYFTVBVLEU-UHFFFAOYSA-N	-1	3	349.387	1.627	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@H]2CCCCO2)cc1[N+](=O)[O-]	ZINC000275181887	268292399	/nfs/dbraw/zinc/29/23/99/268292399.db2.gz	KSKDFJWAFHNFTE-SECBINFHSA-N	-1	3	348.352	1.590	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H](C)[C@H](C)CO)cc1[N+](=O)[O-]	ZINC000275111661	273100871	/nfs/dbraw/zinc/10/08/71/273100871.db2.gz	WHQOWHLQRKCSEH-SFYZADRCSA-N	-1	3	336.341	1.038	20	5		EDBDHM
Cc1cnc(N2CCC[C@H]2C[C@@]2(C)NC(=O)[N-]C2=O)c([N+](=O)[O-])c1	ZINC000286419182	288001558	/nfs/dbraw/zinc/00/15/58/288001558.db2.gz	PRSOWZRCZRZNBU-ZUZCIYMTSA-N	-1	3	333.348	1.255	20	5		EDBDHM
C[C@@]1(C[C@@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2)NC(=O)[N-]C1=O	ZINC000287739677	288310742	/nfs/dbraw/zinc/31/07/42/288310742.db2.gz	GFCBMTJNLSPCLP-LRDDRELGSA-N	-1	3	346.343	1.188	20	5		EDBDHM
CCn1c(C)nc([N+](=O)[O-])c1NCCNC(=O)c1ccc([O-])cc1	ZINC000288165829	288421179	/nfs/dbraw/zinc/42/11/79/288421179.db2.gz	PRIFHRHTQXXDON-UHFFFAOYSA-N	-1	3	333.348	1.667	20	5		EDBDHM
COC(=O)c1cc([N-]C(=O)c2ncn(C(C)(C)C)n2)cc([N+](=O)[O-])c1	ZINC000291547630	289102132	/nfs/dbraw/zinc/10/21/32/289102132.db2.gz	SHEWSIFNGHYJGS-UHFFFAOYSA-N	-1	3	347.331	1.980	20	5		EDBDHM
Cc1cc(C(=O)N2CCC[C@@H]2c2nncn2C)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375103811	301096682	/nfs/dbraw/zinc/09/66/82/301096682.db2.gz	YLGYHMAUKYSCPJ-SNVBAGLBSA-N	-1	3	332.320	1.110	20	5		EDBDHM
CCN1CC[C@H]2OCCN(C(=O)c3ccc([O-])c([N+](=O)[O-])c3)[C@H]2C1	ZINC000293820723	303023969	/nfs/dbraw/zinc/02/39/69/303023969.db2.gz	GDXRPNJKENPJJD-DZGCQCFKSA-N	-1	3	335.360	1.236	20	5		EDBDHM
CC[C@@](C)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)OC	ZINC000299584310	303632688	/nfs/dbraw/zinc/63/26/88/303632688.db2.gz	DLXRJVJAVNIQPL-GFCCVEGCSA-N	-1	3	334.325	1.354	20	5		EDBDHM
COC(=O)c1ccc(C)c(NC(=O)c2c([N+](=O)[O-])cnn2C)c1[O-]	ZINC000436840340	305168292	/nfs/dbraw/zinc/16/82/92/305168292.db2.gz	QFNGMZCZHNPETF-UHFFFAOYSA-N	-1	3	334.288	1.381	20	5		EDBDHM
CC(C)OC(=O)[C@H](C)[N-]S(=O)(=O)CCc1ccccc1[N+](=O)[O-]	ZINC000452022595	305379350	/nfs/dbraw/zinc/37/93/50/305379350.db2.gz	UQJPVXSDFNBYQY-NSHDSACASA-N	-1	3	344.389	1.397	20	5		EDBDHM
O=C(/C=C\c1cncc([O-])c1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000493418346	305617044	/nfs/dbraw/zinc/61/70/44/305617044.db2.gz	KVVMFHDGRKTBDT-UPHRSURJSA-N	-1	3	343.343	1.769	20	5		EDBDHM
CN(C)c1ccc(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cn1	ZINC000046812742	441126495	/nfs/dbraw/zinc/12/64/95/441126495.db2.gz	FFXMCNAVAFCWBP-UHFFFAOYSA-N	-1	3	336.373	1.534	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1cnc(C)s1	ZINC000098039034	441148675	/nfs/dbraw/zinc/14/86/75/441148675.db2.gz	IRKUJEKGDQGLDL-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
CCC[C@](C)([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)OC	ZINC000042219483	441717289	/nfs/dbraw/zinc/71/72/89/441717289.db2.gz	AOQSKVPXRMXJFI-AWEZNQCLSA-N	-1	3	344.389	1.913	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H]1CCCC[C@H]1O	ZINC000158330671	441724872	/nfs/dbraw/zinc/72/48/72/441724872.db2.gz	ORJGCYQDSPRUPV-WCQYABFASA-N	-1	3	328.390	1.733	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000160235020	441866659	/nfs/dbraw/zinc/86/66/59/441866659.db2.gz	SACILFQRKLULFL-WDEREUQCSA-N	-1	3	341.389	1.226	20	5		EDBDHM
C[C@@H](O)C[N-]S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000123658133	441894383	/nfs/dbraw/zinc/89/43/83/441894383.db2.gz	UNGSRROTBQRAKL-ZCFIWIBFSA-N	-1	3	339.167	1.016	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCN2CCCCC2)c([N+](=O)[O-])c1	ZINC000078983205	442003800	/nfs/dbraw/zinc/00/38/00/442003800.db2.gz	IUSBTQFNTSWKLM-UHFFFAOYSA-N	-1	3	343.405	1.368	20	5		EDBDHM
Cc1c(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)cnn1C	ZINC000152599083	442229517	/nfs/dbraw/zinc/22/95/17/442229517.db2.gz	JJDPCIHGYUZVNS-UHFFFAOYSA-N	-1	3	328.325	1.254	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2CCOCC2)c1C	ZINC000178322724	442424353	/nfs/dbraw/zinc/42/43/53/442424353.db2.gz	UYBIMQAAUXELSA-UHFFFAOYSA-N	-1	3	328.390	1.917	20	5		EDBDHM
CSc1ccc(C(=O)N2CCc3nc[n-]c(=O)c3C2)cc1[N+](=O)[O-]	ZINC000179045599	442559114	/nfs/dbraw/zinc/55/91/14/442559114.db2.gz	AHIOLSUXPVQPOG-UHFFFAOYSA-N	-1	3	346.368	1.599	20	5		EDBDHM
CCN(C)C(=O)[C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000188459061	442752187	/nfs/dbraw/zinc/75/21/87/442752187.db2.gz	CCZSUZDOVHRPHD-MRVPVSSYSA-N	-1	3	349.796	1.393	20	5		EDBDHM
COCc1nc(Sc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])n[n-]1	ZINC000268452546	442994805	/nfs/dbraw/zinc/99/48/05/442994805.db2.gz	BEGCOBRPYIJZDU-UHFFFAOYSA-N	-1	3	344.374	1.414	20	5		EDBDHM
COCc1nc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)n[n-]1	ZINC000268481644	443004817	/nfs/dbraw/zinc/00/48/17/443004817.db2.gz	LCHPDKSGEYTUIB-QMMMGPOBSA-N	-1	3	337.361	1.979	20	5		EDBDHM
CCOC(=O)[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])[C@H](C)CC	ZINC000266312935	443094298	/nfs/dbraw/zinc/09/42/98/443094298.db2.gz	QANQUWXFTUFRRT-MFKMUULPSA-N	-1	3	344.389	1.851	20	5		EDBDHM
CC[C@H](CCO)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000268660058	443067700	/nfs/dbraw/zinc/06/77/00/443067700.db2.gz	XDAWFNUNLPVKPJ-SNVBAGLBSA-N	-1	3	332.378	1.290	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H]2CC[C@H](O)C2)c1[N+](=O)[O-]	ZINC000190187195	443068162	/nfs/dbraw/zinc/06/81/62/443068162.db2.gz	CLTVAEKQJVROAC-NEPJUHHUSA-N	-1	3	328.390	1.651	20	5		EDBDHM
C[C@H]1CN(C2CC2)C[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000268763413	443101085	/nfs/dbraw/zinc/10/10/85/443101085.db2.gz	ARLYGUCAWHLBSF-TVQRCGJNSA-N	-1	3	343.380	1.495	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1CCC[C@@H]1O	ZINC000269307697	443276085	/nfs/dbraw/zinc/27/60/85/443276085.db2.gz	UPUZHCKIKUNIAA-ONGXEEELSA-N	-1	3	330.362	1.043	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CS[C@@H](C)C1	ZINC000416593920	319448185	/nfs/dbraw/zinc/44/81/85/319448185.db2.gz	PNDYLZAQWVQVEO-IUCAKERBSA-N	-1	3	332.403	1.776	20	5		EDBDHM
CCOC(=O)CCC[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000267151636	443359733	/nfs/dbraw/zinc/35/97/33/443359733.db2.gz	NUFDRYUICRVYSR-UHFFFAOYSA-N	-1	3	346.361	1.225	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CCCC[C@H]1O	ZINC000269726346	443412954	/nfs/dbraw/zinc/41/29/54/443412954.db2.gz	BXXQFTGUKRXDFQ-ZYHUDNBSSA-N	-1	3	344.389	1.433	20	5		EDBDHM
O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCc2nc[n-]c(=O)c2C1	ZINC000269717423	443408691	/nfs/dbraw/zinc/40/86/91/443408691.db2.gz	WPQTZVSGZYRFFR-UHFFFAOYSA-N	-1	3	348.746	1.871	20	5		EDBDHM
COC[C@H](C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])OC	ZINC000272961720	443502768	/nfs/dbraw/zinc/50/27/68/443502768.db2.gz	NNQGCDKFZBFZIC-NSHDSACASA-N	-1	3	332.378	1.151	20	5		EDBDHM
COC(=O)[C@@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C1CC1	ZINC000267830721	443591435	/nfs/dbraw/zinc/59/14/35/443591435.db2.gz	ZZQJUHNWIBNKOZ-ZDUSSCGKSA-N	-1	3	342.373	1.442	20	5		EDBDHM
O=C(c1ccc([O-])cc1)N1CCN(c2ccncc2[N+](=O)[O-])CC1	ZINC000436747985	320022443	/nfs/dbraw/zinc/02/24/43/320022443.db2.gz	CYKJWBFPMQHPDI-UHFFFAOYSA-N	-1	3	328.328	1.658	20	5		EDBDHM
C[C@H]1CC[C@H]([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000444213793	320120421	/nfs/dbraw/zinc/12/04/21/320120421.db2.gz	CWEGZYBZPJOXLP-UWVGGRQHSA-N	-1	3	342.373	1.833	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])[C@H](O)C(F)F	ZINC000451716477	320238227	/nfs/dbraw/zinc/23/82/27/320238227.db2.gz	RWLKHUJDXJEMHB-KCJUWKMLSA-N	-1	3	338.332	1.586	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)[C@@H](O)C(F)F	ZINC000451717806	320238699	/nfs/dbraw/zinc/23/86/99/320238699.db2.gz	TWSHDLGHCVSCCI-WDEREUQCSA-N	-1	3	338.332	1.419	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2COCC2(C)C)c([N+](=O)[O-])c1	ZINC000451986442	320240196	/nfs/dbraw/zinc/24/01/96/320240196.db2.gz	XONDIEQVJHUPDD-GFCCVEGCSA-N	-1	3	330.362	1.307	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(N2CCC[C@H]2C[C@]2(C)NC(=O)[N-]C2=O)c1	ZINC000286321686	443690958	/nfs/dbraw/zinc/69/09/58/443690958.db2.gz	JROARVJOSKGZMR-ZBEGNZNMSA-N	-1	3	332.360	1.860	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)c2ncnn2C)c1C	ZINC000276694376	443794207	/nfs/dbraw/zinc/79/42/07/443794207.db2.gz	NDPVLOIOZSQTGZ-SNVBAGLBSA-N	-1	3	339.377	1.380	20	5		EDBDHM
CCNC(=O)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(C)C	ZINC000292706513	443823561	/nfs/dbraw/zinc/82/35/61/443823561.db2.gz	LWNIGQRFHMJDAO-LBPRGKRZSA-N	-1	3	347.368	1.173	20	5		EDBDHM
CCC[C@H](C)[C@@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000565083885	321168658	/nfs/dbraw/zinc/16/86/58/321168658.db2.gz	PVNKPPBWPJCWGY-JOYOIKCWSA-N	-1	3	334.369	1.809	20	5		EDBDHM
COC(=O)Cc1ccc(N(C)C[C@@H](C)c2nnn[n-]2)c([N+](=O)[O-])c1	ZINC000294919653	444158193	/nfs/dbraw/zinc/15/81/93/444158193.db2.gz	IJBIGYZMCTVGQX-SECBINFHSA-N	-1	3	334.336	1.063	20	5		EDBDHM
COC(=O)Cc1ccc(N(C)C[C@@H](C)c2nn[n-]n2)c([N+](=O)[O-])c1	ZINC000294919653	444158196	/nfs/dbraw/zinc/15/81/96/444158196.db2.gz	IJBIGYZMCTVGQX-SECBINFHSA-N	-1	3	334.336	1.063	20	5		EDBDHM
CC[C@@H](O)[C@@H](CC)[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000313102906	444295612	/nfs/dbraw/zinc/29/56/12/444295612.db2.gz	GMLYQXNPSXHHLX-ZYHUDNBSSA-N	-1	3	332.378	1.431	20	5		EDBDHM
COC(=O)[C@@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C1CC1	ZINC000342308288	444622652	/nfs/dbraw/zinc/62/26/52/444622652.db2.gz	VXOUIDAKVLVRLD-LBPRGKRZSA-N	-1	3	328.346	1.133	20	5		EDBDHM
CC(C)c1nc([C@H](C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)n[nH]1	ZINC000342794416	444870109	/nfs/dbraw/zinc/87/01/09/444870109.db2.gz	VCHVQNBCEVMMKY-ZETCQYMHSA-N	-1	3	345.406	1.937	20	5		EDBDHM
O=[N+]([O-])c1ccc(-c2noc([N-][C@H](CO)CC(F)(F)F)n2)cc1	ZINC000339698859	445162066	/nfs/dbraw/zinc/16/20/66/445162066.db2.gz	ZHCATYDUHYJPOZ-QMMMGPOBSA-N	-1	3	332.238	2.370	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2CCC[C@H](CO)C2)c(F)c1	ZINC000344954737	445152077	/nfs/dbraw/zinc/15/20/77/445152077.db2.gz	FZSMHIXNGGANIO-QWRGUYRKSA-N	-1	3	346.380	1.811	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCc2ccn(C)n2)c1C	ZINC000354682530	445338636	/nfs/dbraw/zinc/33/86/36/445338636.db2.gz	BNEJMNXHYIRUCK-UHFFFAOYSA-N	-1	3	338.389	1.466	20	5		EDBDHM
COc1ccc([N-]C(=O)c2nc3nccc(C)n3n2)cc1[N+](=O)[O-]	ZINC000359970149	445509244	/nfs/dbraw/zinc/50/92/44/445509244.db2.gz	KNIXUZSHFUYKOP-UHFFFAOYSA-N	-1	3	328.288	1.602	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2CCCN(C)[C@H]2C)c1[N+](=O)[O-]	ZINC000360008748	445526180	/nfs/dbraw/zinc/52/61/80/445526180.db2.gz	YLXUMQFEXNZVJN-QWHCGFSZSA-N	-1	3	341.433	1.973	20	5		EDBDHM
CCC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)C(=O)OC	ZINC000358594132	445666061	/nfs/dbraw/zinc/66/60/61/445666061.db2.gz	DJKJOBDVRBLACA-SNVBAGLBSA-N	-1	3	346.361	1.223	20	5		EDBDHM
COCc1nc(SCC(=O)Nc2cc([N+](=O)[O-])ccc2C)n[n-]1	ZINC000353788103	445756732	/nfs/dbraw/zinc/75/67/32/445756732.db2.gz	BJBOIBCYJRTWGX-UHFFFAOYSA-N	-1	3	337.361	1.899	20	5		EDBDHM
Cc1c(C(=O)Nc2[n-]nnc2C(=O)NC2CC2)cccc1[N+](=O)[O-]	ZINC000411105779	446401084	/nfs/dbraw/zinc/40/10/84/446401084.db2.gz	YCTDAYLGOIPSAQ-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
Cc1c(C(=O)Nc2nn[n-]c2C(=O)NC2CC2)cccc1[N+](=O)[O-]	ZINC000411105779	446401085	/nfs/dbraw/zinc/40/10/85/446401085.db2.gz	YCTDAYLGOIPSAQ-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
Cc1c(C(=O)Nc2n[n-]nc2C(=O)NC2CC2)cccc1[N+](=O)[O-]	ZINC000411105779	446401087	/nfs/dbraw/zinc/40/10/87/446401087.db2.gz	YCTDAYLGOIPSAQ-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
CC(C)O[C@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000416529682	447637944	/nfs/dbraw/zinc/63/79/44/447637944.db2.gz	QERZPSYVYXMNAA-JGZJWPJOSA-N	-1	3	332.353	1.968	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1C[C@@H](C)O[C@H]1C	ZINC000416594833	447655881	/nfs/dbraw/zinc/65/58/81/447655881.db2.gz	DSKHENQVVITTFE-VWYCJHECSA-N	-1	3	344.389	1.695	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CS[C@H](C)C1	ZINC000416593923	447656344	/nfs/dbraw/zinc/65/63/44/447656344.db2.gz	PNDYLZAQWVQVEO-RKDXNWHRSA-N	-1	3	332.403	1.776	20	5		EDBDHM
CC(C)(CN1CCCC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000452083770	447813776	/nfs/dbraw/zinc/81/37/76/447813776.db2.gz	LXVGTFCQXOGBEI-UHFFFAOYSA-N	-1	3	345.396	1.887	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)[C@H](OC)C1CC1	ZINC000451983111	447796194	/nfs/dbraw/zinc/79/61/94/447796194.db2.gz	GFKMWCRLYDXFAU-XPTSAGLGSA-N	-1	3	344.389	1.695	20	5		EDBDHM
CCC[C@H](C)[C@H](CO)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000566624519	448524549	/nfs/dbraw/zinc/52/45/49/448524549.db2.gz	ATLMWFCRBBKNHB-RYUDHWBXSA-N	-1	3	330.406	1.979	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])n[n-]1	ZINC000579742885	448869899	/nfs/dbraw/zinc/86/98/99/448869899.db2.gz	DBMDFJQVMHFFFT-UHFFFAOYSA-N	-1	3	346.343	2.411	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])[n-]n1	ZINC000579742885	448869904	/nfs/dbraw/zinc/86/99/04/448869904.db2.gz	DBMDFJQVMHFFFT-UHFFFAOYSA-N	-1	3	346.343	2.411	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H](CO)CC2CCCCC2)nc1	ZINC000593607417	449104797	/nfs/dbraw/zinc/10/47/97/449104797.db2.gz	GIDRQNZBAQUUKU-GFCCVEGCSA-N	-1	3	343.405	1.599	20	5		EDBDHM
Cn1c(NC(=O)c2n[n-]c3ccc([N+](=O)[O-])cc32)nnc1C1CC1	ZINC000597896791	449136936	/nfs/dbraw/zinc/13/69/36/449136936.db2.gz	GMJMZYCNFSBYBO-UHFFFAOYSA-N	-1	3	327.304	1.729	20	5		EDBDHM
NCc1cn([C@@H]2CCCN(Cc3cc([O-])ccc3[N+](=O)[O-])C2)nn1	ZINC000593726777	449161197	/nfs/dbraw/zinc/16/11/97/449161197.db2.gz	WGBZNNWQEYVRCQ-CYBMUJFWSA-N	-1	3	332.364	1.188	20	5		EDBDHM
CC(C)n1cnc([N-]C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)n1	ZINC000593235061	449181179	/nfs/dbraw/zinc/18/11/79/449181179.db2.gz	YWUUCKIXQRIEMR-UHFFFAOYSA-N	-1	3	333.304	1.791	20	5		EDBDHM
C[C@@]1(c2ccccc2)C[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593554055	449344214	/nfs/dbraw/zinc/34/42/14/449344214.db2.gz	XQKGFSVKAMVULZ-ZFWWWQNUSA-N	-1	3	333.369	1.998	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCOC3(CCC3)C2)nc1	ZINC000593564141	449353211	/nfs/dbraw/zinc/35/32/11/449353211.db2.gz	LMJSGNJVKQJGPB-SNVBAGLBSA-N	-1	3	327.362	1.370	20	5		EDBDHM
O=c1[n-]ccc(N2CCC(CN3CCCCC3=O)CC2)c1[N+](=O)[O-]	ZINC000596139649	449382440	/nfs/dbraw/zinc/38/24/40/449382440.db2.gz	NLMWIYBZLHIVHO-UHFFFAOYSA-N	-1	3	334.376	1.924	20	5		EDBDHM
O=c1[n-]ccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000596248869	449438728	/nfs/dbraw/zinc/43/87/28/449438728.db2.gz	MJTREZORXVMITA-MLGOLLRUSA-N	-1	3	333.319	2.000	20	5		EDBDHM
COCCCC[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594748903	449665597	/nfs/dbraw/zinc/66/55/97/449665597.db2.gz	OOAXNKJREKPBKV-UHFFFAOYSA-N	-1	3	339.373	1.848	20	5		EDBDHM
C[C@@H](CO)[C@@H](C)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594756778	449671882	/nfs/dbraw/zinc/67/18/82/449671882.db2.gz	AHIWAUQAGKMANS-VHSXEESVSA-N	-1	3	339.373	1.438	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H](CO)C2CCC2)cc1[N+](=O)[O-]	ZINC000594804135	449716360	/nfs/dbraw/zinc/71/63/60/449716360.db2.gz	KZSGUJGQAACQMD-NSHDSACASA-N	-1	3	348.352	1.182	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C1(CO)CC1	ZINC000594826643	449733591	/nfs/dbraw/zinc/73/35/91/449733591.db2.gz	HONQOARIUZVOMG-MRVPVSSYSA-N	-1	3	334.781	1.688	20	5		EDBDHM
O=c1[n-]ccc(NC[C@H]2CN(Cc3ccncc3)CCO2)c1[N+](=O)[O-]	ZINC000599183872	449785157	/nfs/dbraw/zinc/78/51/57/449785157.db2.gz	CGHHAGHFJDTVMC-ZDUSSCGKSA-N	-1	3	345.359	1.403	20	5		EDBDHM
Cn1ncc2c1nc(CN1CCc3ccc([N+](=O)[O-])cc31)[n-]c2=O	ZINC000612500016	449741478	/nfs/dbraw/zinc/74/14/78/449741478.db2.gz	LUDOXTNCADBCGK-UHFFFAOYSA-N	-1	3	326.316	1.540	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CCC[C@H](C)O1	ZINC000594850662	449758284	/nfs/dbraw/zinc/75/82/84/449758284.db2.gz	FAAXZRIGUBFRFL-CMPLNLGQSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCO[C@H]2CC2(F)F)c([N+](=O)[O-])s1	ZINC000601462685	449985618	/nfs/dbraw/zinc/98/56/18/449985618.db2.gz	BKXOCAYGAODSKP-QMMMGPOBSA-N	-1	3	342.345	1.667	20	5		EDBDHM
CC(C)N1CC[C@@H]([N-]c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1=O	ZINC000271388431	535239537	/nfs/dbraw/zinc/23/95/37/535239537.db2.gz	LKMWSXDDNGYMFZ-MRVPVSSYSA-N	-1	3	347.418	1.481	20	5		EDBDHM
CC[C@H](C)[C@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)OC	ZINC000340389447	535980591	/nfs/dbraw/zinc/98/05/91/535980591.db2.gz	NKGYAFQSKKLCKN-CABZTGNLSA-N	-1	3	344.389	1.769	20	5		EDBDHM
CN(C)CCN(CC(=O)[O-])C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000739606953	578590657	/nfs/dbraw/zinc/59/06/57/578590657.db2.gz	OXEPMKGEYXHYLU-UHFFFAOYSA-N	-1	3	334.332	1.165	20	5		EDBDHM
O=C(CC[C@@H]1NC(=O)[N-]C1=O)OCc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000734890853	578844723	/nfs/dbraw/zinc/84/47/23/578844723.db2.gz	ZTLRTNSRESJAKE-VIFPVBQESA-N	-1	3	341.707	1.280	20	5		EDBDHM
CO[C@@H](CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)C(F)(F)F	ZINC000736964266	579036412	/nfs/dbraw/zinc/03/64/12/579036412.db2.gz	WMGPXLMUGLYZKH-ZETCQYMHSA-N	-1	3	333.230	1.159	20	5		EDBDHM
CO[C@@H](CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)C(F)(F)F	ZINC000736964266	579036413	/nfs/dbraw/zinc/03/64/13/579036413.db2.gz	WMGPXLMUGLYZKH-ZETCQYMHSA-N	-1	3	333.230	1.159	20	5		EDBDHM
Cc1ccccc1[C@H](O)CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000737421291	579088727	/nfs/dbraw/zinc/08/87/27/579088727.db2.gz	LYRCQKAHWLWGNJ-CYBMUJFWSA-N	-1	3	341.331	1.624	20	5		EDBDHM
Cc1ccccc1[C@H](O)CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000737421291	579088729	/nfs/dbraw/zinc/08/87/29/579088729.db2.gz	LYRCQKAHWLWGNJ-CYBMUJFWSA-N	-1	3	341.331	1.624	20	5		EDBDHM
NC(=O)c1ccc(C[N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)o1	ZINC000778024413	580455098	/nfs/dbraw/zinc/45/50/98/580455098.db2.gz	PPGWBJSNTOUHTD-UHFFFAOYSA-N	-1	3	339.254	1.695	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C2COC(C)(C)OC2)cc1C	ZINC000758631889	579988186	/nfs/dbraw/zinc/98/81/86/579988186.db2.gz	SOOOWMOJNJTSRU-UHFFFAOYSA-N	-1	3	344.389	1.641	20	5		EDBDHM
CCOC(=O)[C@@H](C)[N-]S(=O)(=O)CCc1ccccc1[N+](=O)[O-]	ZINC000766782495	580173833	/nfs/dbraw/zinc/17/38/33/580173833.db2.gz	KRSNPRWNVISLMK-SNVBAGLBSA-N	-1	3	330.362	1.008	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)[C@@H](O)C(F)(F)F	ZINC000768881849	580223387	/nfs/dbraw/zinc/22/33/87/580223387.db2.gz	LIMVPMMLPYJSKA-HTRCEHHLSA-N	-1	3	348.324	1.636	20	5		EDBDHM
Nc1ccc([N+](=O)[O-])cc1C(=O)NCCNC(=O)c1ccc([O-])cc1	ZINC000769708695	580243445	/nfs/dbraw/zinc/24/34/45/580243445.db2.gz	CRMOWYKOIPGOLG-UHFFFAOYSA-N	-1	3	344.327	1.042	20	5		EDBDHM
COCc1ccc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])cc1	ZINC000774622456	580367860	/nfs/dbraw/zinc/36/78/60/580367860.db2.gz	ZEQBWNZLUWIQMV-UHFFFAOYSA-N	-1	3	338.345	1.442	20	5		EDBDHM
CCCSc1ccc([N+](=O)[O-])cc1C(=O)[N-]N1CC(=O)NC1=O	ZINC000780321703	580518601	/nfs/dbraw/zinc/51/86/01/580518601.db2.gz	LILZSUGSCOHREM-UHFFFAOYSA-N	-1	3	338.345	1.294	20	5		EDBDHM
COc1cc(C(=O)[N-]N2CCc3ccccc3C2=O)ccc1[N+](=O)[O-]	ZINC000780714379	580532054	/nfs/dbraw/zinc/53/20/54/580532054.db2.gz	USLGWKWNFCGZFP-UHFFFAOYSA-N	-1	3	341.323	1.947	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)N1CCCCC1=O	ZINC000800939608	581062656	/nfs/dbraw/zinc/06/26/56/581062656.db2.gz	LIMWYGAGGQRWKD-SECBINFHSA-N	-1	3	347.418	1.336	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCC[C@@H](O)C(F)(F)F)c(-c2nnn[n-]2)c1	ZINC000738370374	598896577	/nfs/dbraw/zinc/89/65/77/598896577.db2.gz	PFEOEOVPSCLVAM-SECBINFHSA-N	-1	3	332.242	1.500	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCC[C@@H](O)C(F)(F)F)c(-c2nn[n-]n2)c1	ZINC000738370374	598896578	/nfs/dbraw/zinc/89/65/78/598896578.db2.gz	PFEOEOVPSCLVAM-SECBINFHSA-N	-1	3	332.242	1.500	20	5		EDBDHM
Cc1cc(N2CCO[C@H](CN(C)CC(=O)[O-])C2)c([N+](=O)[O-])s1	ZINC000900941799	592180212	/nfs/dbraw/zinc/18/02/12/592180212.db2.gz	VPNMXCNUGASBFN-SNVBAGLBSA-N	-1	3	329.378	1.186	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2CC[C@H](C3CC3)O2)c(F)c1	ZINC000907469531	592651037	/nfs/dbraw/zinc/65/10/37/592651037.db2.gz	NYLNUGCGASPQKP-DGCLKSJQSA-N	-1	3	344.364	1.970	20	5		EDBDHM
Cc1cc(NCCCN2CCN(C)CC2)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000910340422	592838258	/nfs/dbraw/zinc/83/82/58/592838258.db2.gz	VXGRABXNDHUGTE-UHFFFAOYSA-N	-1	3	336.392	1.651	20	5		EDBDHM
O=C([N-][C@H](CO)[C@@H]1CCCOC1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000839857432	593202041	/nfs/dbraw/zinc/20/20/41/593202041.db2.gz	PVMLNPJPKZKMRQ-ZWNOBZJWSA-N	-1	3	344.314	1.590	20	5		EDBDHM
CCOc1nc2ccc(C(=O)OCCn3cnc([N+](=O)[O-])n3)cc2[n-]1	ZINC000838814340	593218872	/nfs/dbraw/zinc/21/88/72/593218872.db2.gz	XMFCWUFLNMTXQI-UHFFFAOYSA-N	-1	3	346.303	1.318	20	5		EDBDHM
CCOc1nc2cc(C(=O)OCCn3cnc([N+](=O)[O-])n3)ccc2[n-]1	ZINC000838814340	593218873	/nfs/dbraw/zinc/21/88/73/593218873.db2.gz	XMFCWUFLNMTXQI-UHFFFAOYSA-N	-1	3	346.303	1.318	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]Cc1nccnc1Cl	ZINC000809379997	593334847	/nfs/dbraw/zinc/33/48/47/593334847.db2.gz	SIIQZHANXPSTKM-UHFFFAOYSA-N	-1	3	342.764	1.825	20	5		EDBDHM
C[C@@H]1CC[C@H](OC(=O)C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000815244187	593621920	/nfs/dbraw/zinc/62/19/20/593621920.db2.gz	VANIIUJOMGSYIJ-MNOVXSKESA-N	-1	3	342.373	1.605	20	5		EDBDHM
C[C@H](CCO)Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820248304	593802853	/nfs/dbraw/zinc/80/28/53/593802853.db2.gz	FDFAPRGVLHRIEE-MRVPVSSYSA-N	-1	3	329.320	1.506	20	5		EDBDHM
C[C@H](CCO)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820248304	593802854	/nfs/dbraw/zinc/80/28/54/593802854.db2.gz	FDFAPRGVLHRIEE-MRVPVSSYSA-N	-1	3	329.320	1.506	20	5		EDBDHM
CN(C)C(=O)C1CCN(c2ccc(-c3nnn[n-]3)c([N+](=O)[O-])c2)CC1	ZINC000821575615	593866840	/nfs/dbraw/zinc/86/68/40/593866840.db2.gz	JCRHONKKMJVPTL-UHFFFAOYSA-N	-1	3	345.363	1.080	20	5		EDBDHM
CC(=O)OC1CCN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1	ZINC000824009932	593907142	/nfs/dbraw/zinc/90/71/42/593907142.db2.gz	FQKLVPHBERIZHR-UHFFFAOYSA-N	-1	3	332.320	1.307	20	5		EDBDHM
CC(=O)OC1CCN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1	ZINC000824009932	593907143	/nfs/dbraw/zinc/90/71/43/593907143.db2.gz	FQKLVPHBERIZHR-UHFFFAOYSA-N	-1	3	332.320	1.307	20	5		EDBDHM
C[C@H](OC(=O)c1nn(C)cc1[N+](=O)[O-])c1ccc(-c2nnn[n-]2)cc1	ZINC000824731571	594064493	/nfs/dbraw/zinc/06/44/93/594064493.db2.gz	WSULMMMBCUNXOT-QMMMGPOBSA-N	-1	3	343.303	1.426	20	5		EDBDHM
C[C@H](OC(=O)c1nn(C)cc1[N+](=O)[O-])c1ccc(-c2nn[n-]n2)cc1	ZINC000824731571	594064494	/nfs/dbraw/zinc/06/44/94/594064494.db2.gz	WSULMMMBCUNXOT-QMMMGPOBSA-N	-1	3	343.303	1.426	20	5		EDBDHM
C[C@](CNC(=O)[O-])(NCc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CC1	ZINC000824951909	594103676	/nfs/dbraw/zinc/10/36/76/594103676.db2.gz	DOGHWLOBZBDSNP-OAHLLOKOSA-N	-1	3	336.348	1.220	20	5		EDBDHM
C[C@H]1OCC[C@@H]1Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000825019843	594117233	/nfs/dbraw/zinc/11/72/33/594117233.db2.gz	HJMMNTDDYWNZGS-PELKAZGASA-N	-1	3	341.331	1.912	20	5		EDBDHM
C[C@H]1OCC[C@@H]1Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000825019843	594117235	/nfs/dbraw/zinc/11/72/35/594117235.db2.gz	HJMMNTDDYWNZGS-PELKAZGASA-N	-1	3	341.331	1.912	20	5		EDBDHM
CCC(CC)(CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)C(=O)OC	ZINC000825090346	594128907	/nfs/dbraw/zinc/12/89/07/594128907.db2.gz	XIEYFUHOLLYXCG-UHFFFAOYSA-N	-1	3	349.351	1.561	20	5		EDBDHM
CCC(CC)(CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)C(=O)OC	ZINC000825090346	594128908	/nfs/dbraw/zinc/12/89/08/594128908.db2.gz	XIEYFUHOLLYXCG-UHFFFAOYSA-N	-1	3	349.351	1.561	20	5		EDBDHM
CCOC(=O)CC[C@@H](C)Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000825508392	594194503	/nfs/dbraw/zinc/19/45/03/594194503.db2.gz	YGPOJAKUPZTAJV-SECBINFHSA-N	-1	3	334.336	1.919	20	5		EDBDHM
CCOC(=O)CC[C@@H](C)Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000825508392	594194504	/nfs/dbraw/zinc/19/45/04/594194504.db2.gz	YGPOJAKUPZTAJV-SECBINFHSA-N	-1	3	334.336	1.919	20	5		EDBDHM
CCOC(=O)c1cnn(Cc2cccc([N+](=O)[O-])c2)c1-c1nnn[n-]1	ZINC000825569960	594202085	/nfs/dbraw/zinc/20/20/85/594202085.db2.gz	CUAZQQJGTYNXKN-UHFFFAOYSA-N	-1	3	343.303	1.196	20	5		EDBDHM
O=[N+]([O-])c1c(-c2nnn[n-]2)ccnc1N1CCC(c2cc[nH]n2)CC1	ZINC000823620290	594221838	/nfs/dbraw/zinc/22/18/38/594221838.db2.gz	JNTIIOPWICWXCQ-UHFFFAOYSA-N	-1	3	341.335	1.277	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCC[C@H]2CCCC[C@H]2O)c(-c2nnn[n-]2)c1	ZINC000823651422	594224699	/nfs/dbraw/zinc/22/46/99/594224699.db2.gz	JBGWUGFASISWPA-ZWNOBZJWSA-N	-1	3	347.379	1.913	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCC[C@H]2CCCC[C@H]2O)c(-c2nn[n-]n2)c1	ZINC000823651422	594224700	/nfs/dbraw/zinc/22/47/00/594224700.db2.gz	JBGWUGFASISWPA-ZWNOBZJWSA-N	-1	3	347.379	1.913	20	5		EDBDHM
CN(C[C@@H]1CCCC[C@@H]1O)c1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825908848	594275571	/nfs/dbraw/zinc/27/55/71/594275571.db2.gz	NCZWUXNQYMTPOO-CABZTGNLSA-N	-1	3	333.352	1.157	20	5		EDBDHM
CN(C[C@@H]1CCCC[C@@H]1O)c1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825908848	594275573	/nfs/dbraw/zinc/27/55/73/594275573.db2.gz	NCZWUXNQYMTPOO-CABZTGNLSA-N	-1	3	333.352	1.157	20	5		EDBDHM
CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(-c2nnn[n-]2)[nH]1	ZINC000825985927	594298262	/nfs/dbraw/zinc/29/82/62/594298262.db2.gz	GCUXCWHTXISFLU-UHFFFAOYSA-N	-1	3	327.304	1.375	20	5		EDBDHM
CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(-c2nn[n-]n2)[nH]1	ZINC000825985927	594298263	/nfs/dbraw/zinc/29/82/63/594298263.db2.gz	GCUXCWHTXISFLU-UHFFFAOYSA-N	-1	3	327.304	1.375	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC(n3ccnc3)CC2)cc1-c1nnn[n-]1	ZINC000826499151	594502831	/nfs/dbraw/zinc/50/28/31/594502831.db2.gz	XQATUJCHMSQOQU-UHFFFAOYSA-N	-1	3	340.347	1.813	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC(n3ccnc3)CC2)cc1-c1nn[n-]n1	ZINC000826499151	594502833	/nfs/dbraw/zinc/50/28/33/594502833.db2.gz	XQATUJCHMSQOQU-UHFFFAOYSA-N	-1	3	340.347	1.813	20	5		EDBDHM
O=[N+]([O-])c1cccc([C@H](O)COc2ccc(-c3nnn[n-]3)cc2)c1	ZINC000826499688	594503719	/nfs/dbraw/zinc/50/37/19/594503719.db2.gz	SGBQHUVEOXQSSI-CQSZACIVSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1cccc([C@H](O)COc2ccc(-c3nn[n-]n3)cc2)c1	ZINC000826499688	594503720	/nfs/dbraw/zinc/50/37/20/594503720.db2.gz	SGBQHUVEOXQSSI-CQSZACIVSA-N	-1	3	327.300	1.887	20	5		EDBDHM
CC(C)[C@H](CO)O[N-]C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000836899792	595012240	/nfs/dbraw/zinc/01/22/40/595012240.db2.gz	DJJDZRXMKWWTGT-ZDUSSCGKSA-N	-1	3	326.305	1.044	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2CSCCS2)nc1	ZINC000845893574	595090522	/nfs/dbraw/zinc/09/05/22/595090522.db2.gz	RMUJPQJPWRZXGL-VIFPVBQESA-N	-1	3	335.432	1.117	20	5		EDBDHM
CCC(=O)c1ccc(N2CCCN(CC(=O)[O-])CC2)c([N+](=O)[O-])c1	ZINC000844213638	595303833	/nfs/dbraw/zinc/30/38/33/595303833.db2.gz	BMCYAERBANPCMA-UHFFFAOYSA-N	-1	3	335.360	1.784	20	5		EDBDHM
CCn1cnnc1C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848581871	595408828	/nfs/dbraw/zinc/40/88/28/595408828.db2.gz	YLOCPFXKXHQGJW-UHFFFAOYSA-N	-1	3	341.274	1.494	20	5		EDBDHM
Cc1noc(CC[N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)n1	ZINC000848582640	595409291	/nfs/dbraw/zinc/40/92/91/595409291.db2.gz	NVRXMUCUIVRNES-UHFFFAOYSA-N	-1	3	342.258	1.617	20	5		EDBDHM
COCCOC[C@@H](C)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848583935	595409388	/nfs/dbraw/zinc/40/93/88/595409388.db2.gz	JGJRCGKPQQXRRP-SNVBAGLBSA-N	-1	3	348.302	1.734	20	5		EDBDHM
O=C([N-][C@@H](CO)CC1CC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848585089	595410035	/nfs/dbraw/zinc/41/00/35/595410035.db2.gz	GGYRLPNNMFVUCE-SNVBAGLBSA-N	-1	3	330.287	1.844	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2COC3(CCC3)C2)c(F)c1	ZINC000849450494	595532225	/nfs/dbraw/zinc/53/22/25/595532225.db2.gz	ZNWUEKASVAULSY-VIFPVBQESA-N	-1	3	330.337	1.724	20	5		EDBDHM
O=C([N-]C[C@@H]1CCCN(c2cc[nH]c(=O)c2[N+](=O)[O-])C1)C(F)(F)F	ZINC000853637294	595842171	/nfs/dbraw/zinc/84/21/71/595842171.db2.gz	QBYYLQLTOBAUAI-QMMMGPOBSA-N	-1	3	348.281	1.590	20	5		EDBDHM
COCCN1CCC(Nc2ccc(CC(=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000563207121	306323658	/nfs/dbraw/zinc/32/36/58/306323658.db2.gz	MQXIARHZOLTQPH-UHFFFAOYSA-N	-1	3	337.376	1.745	20	5		EDBDHM
CCc1nnc([N-]C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)s1	ZINC000022568584	212306650	/nfs/dbraw/zinc/30/66/50/212306650.db2.gz	QWAACAJIOSJEHC-UHFFFAOYSA-N	-1	3	345.344	1.842	20	5		EDBDHM
O=C(C=Cc1cccc([N+](=O)[O-])c1)N1CCc2nc[n-]c(=O)c2C1	ZINC000491962350	255156078	/nfs/dbraw/zinc/15/60/78/255156078.db2.gz	JPJPBNGSTJKOMC-PLNGDYQASA-N	-1	3	326.312	1.689	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C[C@@H]2CCCN2C)cc1[N+](=O)[O-]	ZINC000271687069	140333876	/nfs/dbraw/zinc/33/38/76/140333876.db2.gz	DNXVLKPAHVQUSY-JTQLQIEISA-N	-1	3	347.824	1.929	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2C(=O)NCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000195476507	292087421	/nfs/dbraw/zinc/08/74/21/292087421.db2.gz	UAWBQFWWMIYQGY-KWQFWETISA-N	-1	3	341.389	1.015	20	5		EDBDHM
CN1CC[C@@H](C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000416495076	304324746	/nfs/dbraw/zinc/32/47/46/304324746.db2.gz	KPYPKRQKSKYLBW-VIFPVBQESA-N	-1	3	333.797	1.478	20	5		EDBDHM
O=C([O-])c1ccc([N+](=O)[O-])c(N2CCN(CC3CCOCC3)CC2)c1	ZINC000572964464	306605729	/nfs/dbraw/zinc/60/57/29/306605729.db2.gz	MFMDAJQWEAKKCM-UHFFFAOYSA-N	-1	3	349.387	1.842	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1(OC)CCC1	ZINC000355712277	150370176	/nfs/dbraw/zinc/37/01/76/150370176.db2.gz	IVERVSSEDORTIK-UHFFFAOYSA-N	-1	3	330.362	1.451	20	5		EDBDHM
COCCOC[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000360547657	152090125	/nfs/dbraw/zinc/09/01/25/152090125.db2.gz	RPHURNZPEFNLKH-VIFPVBQESA-N	-1	3	336.341	1.064	20	5		EDBDHM
CCOC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])nn2C)c([O-])c1	ZINC000360636902	152134355	/nfs/dbraw/zinc/13/43/55/152134355.db2.gz	PJRHGMVWKPOGTJ-UHFFFAOYSA-N	-1	3	334.288	1.463	20	5		EDBDHM
C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCO[C@@H](CN(C)CC(=O)[O-])C1	ZINC000363925522	153098642	/nfs/dbraw/zinc/09/86/42/153098642.db2.gz	QASJFPPAZYZZMX-WFASDCNBSA-N	-1	3	337.376	1.373	20	5		EDBDHM
Cc1nnc([C@H](C)[N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)s1	ZINC000273605948	268063628	/nfs/dbraw/zinc/06/36/28/268063628.db2.gz	MWQAXDSSBAJYRE-QMMMGPOBSA-N	-1	3	342.402	1.935	20	5		EDBDHM
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])[C@@H]1OC	ZINC000274831051	268217640	/nfs/dbraw/zinc/21/76/40/268217640.db2.gz	ZEALARNRFSDPRT-YUTCNCBUSA-N	-1	3	344.389	1.207	20	5		EDBDHM
CCOC(=O)C(C)(C)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276664168	268458344	/nfs/dbraw/zinc/45/83/44/268458344.db2.gz	FHNAUTNIZKACDE-UHFFFAOYSA-N	-1	3	344.389	1.832	20	5		EDBDHM
CC(C)N1CCC[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000274731663	273098306	/nfs/dbraw/zinc/09/83/06/273098306.db2.gz	ULMCTLIYKFZKCO-LBPRGKRZSA-N	-1	3	327.406	1.746	20	5		EDBDHM
C[C@@H]1CN(CCCNC(=O)c2cc([O-])cc([N+](=O)[O-])c2)CCCO1	ZINC000277643839	273213884	/nfs/dbraw/zinc/21/38/84/273213884.db2.gz	SEJINNTUBDMPIC-GFCCVEGCSA-N	-1	3	337.376	1.531	20	5		EDBDHM
Cc1cc(OCC(=O)N2CCc3c(=O)[n-]cnc3C2)ccc1[N+](=O)[O-]	ZINC000280784846	273398069	/nfs/dbraw/zinc/39/80/69/273398069.db2.gz	KHYCPYPVAUJAHO-UHFFFAOYSA-N	-1	3	344.327	1.363	20	5		EDBDHM
COCC1([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)CCC1	ZINC000283829010	273976167	/nfs/dbraw/zinc/97/61/67/273976167.db2.gz	GSEOBDRMGWFDFL-UHFFFAOYSA-N	-1	3	330.362	1.451	20	5		EDBDHM
CCCN1CCC[C@H]1C[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000352499934	276011977	/nfs/dbraw/zinc/01/19/77/276011977.db2.gz	MDJVPOBUVWVQRZ-NSHDSACASA-N	-1	3	345.396	1.887	20	5		EDBDHM
COCC[C@H](COC)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000352531770	292693298	/nfs/dbraw/zinc/69/32/98/292693298.db2.gz	RRHTVDSHNSQWGD-LLVKDONJSA-N	-1	3	332.378	1.233	20	5		EDBDHM
CO[C@H](C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C1CC1	ZINC000293739582	303012149	/nfs/dbraw/zinc/01/21/49/303012149.db2.gz	HMFVPWGKMWRPCG-GFCCVEGCSA-N	-1	3	328.390	1.915	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CC[C@@H](CO)C2)c(Cl)c1	ZINC000295658907	303248702	/nfs/dbraw/zinc/24/87/02/303248702.db2.gz	GASZXIDNEQDVGR-BDAKNGLRSA-N	-1	3	334.781	1.688	20	5		EDBDHM
CC(C)c1[nH]nc(C(=O)Nc2cccc(-c3nnn[n-]3)c2)c1[N+](=O)[O-]	ZINC000433696587	305112669	/nfs/dbraw/zinc/11/26/69/305112669.db2.gz	KUUPZFOGPWQREP-UHFFFAOYSA-N	-1	3	342.319	1.874	20	5		EDBDHM
CC(C)c1[nH]nc(C(=O)Nc2cccc(-c3nn[n-]n3)c2)c1[N+](=O)[O-]	ZINC000433696587	305112670	/nfs/dbraw/zinc/11/26/70/305112670.db2.gz	KUUPZFOGPWQREP-UHFFFAOYSA-N	-1	3	342.319	1.874	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2C[C@@H]3OCCC[C@@H]23)cc1[N+](=O)[O-]	ZINC000439091613	305193758	/nfs/dbraw/zinc/19/37/58/305193758.db2.gz	NHSSLUIGLKRPJK-NGZCFLSTSA-N	-1	3	332.403	1.811	20	5		EDBDHM
Cc1n[nH]cc1CCC[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000451552617	305352999	/nfs/dbraw/zinc/35/29/99/305352999.db2.gz	WSAUTSSCTUQAPI-UHFFFAOYSA-N	-1	3	338.389	1.846	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC2(CF)CCOCC2)c([N+](=O)[O-])c1	ZINC000451811943	305370599	/nfs/dbraw/zinc/37/05/99/305370599.db2.gz	FZYOGDOOAMJYGE-UHFFFAOYSA-N	-1	3	346.380	1.948	20	5		EDBDHM
Cc1ncc(CNC(=O)NCCOc2ccc([N+](=O)[O-])cc2)c(=O)[n-]1	ZINC000544132451	306072905	/nfs/dbraw/zinc/07/29/05/306072905.db2.gz	KBEOMHMIHINRJS-UHFFFAOYSA-N	-1	3	347.331	1.277	20	5		EDBDHM
CNS(=O)(=O)c1cc([N-]C(=O)c2ccc([N+](=O)[O-])o2)ccc1C	ZINC000032501907	441559357	/nfs/dbraw/zinc/55/93/57/441559357.db2.gz	XQQQGYFCBUIKGI-UHFFFAOYSA-N	-1	3	339.329	1.657	20	5		EDBDHM
C[C@]1(c2ccc(CNc3ccncc3[N+](=O)[O-])cc2)NC(=O)[N-]C1=O	ZINC000066812084	441570594	/nfs/dbraw/zinc/57/05/94/441570594.db2.gz	JSANBNIDRQCYMO-MRXNPFEDSA-N	-1	3	341.327	1.657	20	5		EDBDHM
C[C@H](CN1CCCC1=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000055280170	441637230	/nfs/dbraw/zinc/63/72/30/441637230.db2.gz	FLOAWNYSHHQDSU-SECBINFHSA-N	-1	3	345.352	1.023	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CCN(C(C)C)C1=O	ZINC000114743219	441681883	/nfs/dbraw/zinc/68/18/83/441681883.db2.gz	LEARAGSWHZQPDS-NSHDSACASA-N	-1	3	341.389	1.191	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCCC1	ZINC000056036781	441683547	/nfs/dbraw/zinc/68/35/47/441683547.db2.gz	RNIVUBLUUZHVTP-UHFFFAOYSA-N	-1	3	346.336	1.498	20	5		EDBDHM
CCC(CC)(CO)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000159222230	441795865	/nfs/dbraw/zinc/79/58/65/441795865.db2.gz	BBMIXHLDUAGFMP-UHFFFAOYSA-N	-1	3	334.369	1.811	20	5		EDBDHM
CC[C@@H](C)C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000116651389	441833904	/nfs/dbraw/zinc/83/39/04/441833904.db2.gz	VEFIIMAZPZDBPT-SNVBAGLBSA-N	-1	3	329.378	1.035	20	5		EDBDHM
C[C@H]1C[C@@H]([N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])CN1C1CC1	ZINC000124059835	441906364	/nfs/dbraw/zinc/90/63/64/441906364.db2.gz	GRIMABOWSVHJQL-VHSXEESVSA-N	-1	3	343.380	1.637	20	5		EDBDHM
COC(=O)CCCC[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000069044083	441882732	/nfs/dbraw/zinc/88/27/32/441882732.db2.gz	AIZCMILZPBPBLP-UHFFFAOYSA-N	-1	3	344.389	1.833	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]c2cccn(C)c2=O)c1C	ZINC000163558604	442174083	/nfs/dbraw/zinc/17/40/83/442174083.db2.gz	FAQXRBUKKGLJQC-UHFFFAOYSA-N	-1	3	337.357	1.711	20	5		EDBDHM
C[C@@H](O)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000154281542	442330351	/nfs/dbraw/zinc/33/03/51/442330351.db2.gz	VZHLHFNZMYPSCU-SSDOTTSWSA-N	-1	3	342.295	1.663	20	5		EDBDHM
Cn1cc(S(=O)(=O)[N-]CCc2cccc([N+](=O)[O-])c2)nc1Cl	ZINC000154297676	442331155	/nfs/dbraw/zinc/33/11/55/442331155.db2.gz	VVGNWSDVNQAURQ-UHFFFAOYSA-N	-1	3	344.780	1.503	20	5		EDBDHM
Cc1ccc([C@@H](C)NC(=O)C(=O)[N-]c2cnns2)cc1[N+](=O)[O-]	ZINC000192045882	442578510	/nfs/dbraw/zinc/57/85/10/442578510.db2.gz	ORNWZSFFZQUOLS-MRVPVSSYSA-N	-1	3	335.345	1.571	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2CCN(C3CC3)C2)s1	ZINC000173022167	442588323	/nfs/dbraw/zinc/58/83/23/442588323.db2.gz	JFSKNJAJNADRLT-SECBINFHSA-N	-1	3	331.419	1.419	20	5		EDBDHM
CCN1CCC[C@H]1C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000193208678	442722442	/nfs/dbraw/zinc/72/24/42/442722442.db2.gz	HOVGINAVQXGQMZ-NSHDSACASA-N	-1	3	343.405	1.366	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC(=O)NC(C)(C)C)c1[N+](=O)[O-]	ZINC000189810563	443015138	/nfs/dbraw/zinc/01/51/38/443015138.db2.gz	KTTRDFSIQSDXQR-UHFFFAOYSA-N	-1	3	343.405	1.405	20	5		EDBDHM
COC(=O)c1cc([N-]S(=O)(=O)N2CCCC2)cc([N+](=O)[O-])c1	ZINC000266614153	443186640	/nfs/dbraw/zinc/18/66/40/443186640.db2.gz	RRDVIZFEUUZNFF-UHFFFAOYSA-N	-1	3	329.334	1.134	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@H]2CC(=O)N(C)C2)c1	ZINC000272588522	443374352	/nfs/dbraw/zinc/37/43/52/443374352.db2.gz	ZKWRQERJEHSWJX-MRVPVSSYSA-N	-1	3	347.780	1.066	20	5		EDBDHM
CN1CC=C(C[N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])CC1	ZINC000272256114	443570425	/nfs/dbraw/zinc/57/04/25/443570425.db2.gz	PQLXTVQIWNHZDD-UHFFFAOYSA-N	-1	3	329.353	1.274	20	5		EDBDHM
CCOC(=O)[C@H](C)[C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000273161093	443553785	/nfs/dbraw/zinc/55/37/85/443553785.db2.gz	ZYALSRWEJUTLMI-RKDXNWHRSA-N	-1	3	348.352	1.600	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2cc(C(N)=O)ccc2Cl)n1	ZINC000427168694	319891950	/nfs/dbraw/zinc/89/19/50/319891950.db2.gz	AEOINVFELFWYBX-UHFFFAOYSA-N	-1	3	337.723	1.816	20	5		EDBDHM
CN(C)CCOC1CCN(C(=O)c2cccc([N+](=O)[O-])c2[O-])CC1	ZINC000443967563	320116995	/nfs/dbraw/zinc/11/69/95/320116995.db2.gz	ZXUOPZKQHVLGEN-UHFFFAOYSA-N	-1	3	337.376	1.483	20	5		EDBDHM
COC[C@@H](CO)[N-]c1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000280387027	443709996	/nfs/dbraw/zinc/70/99/96/443709996.db2.gz	ZYECHEOEMHKPQS-SSDOTTSWSA-N	-1	3	339.226	1.941	20	5		EDBDHM
CS[C@@H](CO)[C@@H](C)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276919873	443873381	/nfs/dbraw/zinc/87/33/81/443873381.db2.gz	YRTLXKBHGPHNAO-MNOVXSKESA-N	-1	3	348.446	1.602	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC(C)(C)CCO)c1[N+](=O)[O-]	ZINC000190034161	533704782	/nfs/dbraw/zinc/70/47/82/533704782.db2.gz	ZCABEGZZYYHPPG-UHFFFAOYSA-N	-1	3	330.406	1.899	20	5		EDBDHM
Cc1nnc([N-]C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)n1C1CC1	ZINC000285377947	443961596	/nfs/dbraw/zinc/96/15/96/443961596.db2.gz	KSLGGEHYOGWZRW-UHFFFAOYSA-N	-1	3	345.315	1.853	20	5		EDBDHM
C[C@H](C(=O)N1CCc2c(nc[n-]c2=O)C1)c1cccc([N+](=O)[O-])c1	ZINC000562406718	321056417	/nfs/dbraw/zinc/05/64/17/321056417.db2.gz	ITQCZINAUFKILP-JTQLQIEISA-N	-1	3	328.328	1.779	20	5		EDBDHM
Cc1cc(N2CCN(C3CCOCC3)CC2)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000567978488	321270511	/nfs/dbraw/zinc/27/05/11/321270511.db2.gz	HIKVQQMPUYMVPS-UHFFFAOYSA-N	-1	3	349.387	1.902	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CCCCC[C@@H]1O	ZINC000322853650	444341169	/nfs/dbraw/zinc/34/11/69/444341169.db2.gz	QPNQLJVUWSLIGW-RYUDHWBXSA-N	-1	3	344.389	1.575	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC)C1CC1	ZINC000323793265	444347077	/nfs/dbraw/zinc/34/70/77/444347077.db2.gz	DRNCDJPLCOQMRU-GFCCVEGCSA-N	-1	3	342.373	1.848	20	5		EDBDHM
COC(=O)C[C@@H](C)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000580777796	322094834	/nfs/dbraw/zinc/09/48/34/322094834.db2.gz	JCKTXFSHJHVDPH-SECBINFHSA-N	-1	3	330.362	1.442	20	5		EDBDHM
CC(C)(C(=O)[O-])N1CCN(c2nc3sccn3c2[N+](=O)[O-])CC1	ZINC000580837549	322102262	/nfs/dbraw/zinc/10/22/62/322102262.db2.gz	VRCLVCVHECTXOA-UHFFFAOYSA-N	-1	3	339.377	1.289	20	5		EDBDHM
C[C@H]1C[C@@H]1N1CCN(c2nc(C(=O)[O-])ccc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000581134061	322140468	/nfs/dbraw/zinc/14/04/68/322140468.db2.gz	KWQGZPVCJWPPCL-MJVIPROJSA-N	-1	3	334.376	1.855	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-]Cc1ccc[nH]1)OCCO2	ZINC000343907509	444661272	/nfs/dbraw/zinc/66/12/72/444661272.db2.gz	LQRDTIXGSSQMFQ-UHFFFAOYSA-N	-1	3	339.329	1.173	20	5		EDBDHM
CC1(C)NC(=O)CC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000338427203	444688896	/nfs/dbraw/zinc/68/88/96/444688896.db2.gz	WBVLGOQXUBGITC-LLVKDONJSA-N	-1	3	345.352	1.069	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCN2CCCCC2)c([N+](=O)[O-])c1	ZINC000330403063	444967663	/nfs/dbraw/zinc/96/76/63/444967663.db2.gz	GJIJUAKLDDXKAT-UHFFFAOYSA-N	-1	3	327.406	1.667	20	5		EDBDHM
Cc1cc(C(=O)Nc2ccc(-c3nnn[n-]3)cc2)c(N)c([N+](=O)[O-])c1	ZINC000363044588	445659254	/nfs/dbraw/zinc/65/92/54/445659254.db2.gz	TXCMULUKURGOGO-UHFFFAOYSA-N	-1	3	339.315	1.918	20	5		EDBDHM
Cc1cc(C(=O)Nc2ccc(-c3nn[n-]n3)cc2)c(N)c([N+](=O)[O-])c1	ZINC000363044588	445659257	/nfs/dbraw/zinc/65/92/57/445659257.db2.gz	TXCMULUKURGOGO-UHFFFAOYSA-N	-1	3	339.315	1.918	20	5		EDBDHM
COCCOC[C@@H](C)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000360257659	445661630	/nfs/dbraw/zinc/66/16/30/445661630.db2.gz	LSJUIYYPUIUNMC-GFCCVEGCSA-N	-1	3	346.405	1.541	20	5		EDBDHM
CCc1cnc(C[N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)o1	ZINC000354124454	445922382	/nfs/dbraw/zinc/92/23/82/445922382.db2.gz	KTUILYVFIMDTHM-UHFFFAOYSA-N	-1	3	325.346	1.765	20	5		EDBDHM
CSC1(CNC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)CCN(C)CC1	ZINC000359262492	446098661	/nfs/dbraw/zinc/09/86/61/446098661.db2.gz	BRFBPNBOYBOIDL-UHFFFAOYSA-N	-1	3	340.405	1.253	20	5		EDBDHM
COCCCN1CCCN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC1	ZINC000369661125	446141279	/nfs/dbraw/zinc/14/12/79/446141279.db2.gz	OWJRCQNCAXRNHN-UHFFFAOYSA-N	-1	3	337.376	1.485	20	5		EDBDHM
O=C(Cc1ccc([O-])c(F)c1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450632759	447543494	/nfs/dbraw/zinc/54/34/94/447543494.db2.gz	SHRPDNYDIUWODP-UHFFFAOYSA-N	-1	3	331.303	1.962	20	5		EDBDHM
CO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C12CCC2	ZINC000416569884	447651849	/nfs/dbraw/zinc/65/18/49/447651849.db2.gz	YXUFPYQOYKKLLR-CHWSQXEVSA-N	-1	3	326.374	1.831	20	5		EDBDHM
Cn1cnc([N-]C(=O)c2cc(Br)cc([N+](=O)[O-])c2)n1	ZINC000554226918	448014839	/nfs/dbraw/zinc/01/48/39/448014839.db2.gz	MCGNDXQMNJUSKO-UHFFFAOYSA-N	-1	3	326.110	1.738	20	5		EDBDHM
CN(CCn1ccc([N+](=O)[O-])n1)Cc1ccc(OCC(=O)[O-])cc1	ZINC000571570842	448172451	/nfs/dbraw/zinc/17/24/51/448172451.db2.gz	KHHDKDVKVKVYEC-UHFFFAOYSA-N	-1	3	334.332	1.387	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCN2CC[C@@H](C)C2)c1C	ZINC000532195761	448214954	/nfs/dbraw/zinc/21/49/54/448214954.db2.gz	XWTXQPYGTXYLNP-LLVKDONJSA-N	-1	3	341.433	1.832	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)NCc1ccc(-c2nnn[n-]2)cc1	ZINC000517680881	448603609	/nfs/dbraw/zinc/60/36/09/448603609.db2.gz	KRKXJSDXYZCCMF-UHFFFAOYSA-N	-1	3	327.304	1.043	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)NCc1ccc(-c2nn[n-]n2)cc1	ZINC000517680881	448603615	/nfs/dbraw/zinc/60/36/15/448603615.db2.gz	KRKXJSDXYZCCMF-UHFFFAOYSA-N	-1	3	327.304	1.043	20	5		EDBDHM
C[C@@H]1CN(CCCNc2nc(C(=O)[O-])ccc2[N+](=O)[O-])CCCO1	ZINC000578872486	448658570	/nfs/dbraw/zinc/65/85/70/448658570.db2.gz	XTINSGGZRQRSNJ-LLVKDONJSA-N	-1	3	338.364	1.601	20	5		EDBDHM
O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cc(=O)[n-]c(C2CC2)n1	ZINC000574701354	448936076	/nfs/dbraw/zinc/93/60/76/448936076.db2.gz	YMHAMNBROKSUGF-UHFFFAOYSA-N	-1	3	343.343	1.810	20	5		EDBDHM
C[C@@]1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCO[C@@H]1C1CC1	ZINC000593577511	449084910	/nfs/dbraw/zinc/08/49/10/449084910.db2.gz	DCDIMSLVKYZTMX-KGLIPLIRSA-N	-1	3	341.389	1.473	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000589837207	449066056	/nfs/dbraw/zinc/06/60/56/449066056.db2.gz	NTTPIHMQPPNBNS-SECBINFHSA-N	-1	3	340.286	1.044	20	5		EDBDHM
CC(C)[C@@H](CO)[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(C)C	ZINC000593600199	449100132	/nfs/dbraw/zinc/10/01/32/449100132.db2.gz	BOHRESMXPJWPPI-TZMCWYRMSA-N	-1	3	345.421	1.557	20	5		EDBDHM
CC(C)OC(=O)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(C)C	ZINC000593602823	449102604	/nfs/dbraw/zinc/10/26/04/449102604.db2.gz	YHKRFAHJGVYNNV-LBPRGKRZSA-N	-1	3	345.377	1.244	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCc3ccccc3C2)nc1	ZINC000593525152	449324303	/nfs/dbraw/zinc/32/43/03/449324303.db2.gz	KCRCOEMNZZTMHS-CYBMUJFWSA-N	-1	3	333.369	1.826	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2C[C@@H]2Cc2ccccc2)nc1	ZINC000593551801	449342976	/nfs/dbraw/zinc/34/29/76/449342976.db2.gz	FJBKNHDIFVNBGY-JSGCOSHPSA-N	-1	3	333.369	1.899	20	5		EDBDHM
O=C(N1CCCCC1)N1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596067831	449345400	/nfs/dbraw/zinc/34/54/00/449345400.db2.gz	BKLXPFYTKXZEKM-UHFFFAOYSA-N	-1	3	335.364	1.423	20	5		EDBDHM
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1	ZINC000596347490	449479159	/nfs/dbraw/zinc/47/91/59/449479159.db2.gz	XDLYWZOIARDDPR-SFYZADRCSA-N	-1	3	349.265	1.873	20	5		EDBDHM
O=C(NC[C@H]1CCN1Cc1ccccc1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000598780005	449597827	/nfs/dbraw/zinc/59/78/27/449597827.db2.gz	NBYZJNKWHPACJJ-CYBMUJFWSA-N	-1	3	342.355	1.700	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])N1CCCC[C@@H]1C	ZINC000594748178	449664181	/nfs/dbraw/zinc/66/41/81/449664181.db2.gz	KVBZFWBIFFWWPH-RYUDHWBXSA-N	-1	3	342.421	1.531	20	5		EDBDHM
C[C@H](O)CCC[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594770753	449683496	/nfs/dbraw/zinc/68/34/96/449683496.db2.gz	OQBOYWBWWDQLNY-JTQLQIEISA-N	-1	3	339.373	1.582	20	5		EDBDHM
CC1(C)CCCN(CC[N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])C1	ZINC000594772014	449684300	/nfs/dbraw/zinc/68/43/00/449684300.db2.gz	UWHVTSCQFWHPMV-UHFFFAOYSA-N	-1	3	342.421	1.390	20	5		EDBDHM
CO[C@H](C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000594800817	449711562	/nfs/dbraw/zinc/71/15/62/449711562.db2.gz	LIWZKIKDDPNDNL-SMDDNHRTSA-N	-1	3	344.389	1.066	20	5		EDBDHM
CC[C@H](O)C[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594776256	449688585	/nfs/dbraw/zinc/68/85/85/449688585.db2.gz	XGDCHOSPDOOSEV-VIFPVBQESA-N	-1	3	325.346	1.192	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CC(O)(C1CC1)C1CC1	ZINC000594866222	449780105	/nfs/dbraw/zinc/78/01/05/449780105.db2.gz	OYSIESBRAQXYPU-UHFFFAOYSA-N	-1	3	326.374	1.424	20	5		EDBDHM
CCn1cc(C[N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)nn1	ZINC000594838988	449746567	/nfs/dbraw/zinc/74/65/67/449746567.db2.gz	GBGUEFGYYMZRCG-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CCN(C)[C@H](C)C2)c([N+](=O)[O-])s1	ZINC000601357089	449870694	/nfs/dbraw/zinc/87/06/94/449870694.db2.gz	LFVFTXCYMKFPCK-SCZZXKLOSA-N	-1	3	333.435	1.726	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2cccc3c2CCCN3)nc1	ZINC000595111065	449874403	/nfs/dbraw/zinc/87/44/03/449874403.db2.gz	GDQAJHTZYJSGDK-UHFFFAOYSA-N	-1	3	348.384	1.826	20	5		EDBDHM
O=[N+]([O-])c1ccc([O-])cc1Cn1cc(CCN2CCCCC2)nn1	ZINC000603227985	450158152	/nfs/dbraw/zinc/15/81/52/450158152.db2.gz	XVVHMBXKSBSQIW-UHFFFAOYSA-N	-1	3	331.376	1.969	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](CO)CC1CCC1	ZINC000619504386	450493996	/nfs/dbraw/zinc/49/39/96/450493996.db2.gz	WJFPFPHRUGGMTP-LLVKDONJSA-N	-1	3	344.389	1.433	20	5		EDBDHM
NC(=O)C1CCC(Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1	ZINC000737738424	578277282	/nfs/dbraw/zinc/27/72/82/578277282.db2.gz	JBDGVGZLZUOBKO-UHFFFAOYSA-N	-1	3	331.336	1.231	20	5		EDBDHM
NC(=O)C1CCC(Nc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1	ZINC000737738424	578277283	/nfs/dbraw/zinc/27/72/83/578277283.db2.gz	JBDGVGZLZUOBKO-UHFFFAOYSA-N	-1	3	331.336	1.231	20	5		EDBDHM
C[C@@H]1CN2CCCC[C@@H]2CN1c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000736292178	578974503	/nfs/dbraw/zinc/97/45/03/578974503.db2.gz	IOBMGJIVYABFOU-DGCLKSJQSA-N	-1	3	343.391	1.838	20	5		EDBDHM
CCOC(=O)C[C@@H](C)Sc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000736594417	579004106	/nfs/dbraw/zinc/00/41/06/579004106.db2.gz	QUXRLFBAXTUSPC-SSDOTTSWSA-N	-1	3	338.349	1.604	20	5		EDBDHM
COC(=O)C1CCC(Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000736909178	579030755	/nfs/dbraw/zinc/03/07/55/579030755.db2.gz	IEIRFNLUVGNDDE-UHFFFAOYSA-N	-1	3	347.335	1.314	20	5		EDBDHM
COC(=O)C1CCC(Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000736909178	579030756	/nfs/dbraw/zinc/03/07/56/579030756.db2.gz	IEIRFNLUVGNDDE-UHFFFAOYSA-N	-1	3	347.335	1.314	20	5		EDBDHM
O=C([O-])[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000739505146	579213048	/nfs/dbraw/zinc/21/30/48/579213048.db2.gz	BONSZKFBCVIFCZ-GOEBONIOSA-N	-1	3	346.339	1.750	20	5		EDBDHM
Cc1cc(F)cc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])c1	ZINC000759168899	580000118	/nfs/dbraw/zinc/00/01/18/580000118.db2.gz	UFBLUEFATAVTGO-UHFFFAOYSA-N	-1	3	326.309	1.743	20	5		EDBDHM
O=C([N-]c1ccon1)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	ZINC000768166104	580208165	/nfs/dbraw/zinc/20/81/65/580208165.db2.gz	VDCUDNMPXYZCLJ-UHFFFAOYSA-N	-1	3	330.256	1.489	20	5		EDBDHM
O=C(CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])Nc1ccncc1[O-]	ZINC000782029546	580564547	/nfs/dbraw/zinc/56/45/47/580564547.db2.gz	UMVWLRDVZRNADR-UHFFFAOYSA-N	-1	3	332.272	1.597	20	5		EDBDHM
O=C(CNC(=O)c1cccc([O-])c1)OCc1ccc([N+](=O)[O-])c(F)c1	ZINC000784827853	580629668	/nfs/dbraw/zinc/62/96/68/580629668.db2.gz	YJSIMPGHGPLHNR-UHFFFAOYSA-N	-1	3	348.286	1.913	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2COC[C@H]2C2CC2)c(Cl)c1	ZINC000908414599	592486740	/nfs/dbraw/zinc/48/67/40/592486740.db2.gz	OYRXJIBEMPQWBK-JQWIXIFHSA-N	-1	3	346.792	1.952	20	5		EDBDHM
O=C(Nc1ccncc1-c1nnn[n-]1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000738197994	593110204	/nfs/dbraw/zinc/11/02/04/593110204.db2.gz	UMNFFWIIIQICCR-UHFFFAOYSA-N	-1	3	345.706	1.498	20	5		EDBDHM
O=C(Nc1ccncc1-c1nn[n-]n1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000738197994	593110205	/nfs/dbraw/zinc/11/02/05/593110205.db2.gz	UMNFFWIIIQICCR-UHFFFAOYSA-N	-1	3	345.706	1.498	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1C(=O)OC[C@H]1CCCN1CC(=O)[O-]	ZINC000818611492	593707897	/nfs/dbraw/zinc/70/78/97/593707897.db2.gz	SRZKMIXJBRDGJH-LLVKDONJSA-N	-1	3	338.316	1.309	20	5		EDBDHM
C[C@H](NC(=O)c1cc(-c2nnn[n-]2)cn1C)c1cccc([N+](=O)[O-])c1	ZINC000820385485	593815240	/nfs/dbraw/zinc/81/52/40/593815240.db2.gz	SJXZHOKLFXFVTD-VIFPVBQESA-N	-1	3	341.331	1.604	20	5		EDBDHM
C[C@H](NC(=O)c1cc(-c2nn[n-]n2)cn1C)c1cccc([N+](=O)[O-])c1	ZINC000820385485	593815241	/nfs/dbraw/zinc/81/52/41/593815241.db2.gz	SJXZHOKLFXFVTD-VIFPVBQESA-N	-1	3	341.331	1.604	20	5		EDBDHM
CCN1C[C@H](C)N(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000825453678	594187634	/nfs/dbraw/zinc/18/76/34/594187634.db2.gz	WMBVVIXRBMXRLJ-QWRGUYRKSA-N	-1	3	331.380	1.694	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCc2ccc(F)cc2)c(-c2nnn[n-]2)c1	ZINC000823651533	594224649	/nfs/dbraw/zinc/22/46/49/594224649.db2.gz	NCHQVVRKVKRRIG-UHFFFAOYSA-N	-1	3	329.295	1.964	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCc2ccc(F)cc2)c(-c2nn[n-]n2)c1	ZINC000823651533	594224650	/nfs/dbraw/zinc/22/46/50/594224650.db2.gz	NCHQVVRKVKRRIG-UHFFFAOYSA-N	-1	3	329.295	1.964	20	5		EDBDHM
COc1ccc(Cn2cc([N+](=O)[O-])cc(C)c2=O)cc1-c1nnn[n-]1	ZINC000826208428	594379161	/nfs/dbraw/zinc/37/91/61/594379161.db2.gz	KBLGLOLEKUCWKZ-UHFFFAOYSA-N	-1	3	342.315	1.302	20	5		EDBDHM
COc1ccc(Cn2cc([N+](=O)[O-])cc(C)c2=O)cc1-c1nn[n-]n1	ZINC000826208428	594379163	/nfs/dbraw/zinc/37/91/63/594379163.db2.gz	KBLGLOLEKUCWKZ-UHFFFAOYSA-N	-1	3	342.315	1.302	20	5		EDBDHM
Cc1cc(-c2nnn[n-]2)ccc1C(=O)OCCn1ccc([N+](=O)[O-])n1	ZINC000826252218	594399548	/nfs/dbraw/zinc/39/95/48/594399548.db2.gz	UVNOFPPIIWZECX-UHFFFAOYSA-N	-1	3	343.303	1.137	20	5		EDBDHM
Cc1cc(-c2nn[n-]n2)ccc1C(=O)OCCn1ccc([N+](=O)[O-])n1	ZINC000826252218	594399551	/nfs/dbraw/zinc/39/95/51/594399551.db2.gz	UVNOFPPIIWZECX-UHFFFAOYSA-N	-1	3	343.303	1.137	20	5		EDBDHM
Cc1nccn1CCCN(C)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000826331036	594429412	/nfs/dbraw/zinc/42/94/12/594429412.db2.gz	QRCMGBZFRRVDKW-UHFFFAOYSA-N	-1	3	342.363	1.806	20	5		EDBDHM
Cc1nccn1CCCN(C)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000826331036	594429415	/nfs/dbraw/zinc/42/94/15/594429415.db2.gz	QRCMGBZFRRVDKW-UHFFFAOYSA-N	-1	3	342.363	1.806	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)c(-c3nnn[n-]3)c2)n1	ZINC000826362839	594445103	/nfs/dbraw/zinc/44/51/03/594445103.db2.gz	KWUQYHTYXOUSQS-UHFFFAOYSA-N	-1	3	348.710	1.414	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)c(-c3nn[n-]n3)c2)n1	ZINC000826362839	594445106	/nfs/dbraw/zinc/44/51/06/594445106.db2.gz	KWUQYHTYXOUSQS-UHFFFAOYSA-N	-1	3	348.710	1.414	20	5		EDBDHM
O=[N+]([O-])c1cccc([C@@H](O)COc2ccc(-c3nnn[n-]3)cc2)c1	ZINC000826499687	594503571	/nfs/dbraw/zinc/50/35/71/594503571.db2.gz	SGBQHUVEOXQSSI-AWEZNQCLSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1cccc([C@@H](O)COc2ccc(-c3nn[n-]n3)cc2)c1	ZINC000826499687	594503573	/nfs/dbraw/zinc/50/35/73/594503573.db2.gz	SGBQHUVEOXQSSI-AWEZNQCLSA-N	-1	3	327.300	1.887	20	5		EDBDHM
CC1=C([O-])N(C)S(=O)(=O)N1Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000829561918	594640723	/nfs/dbraw/zinc/64/07/23/594640723.db2.gz	WSWAOIJINKDMAA-SSDOTTSWSA-N	-1	3	333.753	1.156	20	5		EDBDHM
NC(=O)c1ccc(CNC2(CC(=O)[O-])CCCCC2)c([N+](=O)[O-])c1	ZINC000833085034	594796621	/nfs/dbraw/zinc/79/66/21/594796621.db2.gz	FDKRVYPOQZGLDV-UHFFFAOYSA-N	-1	3	335.360	1.961	20	5		EDBDHM
Cc1nc([N+](=O)[O-])cn1CCC(=O)OCc1cc(=O)[n-]c(C2CC2)n1	ZINC000837471712	595118962	/nfs/dbraw/zinc/11/89/62/595118962.db2.gz	OUCSZVACLXHVIJ-UHFFFAOYSA-N	-1	3	347.331	1.606	20	5		EDBDHM
CN1CCC(O[N-]C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1	ZINC000846646067	595291595	/nfs/dbraw/zinc/29/15/95/595291595.db2.gz	IMPTXVJVOOLJTQ-UHFFFAOYSA-N	-1	3	325.390	1.829	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(OC)OC	ZINC000849405827	595521353	/nfs/dbraw/zinc/52/13/53/595521353.db2.gz	QAGZREANTRMOJC-NSHDSACASA-N	-1	3	346.405	1.887	20	5		EDBDHM
C[C@H]1CN(CC[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000849429385	595525060	/nfs/dbraw/zinc/52/50/60/595525060.db2.gz	PCVKAPONPDUYDO-UWVGGRQHSA-N	-1	3	349.434	1.044	20	5		EDBDHM
O=C(N[C@@H]1[C@H]2CN(c3cc[n-]c(=O)c3[N+](=O)[O-])C[C@H]21)c1ccns1	ZINC001060442903	695065682	/nfs/dbraw/zinc/06/56/82/695065682.db2.gz	WHDBNUOHRCPBPZ-VROVMSAKSA-N	-1	3	347.356	1.017	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](C)N2CCCC2)cc1C	ZINC000560400446	306267494	/nfs/dbraw/zinc/26/74/94/306267494.db2.gz	QUMBOUCMFQUSSW-CYBMUJFWSA-N	-1	3	341.433	1.974	20	5		EDBDHM
O=[N+]([O-])c1ccc(CCS(=O)(=O)[N-]Cc2nccs2)cc1	ZINC000183504753	235113983	/nfs/dbraw/zinc/11/39/83/235113983.db2.gz	SSOSYBMQXRBORZ-UHFFFAOYSA-N	-1	3	327.387	1.713	20	5		EDBDHM
O=C(NCCN1CCc2ccccc2C1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000186886359	236054557	/nfs/dbraw/zinc/05/45/57/236054557.db2.gz	SRLGLZQEHRQVAQ-UHFFFAOYSA-N	-1	3	342.355	1.484	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1CCC1	ZINC000273134993	201254586	/nfs/dbraw/zinc/25/45/86/201254586.db2.gz	JGYSEAYCMWMULI-UHFFFAOYSA-N	-1	3	328.346	1.460	20	5		EDBDHM
Cc1noc(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)n1	ZINC000101575539	204011446	/nfs/dbraw/zinc/01/14/46/204011446.db2.gz	SBVPDSZVKBNKJL-UHFFFAOYSA-N	-1	3	346.752	1.461	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCSCCCO	ZINC000228555404	139023340	/nfs/dbraw/zinc/02/33/40/139023340.db2.gz	IMHQRIBQPLNJEG-UHFFFAOYSA-N	-1	3	334.419	1.297	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2cccc(S(C)(=O)=O)c2)n1	ZINC000427110564	254503276	/nfs/dbraw/zinc/50/32/76/254503276.db2.gz	LXNORRXHRLATIV-UHFFFAOYSA-N	-1	3	338.345	1.467	20	5		EDBDHM
CC[C@@H](C)[C@H](O)C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000443275832	254574783	/nfs/dbraw/zinc/57/47/83/254574783.db2.gz	YFJFCMCJFMSIHT-LDYMZIIASA-N	-1	3	336.797	1.934	20	5		EDBDHM
CN(CC[N-]S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-])C1CC1	ZINC000263693935	139353432	/nfs/dbraw/zinc/35/34/32/139353432.db2.gz	PJLRKRYGYSSCKN-UHFFFAOYSA-N	-1	3	333.797	1.621	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C1CC1	ZINC000263980746	139373687	/nfs/dbraw/zinc/37/36/87/139373687.db2.gz	FWJSWPGDKJWZIW-MRVPVSSYSA-N	-1	3	328.346	1.443	20	5		EDBDHM
CCC(CC)[C@H](O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000269846621	140005636	/nfs/dbraw/zinc/00/56/36/140005636.db2.gz	ZFVAEYUCLSYVGN-GFCCVEGCSA-N	-1	3	346.405	1.679	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H]1CCO[C@@H](C)C1	ZINC000271238167	140261740	/nfs/dbraw/zinc/26/17/40/140261740.db2.gz	CQTFUNNWWPXLJR-NWDGAFQWSA-N	-1	3	328.390	1.997	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](C)[C@@H]2CCCOC2)c([N+](=O)[O-])c1	ZINC000355719894	150373727	/nfs/dbraw/zinc/37/37/27/150373727.db2.gz	XORVXTXTUVYXGP-VXGBXAGGSA-N	-1	3	328.390	1.997	20	5		EDBDHM
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])[C@@H]1OC	ZINC000274831048	268217855	/nfs/dbraw/zinc/21/78/55/268217855.db2.gz	ZEALARNRFSDPRT-BNOWGMLFSA-N	-1	3	344.389	1.207	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CC2(C)COC2)cc1[N+](=O)[O-]	ZINC000275117324	268284123	/nfs/dbraw/zinc/28/41/23/268284123.db2.gz	XTGZMRUDUYIFOT-UHFFFAOYSA-N	-1	3	334.325	1.057	20	5		EDBDHM
CCc1ccc(C(=O)N2CCc3c(=O)[n-]cnc3C2)cc1[N+](=O)[O-]	ZINC000273224768	273033842	/nfs/dbraw/zinc/03/38/42/273033842.db2.gz	LSZVCTDRYACWKD-UHFFFAOYSA-N	-1	3	328.328	1.851	20	5		EDBDHM
CN1CC=C(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000273958822	273062153	/nfs/dbraw/zinc/06/21/53/273062153.db2.gz	NSKXKZGOUGVQFV-UHFFFAOYSA-N	-1	3	329.353	1.274	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2CCOC[C@H]2C)cc1[N+](=O)[O-]	ZINC000278044082	273243134	/nfs/dbraw/zinc/24/31/34/273243134.db2.gz	XSTHIZSVSVBFEH-KCJUWKMLSA-N	-1	3	348.352	1.446	20	5		EDBDHM
O=C([N-]c1cc2c(cc1[N+](=O)[O-])OCCCO2)c1cc2n(n1)CCO2	ZINC000368293443	280011552	/nfs/dbraw/zinc/01/15/52/280011552.db2.gz	WXYPTPNKUYRGTB-UHFFFAOYSA-N	-1	3	346.299	1.597	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1=CCCOC1	ZINC000287444201	288239629	/nfs/dbraw/zinc/23/96/29/288239629.db2.gz	NWWLHFPPHVMPIR-UHFFFAOYSA-N	-1	3	328.346	1.228	20	5		EDBDHM
CC(C)[C@](C)([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C(N)=O	ZINC000287923365	288356812	/nfs/dbraw/zinc/35/68/12/288356812.db2.gz	PBFBLXQKIMSEHV-ZDUSSCGKSA-N	-1	3	329.303	1.703	20	5		EDBDHM
CO[C@@](C)(C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C1CC1	ZINC000360250240	294076388	/nfs/dbraw/zinc/07/63/88/294076388.db2.gz	HHMPIPWONDSJTF-AWEZNQCLSA-N	-1	3	328.390	1.997	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H]1CCNCC1(F)F	ZINC000420465763	304761695	/nfs/dbraw/zinc/76/16/95/304761695.db2.gz	LJJGAYINLNVCHN-VIFPVBQESA-N	-1	3	335.332	1.118	20	5		EDBDHM
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)[N-]OCC1CC1	ZINC000293722165	303009475	/nfs/dbraw/zinc/00/94/75/303009475.db2.gz	GUOWVLKKVWIADJ-UHFFFAOYSA-N	-1	3	335.316	1.741	20	5		EDBDHM
C[C@@H]1COCC[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000432322712	305091265	/nfs/dbraw/zinc/09/12/65/305091265.db2.gz	BZXMKYOCMVDAAT-SCZZXKLOSA-N	-1	3	334.781	1.952	20	5		EDBDHM
COC[C@](C)(O)CC[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000451657388	305359839	/nfs/dbraw/zinc/35/98/39/305359839.db2.gz	KQMUZCXLTRZPHG-CQSZACIVSA-N	-1	3	346.405	1.277	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000535394260	306013359	/nfs/dbraw/zinc/01/33/59/306013359.db2.gz	SXWDUBGWRCSXOX-GFCCVEGCSA-N	-1	3	343.343	1.247	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1c(C)noc1C	ZINC000063198966	441317714	/nfs/dbraw/zinc/31/77/14/441317714.db2.gz	PMYBUZQETIUNDT-UHFFFAOYSA-N	-1	3	341.345	1.687	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1cccc(C)n1	ZINC000055277022	441637051	/nfs/dbraw/zinc/63/70/51/441637051.db2.gz	GCZVLOUFYABVDW-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)[N-]Cc2ccnc(C)n2)c1C	ZINC000056126615	441691006	/nfs/dbraw/zinc/69/10/06/441691006.db2.gz	VMZRBZIJVCIXRX-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
CN(C)CCN(Cc1ccccn1)C(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000125916454	442059931	/nfs/dbraw/zinc/05/99/31/442059931.db2.gz	UHZIIBKNACJGAE-UHFFFAOYSA-N	-1	3	344.371	1.899	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCC(=O)N(C)C2)c1C	ZINC000120789037	442133524	/nfs/dbraw/zinc/13/35/24/442133524.db2.gz	RZGFNUNKAQVRMT-NSHDSACASA-N	-1	3	341.389	1.111	20	5		EDBDHM
CCCc1[nH]nc(C(=O)[N-]c2cc(C(=O)N(C)C)ccn2)c1[N+](=O)[O-]	ZINC000163204441	442150261	/nfs/dbraw/zinc/15/02/61/442150261.db2.gz	ULWAIPJJCNPOAZ-UHFFFAOYSA-N	-1	3	346.347	1.620	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1[C@@H]2CCO[C@@H]2C1(C)C	ZINC000153370776	442278183	/nfs/dbraw/zinc/27/81/83/442278183.db2.gz	BNNHGNQDAVBRHE-BPNCWPANSA-N	-1	3	340.401	1.995	20	5		EDBDHM
C[C@H](O)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000154281455	442330609	/nfs/dbraw/zinc/33/06/09/442330609.db2.gz	VZHLHFNZMYPSCU-ZETCQYMHSA-N	-1	3	342.295	1.663	20	5		EDBDHM
CC(C)(C)C(=O)C[N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1	ZINC000133396954	442416617	/nfs/dbraw/zinc/41/66/17/442416617.db2.gz	RPWXPYYWVQIHML-UHFFFAOYSA-N	-1	3	328.390	1.672	20	5		EDBDHM
CC/C=C(\C)C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000172240285	442428399	/nfs/dbraw/zinc/42/83/99/442428399.db2.gz	PVVLKWPDTPNWEV-IZZDOVSWSA-N	-1	3	341.389	1.346	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CCOC2)c(C(F)(F)F)c1	ZINC000178818801	442494213	/nfs/dbraw/zinc/49/42/13/442494213.db2.gz	KJGUUTBLGZXTOJ-SSDOTTSWSA-N	-1	3	340.279	1.681	20	5		EDBDHM
CC(C)[C@](C)(O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000178743542	442472457	/nfs/dbraw/zinc/47/24/57/442472457.db2.gz	ZULDNTMQVJKEJL-GFCCVEGCSA-N	-1	3	336.797	1.934	20	5		EDBDHM
Cc1cnc(C[N-]S(=O)(=O)CCc2ccccc2[N+](=O)[O-])o1	ZINC000178954446	442537787	/nfs/dbraw/zinc/53/77/87/442537787.db2.gz	ADTMVQCGNNGLPE-UHFFFAOYSA-N	-1	3	325.346	1.553	20	5		EDBDHM
CCOC(=O)c1ccc(NC(=O)Cn2cc([N+](=O)[O-])nc2C)c([O-])c1	ZINC000265875722	442953484	/nfs/dbraw/zinc/95/34/84/442953484.db2.gz	BAWVZMNROOVTPN-UHFFFAOYSA-N	-1	3	348.315	1.621	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](C)CCCO)c1C	ZINC000295321610	318642912	/nfs/dbraw/zinc/64/29/12/318642912.db2.gz	PQAZNARPCFRONF-SNVBAGLBSA-N	-1	3	330.406	1.899	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]C[C@](C)(O)C(C)C)cc1[N+](=O)[O-]	ZINC000184883851	443092073	/nfs/dbraw/zinc/09/20/73/443092073.db2.gz	LNYHLBJQPNKISL-ZDUSSCGKSA-N	-1	3	334.369	1.728	20	5		EDBDHM
CCOC(=O)CCC[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000268886605	443137496	/nfs/dbraw/zinc/13/74/96/443137496.db2.gz	SSORPZANKXPUAC-UHFFFAOYSA-N	-1	3	344.389	1.833	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CS[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000416583591	319447858	/nfs/dbraw/zinc/44/78/58/319447858.db2.gz	FRFGUWREUSLIPC-RKDXNWHRSA-N	-1	3	332.403	1.776	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC2(O)CCCC2)c([N+](=O)[O-])c1	ZINC000269671064	443388783	/nfs/dbraw/zinc/38/87/83/443388783.db2.gz	DLPIGJPQSVXDIX-UHFFFAOYSA-N	-1	3	330.362	1.187	20	5		EDBDHM
COCC[C@@](C)(O)C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000269790899	443443059	/nfs/dbraw/zinc/44/30/59/443443059.db2.gz	QTDBKTVWXCTQEL-CQSZACIVSA-N	-1	3	346.405	1.277	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](CO)CC(C)C)c([N+](=O)[O-])c1	ZINC000269683386	443394172	/nfs/dbraw/zinc/39/41/72/443394172.db2.gz	GOEYQRPIQBVJBV-JTQLQIEISA-N	-1	3	332.378	1.289	20	5		EDBDHM
CS[C@@H]1CN(C(=O)c2cc([O-])cc([N+](=O)[O-])c2)C[C@H]1N(C)C	ZINC000272665463	443401533	/nfs/dbraw/zinc/40/15/33/443401533.db2.gz	IUZIIZAWEWMFJX-CHWSQXEVSA-N	-1	3	325.390	1.418	20	5		EDBDHM
CSC[C@](C)(O)C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000269802347	443447277	/nfs/dbraw/zinc/44/72/77/443447277.db2.gz	SQYUAQJDWYBICB-CYBMUJFWSA-N	-1	3	348.446	1.604	20	5		EDBDHM
Cc1ccnc([N-]c2cnn(CCN3CCOCC3)c2)c1[N+](=O)[O-]	ZINC000265299544	443599973	/nfs/dbraw/zinc/59/99/73/443599973.db2.gz	ZQGJZINHZXEPFK-UHFFFAOYSA-N	-1	3	332.364	1.571	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2cccnn2)c(Cl)c1	ZINC000443941392	320115641	/nfs/dbraw/zinc/11/56/41/320115641.db2.gz	KQHAMYWNKSBQKM-UHFFFAOYSA-N	-1	3	328.737	1.517	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CC2CCOCC2)c1[N+](=O)[O-]	ZINC000189925622	533704799	/nfs/dbraw/zinc/70/47/99/533704799.db2.gz	FIVTWZMFUXNFLH-UHFFFAOYSA-N	-1	3	328.390	1.917	20	5		EDBDHM
COC(=O)C[C@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000314395495	444299868	/nfs/dbraw/zinc/29/98/68/444299868.db2.gz	VQPUKEBPCZYNNT-ZETCQYMHSA-N	-1	3	336.753	1.478	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CC[C@@H](OC)C2)c([N+](=O)[O-])c1	ZINC000331014140	444359400	/nfs/dbraw/zinc/35/94/00/444359400.db2.gz	UBQXBSMOXNJMJI-VHSXEESVSA-N	-1	3	330.362	1.449	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-][C@H]2CCO[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000331041879	444371295	/nfs/dbraw/zinc/37/12/95/444371295.db2.gz	DVKGXPYNGLVTSY-SCZZXKLOSA-N	-1	3	332.353	1.888	20	5		EDBDHM
CO[C@H]1CCC[C@@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000341192168	444720429	/nfs/dbraw/zinc/72/04/29/444720429.db2.gz	OHSUWUKIXOESRA-SKDRFNHKSA-N	-1	3	332.353	1.827	20	5		EDBDHM
CCc1nc([C@@H](C)[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])n[nH]1	ZINC000342790029	444868550	/nfs/dbraw/zinc/86/85/50/444868550.db2.gz	NQOHKPFTYLFEBJ-SECBINFHSA-N	-1	3	339.377	1.623	20	5		EDBDHM
CCc1nnc([C@@H](C)[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])[nH]1	ZINC000342790029	444868554	/nfs/dbraw/zinc/86/85/54/444868554.db2.gz	NQOHKPFTYLFEBJ-SECBINFHSA-N	-1	3	339.377	1.623	20	5		EDBDHM
O=C(NCCNc1ccccc1[N+](=O)[O-])c1cc(F)cc2nn[n-]c21	ZINC000337424054	445074266	/nfs/dbraw/zinc/07/42/66/445074266.db2.gz	BWOZOXUTVVUCQJ-UHFFFAOYSA-N	-1	3	344.306	1.847	20	5		EDBDHM
O=C(NCCNc1ccccc1[N+](=O)[O-])c1cc(F)cc2[n-]nnc21	ZINC000337424054	445074271	/nfs/dbraw/zinc/07/42/71/445074271.db2.gz	BWOZOXUTVVUCQJ-UHFFFAOYSA-N	-1	3	344.306	1.847	20	5		EDBDHM
O=C(NCCNc1ccccc1[N+](=O)[O-])c1cc(F)cc2n[n-]nc21	ZINC000337424054	445074276	/nfs/dbraw/zinc/07/42/76/445074276.db2.gz	BWOZOXUTVVUCQJ-UHFFFAOYSA-N	-1	3	344.306	1.847	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCC[C@H]1F	ZINC000339121914	445041961	/nfs/dbraw/zinc/04/19/61/445041961.db2.gz	ALLJEDOIKJQJLY-MNOVXSKESA-N	-1	3	346.336	1.550	20	5		EDBDHM
COC(=O)c1cc([N-]S(=O)(=O)N2CC[C@H](C)C2)cc([N+](=O)[O-])c1	ZINC000330728238	445115141	/nfs/dbraw/zinc/11/51/41/445115141.db2.gz	IWACOKZLLMGSJR-VIFPVBQESA-N	-1	3	343.361	1.380	20	5		EDBDHM
COC(=O)C1([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)CCCC1	ZINC000343464710	445227606	/nfs/dbraw/zinc/22/76/06/445227606.db2.gz	HKWJKQQUEJSUTI-UHFFFAOYSA-N	-1	3	348.402	1.729	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)[N-]c2nc(C3CCOCC3)cs2)n1	ZINC000343529402	445239392	/nfs/dbraw/zinc/23/93/92/445239392.db2.gz	UVBQYYRDMXMBRP-UHFFFAOYSA-N	-1	3	337.361	1.931	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCN3CCCC[C@@H]23)cc1[N+](=O)[O-]	ZINC000343528584	445239214	/nfs/dbraw/zinc/23/92/14/445239214.db2.gz	ALUGBYLIMDEBFQ-MNOVXSKESA-N	-1	3	345.446	1.870	20	5		EDBDHM
C[N-]S(=O)(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)ccc1F	ZINC000359199140	446027202	/nfs/dbraw/zinc/02/72/02/446027202.db2.gz	ZOLQJWBLQDMDGC-UHFFFAOYSA-N	-1	3	342.308	1.222	20	5		EDBDHM
CCN1CCN([C@@H](C)CNC(=O)c2cc([O-])cc([N+](=O)[O-])c2)CC1	ZINC000432496404	446475137	/nfs/dbraw/zinc/47/51/37/446475137.db2.gz	VPMSCXNSJXDKSP-LBPRGKRZSA-N	-1	3	336.392	1.056	20	5		EDBDHM
COc1cc(C(=O)[N-]c2ncn(-c3ccccn3)n2)ccc1[N+](=O)[O-]	ZINC000371513676	446906250	/nfs/dbraw/zinc/90/62/50/446906250.db2.gz	GZFVVNYUWKYHSN-UHFFFAOYSA-N	-1	3	340.299	1.831	20	5		EDBDHM
CC[C@@H](C[C@@H](C)CO)[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000443325695	447032850	/nfs/dbraw/zinc/03/28/50/447032850.db2.gz	HPUFMUZVHZAXEH-NEPJUHHUSA-N	-1	3	330.406	1.979	20	5		EDBDHM
CC[C@H](C)[C@@](C)(O)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000443296057	447025774	/nfs/dbraw/zinc/02/57/74/447025774.db2.gz	OWZQFWDNSSAKMJ-HZMBPMFUSA-N	-1	3	346.405	1.679	20	5		EDBDHM
O=C(Nc1cc(-c2ccccc2)[nH]n1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000444853010	447142845	/nfs/dbraw/zinc/14/28/45/447142845.db2.gz	UQXVPHNCLUTDKN-UHFFFAOYSA-N	-1	3	325.284	2.338	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](C)c2ccn(C)n2)c1[N+](=O)[O-]	ZINC000416563981	447649064	/nfs/dbraw/zinc/64/90/64/447649064.db2.gz	RNHFCZMQOGZOSZ-NSHDSACASA-N	-1	3	338.389	1.985	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H](CC(C)C)OC	ZINC000416643536	447665894	/nfs/dbraw/zinc/66/58/94/447665894.db2.gz	HKXGGOGVBKVWJA-LBPRGKRZSA-N	-1	3	346.405	1.943	20	5		EDBDHM
COC(=O)Cc1ccc(NCCc2c(C)[n-][nH]c2=O)c([N+](=O)[O-])c1	ZINC000570363377	447993920	/nfs/dbraw/zinc/99/39/20/447993920.db2.gz	AZETUTXIARWTAP-NSHDSACASA-N	-1	3	334.332	1.234	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-])N1CCC[C@@H](C)C1	ZINC000525086516	447967060	/nfs/dbraw/zinc/96/70/60/447967060.db2.gz	AIFIHLVLJVJYNO-NEPJUHHUSA-N	-1	3	342.421	1.389	20	5		EDBDHM
CC(C)Oc1nc(N2CCc3nc[n-]c(=O)c3C2)ccc1[N+](=O)[O-]	ZINC000582677289	448310935	/nfs/dbraw/zinc/31/09/35/448310935.db2.gz	PQMCTOXTXKXDJG-UHFFFAOYSA-N	-1	3	331.332	1.835	20	5		EDBDHM
CC[C@H]1C[C@H]([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2OC)CCO1	ZINC000591468229	448374299	/nfs/dbraw/zinc/37/42/99/448374299.db2.gz	XEOONSXJHMLAOL-MNOVXSKESA-N	-1	3	344.389	1.839	20	5		EDBDHM
O=C([O-])C1CCC(O)(CN2CCc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC000573379900	448613109	/nfs/dbraw/zinc/61/31/09/448613109.db2.gz	WBEQIPNHOJPDPD-UHFFFAOYSA-N	-1	3	334.372	1.959	20	5		EDBDHM
CC(C)(C)N1CC[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1=O	ZINC000574273281	448832940	/nfs/dbraw/zinc/83/29/40/448832940.db2.gz	MERCCXQDPDIKBL-JTQLQIEISA-N	-1	3	341.389	1.273	20	5		EDBDHM
CC(C)C[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCO1	ZINC000593572872	449081039	/nfs/dbraw/zinc/08/10/39/449081039.db2.gz	MVADGWOCMBYIQD-WCQYABFASA-N	-1	3	343.405	1.862	20	5		EDBDHM
C[C@@H](COCC1CC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000593654186	449132279	/nfs/dbraw/zinc/13/22/79/449132279.db2.gz	SINVSLPMDOBUOG-VIFPVBQESA-N	-1	3	332.353	1.827	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC[C@@]1(O)CCCOC1	ZINC000593662973	449136825	/nfs/dbraw/zinc/13/68/25/449136825.db2.gz	KFSWTOPDMHEGOY-AWEZNQCLSA-N	-1	3	344.389	1.113	20	5		EDBDHM
COCCOC[C@H]1CCN(Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1	ZINC000593739394	449173028	/nfs/dbraw/zinc/17/30/28/449173028.db2.gz	CQNUPSQCEAERQS-LBPRGKRZSA-N	-1	3	338.360	1.778	20	5		EDBDHM
COC(=O)C(C)(C)[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F	ZINC000590589627	449204759	/nfs/dbraw/zinc/20/47/59/449204759.db2.gz	YEXRZUHLSMJGCY-UHFFFAOYSA-N	-1	3	334.325	1.272	20	5		EDBDHM
O=C(NC[C@H]1CCN1C1CCCCC1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000600228974	449254038	/nfs/dbraw/zinc/25/40/38/449254038.db2.gz	IRZAELYCGZAETC-CYBMUJFWSA-N	-1	3	334.376	1.832	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C2(CO)CC2)c(C(F)(F)F)c1	ZINC000611407932	449282430	/nfs/dbraw/zinc/28/24/30/449282430.db2.gz	PLVPUFHHGFFAPR-UHFFFAOYSA-N	-1	3	340.279	1.417	20	5		EDBDHM
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C12CCC2	ZINC000593554174	449344703	/nfs/dbraw/zinc/34/47/03/449344703.db2.gz	YODSQCWIYHEKEA-VXGBXAGGSA-N	-1	3	341.389	1.616	20	5		EDBDHM
O=C(NC1CCN([C@H]2CCOC2)CC1)c1cccc([O-])c1[N+](=O)[O-]	ZINC000598375885	449369425	/nfs/dbraw/zinc/36/94/25/449369425.db2.gz	IVXCALPJOGHENP-LBPRGKRZSA-N	-1	3	335.360	1.284	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])N(C1CC1)C1CC1	ZINC000600358010	449338482	/nfs/dbraw/zinc/33/84/82/449338482.db2.gz	DAISRIFVKYWSLN-UHFFFAOYSA-N	-1	3	339.373	1.027	20	5		EDBDHM
O=c1[n-]ccc(NCc2cnc(N3CCOCC3)c(F)c2)c1[N+](=O)[O-]	ZINC000596196061	449408101	/nfs/dbraw/zinc/40/81/01/449408101.db2.gz	HYBBETPDMBFNRR-UHFFFAOYSA-N	-1	3	349.322	1.678	20	5		EDBDHM
O=C1Nc2ccccc2[C@@]12CCN(c1cc[n-]c(=O)c1[N+](=O)[O-])C2	ZINC000596201399	449410805	/nfs/dbraw/zinc/41/08/05/449410805.db2.gz	VOERPBKUKSZDFH-INIZCTEOSA-N	-1	3	326.312	1.796	20	5		EDBDHM
CCOC(=O)C1(COC)CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596219315	449421920	/nfs/dbraw/zinc/42/19/20/449421920.db2.gz	PPOHKGYMAAJLAV-UHFFFAOYSA-N	-1	3	339.348	1.492	20	5		EDBDHM
CCOC(=O)C(C)(C)n1cc(Nc2cc[n-]c(=O)c2[N+](=O)[O-])cn1	ZINC000596167644	449393461	/nfs/dbraw/zinc/39/34/61/449393461.db2.gz	FZNUOZONFRQKFX-UHFFFAOYSA-N	-1	3	335.320	1.934	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2c2nc3sccn3c2[N+](=O)[O-])nc1=N	ZINC000596253131	449441009	/nfs/dbraw/zinc/44/10/09/449441009.db2.gz	XCDCBVGHNILVPE-ZETCQYMHSA-N	-1	3	334.365	1.187	20	5		EDBDHM
C[C@@H](CN1CCC(C)CC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000594864260	449777093	/nfs/dbraw/zinc/77/70/93/449777093.db2.gz	UHQIMUDDSMYSRP-LBPRGKRZSA-N	-1	3	342.421	1.389	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@H]2CCCN2C)c(F)cc1[N+](=O)[O-]	ZINC000601319857	449829498	/nfs/dbraw/zinc/82/94/98/449829498.db2.gz	JGHAQTRBGAKUBN-SNVBAGLBSA-N	-1	3	331.369	1.415	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)[n-]1	ZINC000617876573	449894306	/nfs/dbraw/zinc/89/43/06/449894306.db2.gz	VINVIQMVFYVYJB-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)c[n-]1	ZINC000617876573	449894310	/nfs/dbraw/zinc/89/43/10/449894310.db2.gz	VINVIQMVFYVYJB-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@H]2CCOC[C@@H]2C)c([N+](=O)[O-])s1	ZINC000601414886	449930873	/nfs/dbraw/zinc/93/08/73/449930873.db2.gz	LKIBQDPIJRUVEM-WCBMZHEXSA-N	-1	3	334.419	1.916	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](CO)CCC(C)C	ZINC000599411244	449956364	/nfs/dbraw/zinc/95/63/64/449956364.db2.gz	YCVOWKFBOSUQCY-LBPRGKRZSA-N	-1	3	330.406	1.979	20	5		EDBDHM
CCCN1CC[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000595353331	450067866	/nfs/dbraw/zinc/06/78/66/450067866.db2.gz	FKYGXNRMUKMUMI-JTQLQIEISA-N	-1	3	331.369	1.497	20	5		EDBDHM
COC(=O)[C@H]1C[C@H]([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000595397112	450111646	/nfs/dbraw/zinc/11/16/46/450111646.db2.gz	IYJHPGORZXKTFD-MGCOHNPYSA-N	-1	3	328.346	1.133	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)on1	ZINC000610161946	450150340	/nfs/dbraw/zinc/15/03/40/450150340.db2.gz	VCFRLOVYQRVLMT-UHFFFAOYSA-N	-1	3	325.346	1.932	20	5		EDBDHM
C[C@H]1CCCCN1CCC[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000610259520	450171423	/nfs/dbraw/zinc/17/14/23/450171423.db2.gz	IXQWEQNUKPEKRE-LBPRGKRZSA-N	-1	3	342.421	1.533	20	5		EDBDHM
CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000597695086	450203001	/nfs/dbraw/zinc/20/30/01/450203001.db2.gz	PWASCSRSMLGOHR-ZIAGYGMSSA-N	-1	3	335.360	1.236	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](CCO)C(C)C	ZINC000619487204	450487739	/nfs/dbraw/zinc/48/77/39/450487739.db2.gz	KRCGAPOIMGKLTR-JTQLQIEISA-N	-1	3	332.378	1.289	20	5		EDBDHM
O=C(COC(=O)c1cncc([O-])c1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000732393574	578709244	/nfs/dbraw/zinc/70/92/44/578709244.db2.gz	AJRWRQOCCZLOOW-UHFFFAOYSA-N	-1	3	343.295	1.442	20	5		EDBDHM
C[C@@H]1[C@H](C)[S@](=O)CCN1c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000736225939	578965076	/nfs/dbraw/zinc/96/50/76/578965076.db2.gz	UCLUJRLGPRJZBM-HKPSDFMSSA-N	-1	3	336.377	1.121	20	5		EDBDHM
C[C@@H]1[C@H](C)[S@](=O)CCN1c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000736225939	578965077	/nfs/dbraw/zinc/96/50/77/578965077.db2.gz	UCLUJRLGPRJZBM-HKPSDFMSSA-N	-1	3	336.377	1.121	20	5		EDBDHM
CN(C)C[C@H]1CN(c2ccc(/C=C\C(=O)[O-])cc2[N+](=O)[O-])CCO1	ZINC000737364253	579079117	/nfs/dbraw/zinc/07/91/17/579079117.db2.gz	AJSORONVOZOMPY-AGLBCWCQSA-N	-1	3	335.360	1.459	20	5		EDBDHM
CN(CCNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(=O)[O-]	ZINC000739698415	579238312	/nfs/dbraw/zinc/23/83/12/579238312.db2.gz	KWRDSQVFSLVHMC-UHFFFAOYSA-N	-1	3	333.348	1.695	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]Cc1cccc(F)n1	ZINC000747904477	579662530	/nfs/dbraw/zinc/66/25/30/579662530.db2.gz	HMRXTXKYIXZIIF-UHFFFAOYSA-N	-1	3	325.321	1.916	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)n[n-]1	ZINC000777779097	580450025	/nfs/dbraw/zinc/45/00/25/580450025.db2.gz	FUCFIHIEDSRIPD-UHFFFAOYSA-N	-1	3	333.304	1.638	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)[n-]n1	ZINC000777779097	580450026	/nfs/dbraw/zinc/45/00/26/580450026.db2.gz	FUCFIHIEDSRIPD-UHFFFAOYSA-N	-1	3	333.304	1.638	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CCOC2CCC2)cc1[N+](=O)[O-]	ZINC000777981494	580454207	/nfs/dbraw/zinc/45/42/07/580454207.db2.gz	JAQHRSGJJQOIHT-UHFFFAOYSA-N	-1	3	348.352	1.590	20	5		EDBDHM
O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCc2c(=O)[n-]cnc2C1	ZINC000752770782	579865457	/nfs/dbraw/zinc/86/54/57/579865457.db2.gz	BMKLPHXEFSNXLY-UHFFFAOYSA-N	-1	3	345.271	1.197	20	5		EDBDHM
O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)[N-][C@@H]1CCN(C2CC2)C1	ZINC000754794712	579912437	/nfs/dbraw/zinc/91/24/37/579912437.db2.gz	VZXYNPDXSLDLOZ-SNVBAGLBSA-N	-1	3	345.808	1.763	20	5		EDBDHM
O=C(NC1CCN(C[C@H]2CCCO2)CC1)c1cccc([N+](=O)[O-])c1[O-]	ZINC000769097077	580228271	/nfs/dbraw/zinc/22/82/71/580228271.db2.gz	JVYUIWSXSPQEFJ-CYBMUJFWSA-N	-1	3	349.387	1.674	20	5		EDBDHM
CCOCCO[N-]C(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-]	ZINC000772701552	580318141	/nfs/dbraw/zinc/31/81/41/580318141.db2.gz	LHSFKSDXVCZMGQ-UHFFFAOYSA-N	-1	3	328.321	1.700	20	5		EDBDHM
Cn1cc(C(=O)[N-]N2CCCC2=O)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000780707755	580531948	/nfs/dbraw/zinc/53/19/48/580531948.db2.gz	WSOKFGFUGXHZEJ-UHFFFAOYSA-N	-1	3	329.316	1.263	20	5		EDBDHM
COC(=O)CC(C)(C)[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000795120626	580913708	/nfs/dbraw/zinc/91/37/08/580913708.db2.gz	LAQLQPIYJFITRK-UHFFFAOYSA-N	-1	3	346.361	1.223	20	5		EDBDHM
O=Cc1ccc(OCC(=O)OCc2cc(=O)c([O-])co2)c([N+](=O)[O-])c1	ZINC000736822069	593040840	/nfs/dbraw/zinc/04/08/40/593040840.db2.gz	WQCPZQAXQDZMAM-UHFFFAOYSA-N	-1	3	349.251	1.188	20	5		EDBDHM
O=C1[C@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C[C@H]2CCCCN12	ZINC000841532468	593202046	/nfs/dbraw/zinc/20/20/46/593202046.db2.gz	TUQUKBCIHTVKEG-PSASIEDQSA-N	-1	3	345.402	1.088	20	5		EDBDHM
CC(C)(CO)[C@@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C1CC1	ZINC000810107275	593383758	/nfs/dbraw/zinc/38/37/58/593383758.db2.gz	ZXULSPFRUUNSKR-NSHDSACASA-N	-1	3	334.419	1.732	20	5		EDBDHM
Nc1ccc(NCC[N-]S(=O)(=O)c2cccs2)c([N+](=O)[O-])c1	ZINC000804564989	593425056	/nfs/dbraw/zinc/42/50/56/593425056.db2.gz	VRCYBSPXBINKMF-UHFFFAOYSA-N	-1	3	342.402	1.629	20	5		EDBDHM
Cn1nc(Br)cc1NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000816712911	593543197	/nfs/dbraw/zinc/54/31/97/593543197.db2.gz	TZEHQIOOKQCZRY-UHFFFAOYSA-N	-1	3	342.109	1.444	20	5		EDBDHM
Cc1nccnc1CC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000815077966	593613857	/nfs/dbraw/zinc/61/38/57/593613857.db2.gz	JUJBXDIQKJVPLH-UHFFFAOYSA-N	-1	3	328.375	1.276	20	5		EDBDHM
C[C@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)c1ccc(-c2nnn[n-]2)cc1	ZINC000820499936	593824350	/nfs/dbraw/zinc/82/43/50/593824350.db2.gz	ARHICTPLQLPZHN-VIFPVBQESA-N	-1	3	343.303	1.276	20	5		EDBDHM
C[C@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)c1ccc(-c2nn[n-]n2)cc1	ZINC000820499936	593824351	/nfs/dbraw/zinc/82/43/51/593824351.db2.gz	ARHICTPLQLPZHN-VIFPVBQESA-N	-1	3	343.303	1.276	20	5		EDBDHM
COC(=O)[C@H]1CN(c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000821656848	593900015	/nfs/dbraw/zinc/90/00/15/593900015.db2.gz	APCAZVUTPNPRMU-WPRPVWTQSA-N	-1	3	332.320	1.020	20	5		EDBDHM
COC(=O)[C@H]1CN(c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000821656848	593900016	/nfs/dbraw/zinc/90/00/16/593900016.db2.gz	APCAZVUTPNPRMU-WPRPVWTQSA-N	-1	3	332.320	1.020	20	5		EDBDHM
CC[C@@](C)(O)CNc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820862819	593909582	/nfs/dbraw/zinc/90/95/82/593909582.db2.gz	RJSMSTKLYKHBJN-OAHLLOKOSA-N	-1	3	343.347	1.896	20	5		EDBDHM
CC[C@@](C)(O)CNc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820862819	593909583	/nfs/dbraw/zinc/90/95/83/593909583.db2.gz	RJSMSTKLYKHBJN-OAHLLOKOSA-N	-1	3	343.347	1.896	20	5		EDBDHM
CC[C@@H](NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000820920156	593922291	/nfs/dbraw/zinc/92/22/91/593922291.db2.gz	LZVNCNUUQFRFLK-GFCCVEGCSA-N	-1	3	341.331	1.984	20	5		EDBDHM
CC[C@@H](NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000820920156	593922293	/nfs/dbraw/zinc/92/22/93/593922293.db2.gz	LZVNCNUUQFRFLK-GFCCVEGCSA-N	-1	3	341.331	1.984	20	5		EDBDHM
COc1ccc(COC(=O)c2cc(-c3nnn[n-]3)c[nH]2)cc1[N+](=O)[O-]	ZINC000821825009	593949556	/nfs/dbraw/zinc/94/95/56/593949556.db2.gz	SKKGRTFLRTUJIP-UHFFFAOYSA-N	-1	3	344.287	1.469	20	5		EDBDHM
COc1ccc(COC(=O)c2cc(-c3nn[n-]n3)c[nH]2)cc1[N+](=O)[O-]	ZINC000821825009	593949557	/nfs/dbraw/zinc/94/95/57/593949557.db2.gz	SKKGRTFLRTUJIP-UHFFFAOYSA-N	-1	3	344.287	1.469	20	5		EDBDHM
Cc1nn(C)c(C(=O)Nc2cccc(-c3nnn[n-]3)c2C)c1[N+](=O)[O-]	ZINC000822486790	594056222	/nfs/dbraw/zinc/05/62/22/594056222.db2.gz	SHSCSPNOCJDVQV-UHFFFAOYSA-N	-1	3	342.319	1.378	20	5		EDBDHM
Cc1nn(C)c(C(=O)Nc2cccc(-c3nn[n-]n3)c2C)c1[N+](=O)[O-]	ZINC000822486790	594056223	/nfs/dbraw/zinc/05/62/23/594056223.db2.gz	SHSCSPNOCJDVQV-UHFFFAOYSA-N	-1	3	342.319	1.378	20	5		EDBDHM
Cn1cc(-c2nnn[n-]2)cc1-c1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000822622705	594075124	/nfs/dbraw/zinc/07/51/24/594075124.db2.gz	HIZFAHLQEDHKQT-UHFFFAOYSA-N	-1	3	338.287	1.830	20	5		EDBDHM
Cn1cc(-c2nn[n-]n2)cc1-c1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000822622705	594075125	/nfs/dbraw/zinc/07/51/25/594075125.db2.gz	HIZFAHLQEDHKQT-UHFFFAOYSA-N	-1	3	338.287	1.830	20	5		EDBDHM
O=C(OCc1cc(F)ccc1[N+](=O)[O-])c1cc(-c2nnn[n-]2)c[nH]1	ZINC000823417438	594199612	/nfs/dbraw/zinc/19/96/12/594199612.db2.gz	ANICKVOTEXCYOJ-UHFFFAOYSA-N	-1	3	332.251	1.599	20	5		EDBDHM
O=C(OCc1cc(F)ccc1[N+](=O)[O-])c1cc(-c2nn[n-]n2)c[nH]1	ZINC000823417438	594199613	/nfs/dbraw/zinc/19/96/13/594199613.db2.gz	ANICKVOTEXCYOJ-UHFFFAOYSA-N	-1	3	332.251	1.599	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H](O)c2ccccc2)c(-c2nnn[n-]2)c1	ZINC000823651685	594224680	/nfs/dbraw/zinc/22/46/80/594224680.db2.gz	NISIZKTYTPNTCX-LBPRGKRZSA-N	-1	3	327.304	1.315	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H](O)c2ccccc2)c(-c2nn[n-]n2)c1	ZINC000823651685	594224681	/nfs/dbraw/zinc/22/46/81/594224681.db2.gz	NISIZKTYTPNTCX-LBPRGKRZSA-N	-1	3	327.304	1.315	20	5		EDBDHM
COc1cc(-c2nnn[n-]2)ccc1COc1cccnc1[N+](=O)[O-]	ZINC000826173504	594362083	/nfs/dbraw/zinc/36/20/83/594362083.db2.gz	HHESJZLFWCTLOH-UHFFFAOYSA-N	-1	3	328.288	1.758	20	5		EDBDHM
COc1cc(-c2nn[n-]n2)ccc1COc1cccnc1[N+](=O)[O-]	ZINC000826173504	594362085	/nfs/dbraw/zinc/36/20/85/594362085.db2.gz	HHESJZLFWCTLOH-UHFFFAOYSA-N	-1	3	328.288	1.758	20	5		EDBDHM
O=[N+]([O-])c1ccc(OC[C@H](O)c2ccc(-c3nnn[n-]3)cc2)cc1	ZINC000826498787	594502738	/nfs/dbraw/zinc/50/27/38/594502738.db2.gz	JPCDSDUXYNNDNX-AWEZNQCLSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1ccc(OC[C@H](O)c2ccc(-c3nn[n-]n3)cc2)cc1	ZINC000826498787	594502741	/nfs/dbraw/zinc/50/27/41/594502741.db2.gz	JPCDSDUXYNNDNX-AWEZNQCLSA-N	-1	3	327.300	1.887	20	5		EDBDHM
COc1ccc(OCCN(C)[C@H]2CCN(C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000829499692	594626752	/nfs/dbraw/zinc/62/67/52/594626752.db2.gz	BSDJDYKDCZJSIH-NSHDSACASA-N	-1	3	339.348	1.666	20	5		EDBDHM
O=C([O-])N1CCC[C@H]1[C@H]1CCCCN1CCn1cc([N+](=O)[O-])cn1	ZINC000831998286	594717885	/nfs/dbraw/zinc/71/78/85/594717885.db2.gz	TULZRZPOXIJMES-KGLIPLIRSA-N	-1	3	337.380	1.788	20	5		EDBDHM
O=C([O-])N1CCC[C@@H]1C1CCN(CCn2ccc([N+](=O)[O-])n2)CC1	ZINC000832006723	594718710	/nfs/dbraw/zinc/71/87/10/594718710.db2.gz	UXCVGUGBENWCQC-CYBMUJFWSA-N	-1	3	337.380	1.646	20	5		EDBDHM
C[C@H](NC(=O)[O-])[C@H]1CCCN(CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000833814100	594936171	/nfs/dbraw/zinc/93/61/71/594936171.db2.gz	RHXGADHQBOYWSB-RYUDHWBXSA-N	-1	3	338.364	1.125	20	5		EDBDHM
COCCOC[C@H](C)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848584422	595409648	/nfs/dbraw/zinc/40/96/48/595409648.db2.gz	XIMCNRUHSACVEA-JTQLQIEISA-N	-1	3	348.302	1.734	20	5		EDBDHM
C[C@@H]1OCC[C@@]1(O)C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848592057	595411898	/nfs/dbraw/zinc/41/18/98/595411898.db2.gz	WGAQIGSOJUMXCV-TVQRCGJNSA-N	-1	3	346.286	1.223	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1C=CCC1	ZINC000849428484	595524871	/nfs/dbraw/zinc/52/48/71/595524871.db2.gz	RZHASBFLDZBULA-SECBINFHSA-N	-1	3	326.330	1.378	20	5		EDBDHM
CC(=CC(=O)NCCCc1cc(=O)[nH][n-]1)c1ccc([N+](=O)[O-])cc1	ZINC000854485993	596095202	/nfs/dbraw/zinc/09/52/02/596095202.db2.gz	ISINFHKEMHOZEL-LUAWRHEFSA-N	-1	3	330.344	1.770	20	5		EDBDHM
C[C@@H]1C[C@@H]1COC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000859677237	596164378	/nfs/dbraw/zinc/16/43/78/596164378.db2.gz	HBWPOXWVHLWUGO-NXEZZACHSA-N	-1	3	328.346	1.072	20	5		EDBDHM
CCN1CC[C@H]1C[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F	ZINC000882763988	598046634	/nfs/dbraw/zinc/04/66/34/598046634.db2.gz	GJDPJECGCKYSTC-JTQLQIEISA-N	-1	3	331.369	1.415	20	5		EDBDHM
O=C(CNc1ccccc1[N+](=O)[O-])Nc1cccc(-c2nnn[n-]2)c1	ZINC000068201021	138192737	/nfs/dbraw/zinc/19/27/37/138192737.db2.gz	JCEPFVYBJQMZOR-UHFFFAOYSA-N	-1	3	339.315	1.826	20	5		EDBDHM
O=C(CNc1ccccc1[N+](=O)[O-])Nc1cccc(-c2nn[n-]n2)c1	ZINC000068201021	138192738	/nfs/dbraw/zinc/19/27/38/138192738.db2.gz	JCEPFVYBJQMZOR-UHFFFAOYSA-N	-1	3	339.315	1.826	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]c1ccc2nncn2c1	ZINC000183404187	138783931	/nfs/dbraw/zinc/78/39/31/138783931.db2.gz	CZBWVUGEBPQMEL-UHFFFAOYSA-N	-1	3	333.329	1.579	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](CO)C(C)(C)C)c([N+](=O)[O-])c1	ZINC000276649427	201297775	/nfs/dbraw/zinc/29/77/75/201297775.db2.gz	CVYRYRCKHMZWDS-LBPRGKRZSA-N	-1	3	332.378	1.289	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)CC(C)(C)O	ZINC000295552495	201349084	/nfs/dbraw/zinc/34/90/84/201349084.db2.gz	SJIODXLFVUPNAJ-SECBINFHSA-N	-1	3	332.378	1.431	20	5		EDBDHM
C[C@H](CCCO)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000295456715	201349552	/nfs/dbraw/zinc/34/95/52/201349552.db2.gz	ZKAYGSPRKRTGRD-SECBINFHSA-N	-1	3	336.797	1.935	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1nnc2ccccn21	ZINC000096967754	201378507	/nfs/dbraw/zinc/37/85/07/201378507.db2.gz	AOCHTLBVMZDKQV-SNVBAGLBSA-N	-1	3	347.356	1.677	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1)[C@H](C)O	ZINC000451890846	305372112	/nfs/dbraw/zinc/37/21/12/305372112.db2.gz	LTWWOBUEIPMJMI-XVKPBYJWSA-N	-1	3	336.341	1.180	20	5		EDBDHM
CC(C)Cn1cnc(S(=O)(=O)[N-]Cc2ccccc2[N+](=O)[O-])c1	ZINC000174976383	207078984	/nfs/dbraw/zinc/07/89/84/207078984.db2.gz	GBUFYEKUYHTTDM-UHFFFAOYSA-N	-1	3	338.389	1.926	20	5		EDBDHM
O=C1[N-]C(=O)[C@]2(CCCN(c3nccc4c3cccc4[N+](=O)[O-])C2)N1	ZINC000450487221	296358936	/nfs/dbraw/zinc/35/89/36/296358936.db2.gz	CQUZUXIEIODYRV-MRXNPFEDSA-N	-1	3	341.327	1.321	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@]2(C)CCO[C@H]2C)c([N+](=O)[O-])c1	ZINC000344137445	142933000	/nfs/dbraw/zinc/93/30/00/142933000.db2.gz	YKVNBKPCRJYBON-ZANVPECISA-N	-1	3	330.362	1.449	20	5		EDBDHM
C[C@H]1C[C@H]1N1CCN(C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)C[C@@H](C)C1	ZINC000346205708	143178867	/nfs/dbraw/zinc/17/88/67/143178867.db2.gz	VHNWLWXIKLGVCZ-GMXVVIOVSA-N	-1	3	334.376	1.498	20	5		EDBDHM
CN1CC[C@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000416496878	304325317	/nfs/dbraw/zinc/32/53/17/304325317.db2.gz	RBIULYHHMIZZGA-SECBINFHSA-N	-1	3	333.797	1.478	20	5		EDBDHM
CC(C)(C)c1nc(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)n[nH]1	ZINC000416548980	304330555	/nfs/dbraw/zinc/33/05/55/304330555.db2.gz	XTTLQRONRPRWMC-UHFFFAOYSA-N	-1	3	339.377	1.489	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)[C@@H]1CCCOC1	ZINC000355769453	150393110	/nfs/dbraw/zinc/39/31/10/150393110.db2.gz	YWJURZRLAGIDKV-WDEREUQCSA-N	-1	3	344.389	1.697	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@]2(C)CCCOC2)c([N+](=O)[O-])c1	ZINC000357416667	151025870	/nfs/dbraw/zinc/02/58/70/151025870.db2.gz	AFRVQOSDUIIYNT-CYBMUJFWSA-N	-1	3	330.362	1.451	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1cccn(C)c1=O	ZINC000357553289	151065984	/nfs/dbraw/zinc/06/59/84/151065984.db2.gz	SBONODVZMBEXBU-UHFFFAOYSA-N	-1	3	339.329	1.103	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@](C)(O)C2CC2)c1[N+](=O)[O-]	ZINC000360252543	151967831	/nfs/dbraw/zinc/96/78/31/151967831.db2.gz	WJHOBYZHPMGACG-CQSZACIVSA-N	-1	3	328.390	1.651	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]Cc2nc(CO)cs2)c([N+](=O)[O-])c1	ZINC000352088341	161968579	/nfs/dbraw/zinc/96/85/79/161968579.db2.gz	YNLUJUFEOYGZNY-UHFFFAOYSA-N	-1	3	343.386	1.331	20	5		EDBDHM
O=C(CNC(=O)c1cccc([O-])c1)Nc1cc(F)cc([N+](=O)[O-])c1	ZINC000352189055	162038856	/nfs/dbraw/zinc/03/88/56/162038856.db2.gz	BMLJYYVHQCXXPV-UHFFFAOYSA-N	-1	3	333.275	1.808	20	5		EDBDHM
COCC[C@H](COC)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000352529320	162233738	/nfs/dbraw/zinc/23/37/38/162233738.db2.gz	IDUGMYNSLDKVFE-GFCCVEGCSA-N	-1	3	346.405	1.541	20	5		EDBDHM
CC(C)(C(=O)N1CCc2c(nc[n-]c2=O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000273277564	268012147	/nfs/dbraw/zinc/01/21/47/268012147.db2.gz	SFMRXQSDBDQITR-UHFFFAOYSA-N	-1	3	342.355	1.953	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC1([S@@](C)=O)CCC1	ZINC000280762192	273395211	/nfs/dbraw/zinc/39/52/11/273395211.db2.gz	NNHCCVYPMZDEMJ-OAQYLSRUSA-N	-1	3	346.430	1.483	20	5		EDBDHM
COc1nc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])n[n-]1	ZINC000352646432	278079081	/nfs/dbraw/zinc/07/90/81/278079081.db2.gz	UHXWUVGXUZGFRJ-UHFFFAOYSA-N	-1	3	331.210	1.993	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(N2CCN(C(=O)c3ccc([O-])cc3)CC2)n1	ZINC000178167468	281011584	/nfs/dbraw/zinc/01/15/84/281011584.db2.gz	BXTPLXDSOGTOIP-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
NC(=O)c1ccc(CN2C[C@@H]3CCC[C@@]3(C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000262153754	295179817	/nfs/dbraw/zinc/17/98/17/295179817.db2.gz	NFIQMWJUDJZHTG-BLLLJJGKSA-N	-1	3	333.344	1.380	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2CCCN(C)C2=O)c1[N+](=O)[O-]	ZINC000360259366	301556262	/nfs/dbraw/zinc/55/62/62/301556262.db2.gz	VCYRPRVYIJMNIW-LLVKDONJSA-N	-1	3	341.389	1.111	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCOC2(C)C)c([N+](=O)[O-])c1	ZINC000295174792	303184032	/nfs/dbraw/zinc/18/40/32/303184032.db2.gz	AZGILFGSIFLXLQ-GFCCVEGCSA-N	-1	3	330.362	1.449	20	5		EDBDHM
CC[C@@](C)([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)C(=O)OC	ZINC000299658131	303644640	/nfs/dbraw/zinc/64/46/40/303644640.db2.gz	UZQAUZPXEKCCAU-CYBMUJFWSA-N	-1	3	346.361	1.223	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@@H]2CCN(C)C(=O)C2)cc1[N+](=O)[O-]	ZINC000425181779	304952186	/nfs/dbraw/zinc/95/21/86/304952186.db2.gz	HYZGZSWPDNNBDX-SECBINFHSA-N	-1	3	347.418	1.111	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC2(CCO)CCC2)c([N+](=O)[O-])c1	ZINC000443483694	305238251	/nfs/dbraw/zinc/23/82/51/305238251.db2.gz	AYGUKPHIOSJKJT-UHFFFAOYSA-N	-1	3	344.389	1.434	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]Cc2nnc(C(C)C)[nH]2)c([N+](=O)[O-])c1	ZINC000451681189	305361947	/nfs/dbraw/zinc/36/19/47/305361947.db2.gz	VYGXNKQLCFOBBE-UHFFFAOYSA-N	-1	3	339.377	1.623	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2COCC2(C)C)c1[N+](=O)[O-]	ZINC000451979062	305375816	/nfs/dbraw/zinc/37/58/16/305375816.db2.gz	PPUVKFAKVYOIHS-NSHDSACASA-N	-1	3	328.390	1.915	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1C[C@H]1C1CC1	ZINC000452052206	305380609	/nfs/dbraw/zinc/38/06/09/305380609.db2.gz	ZKQWFPODKRBBSK-JQWIXIFHSA-N	-1	3	326.374	1.928	20	5		EDBDHM
CN(C)C(=O)Cn1ccc([N-]c2c3ccccc3ncc2[N+](=O)[O-])n1	ZINC000488119936	305556831	/nfs/dbraw/zinc/55/68/31/305556831.db2.gz	BTRLCYBCFBUZEO-UHFFFAOYSA-N	-1	3	340.343	1.593	20	5		EDBDHM
Cc1csc(CC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])n1	ZINC000045808083	441042151	/nfs/dbraw/zinc/04/21/51/441042151.db2.gz	UIWNZLHILVOUQW-UHFFFAOYSA-N	-1	3	327.387	1.881	20	5		EDBDHM
O=C(NCCNc1nc2sccn2c1[N+](=O)[O-])c1ccc([O-])cc1	ZINC000047538010	441201998	/nfs/dbraw/zinc/20/19/98/441201998.db2.gz	IZSYEZNWFWZKPN-UHFFFAOYSA-N	-1	3	347.356	1.852	20	5		EDBDHM
O=C(Cc1ccccc1[N+](=O)[O-])NCCNC(=O)c1ccc([O-])cc1	ZINC000047552799	441203693	/nfs/dbraw/zinc/20/36/93/441203693.db2.gz	DKZVZANYQVGNME-UHFFFAOYSA-N	-1	3	343.339	1.389	20	5		EDBDHM
COC(=O)C(C)(C)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000060499175	441246965	/nfs/dbraw/zinc/24/69/65/441246965.db2.gz	MCOIDXJMZZIPQK-UHFFFAOYSA-N	-1	3	330.362	1.442	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1c(C)noc1C	ZINC000063199193	441318002	/nfs/dbraw/zinc/31/80/02/441318002.db2.gz	QJGUALDFCGUFCF-UHFFFAOYSA-N	-1	3	341.345	1.687	20	5		EDBDHM
COc1cc(C[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])ccn1	ZINC000056013220	441681991	/nfs/dbraw/zinc/68/19/91/441681991.db2.gz	GLWJLSAPSLTLPZ-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@H](C)Cn1cccn1	ZINC000056072789	441686246	/nfs/dbraw/zinc/68/62/46/441686246.db2.gz	KZFBCVDAOWBUER-NSHDSACASA-N	-1	3	338.389	1.714	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CCCOC1	ZINC000056130052	441691098	/nfs/dbraw/zinc/69/10/98/441691098.db2.gz	OPGYMEXOVBWTAW-JTQLQIEISA-N	-1	3	330.362	1.308	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](C)C[C@H](C)O)c1C	ZINC000120703453	442120073	/nfs/dbraw/zinc/12/00/73/442120073.db2.gz	INZVOVDRYMHSDV-ONGXEEELSA-N	-1	3	330.406	1.897	20	5		EDBDHM
C[C@H]1CC([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C[C@H](C)O1	ZINC000162970886	442135543	/nfs/dbraw/zinc/13/55/43/442135543.db2.gz	ZHLGJKWOTZUAQN-IUCAKERBSA-N	-1	3	332.353	1.968	20	5		EDBDHM
CC(C)N(C)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000155574366	442409352	/nfs/dbraw/zinc/40/93/52/442409352.db2.gz	ZBQNPCXYCAFXAO-UHFFFAOYSA-N	-1	3	335.813	1.867	20	5		EDBDHM
O=C([N-]c1cnns1)C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000192082150	442587317	/nfs/dbraw/zinc/58/73/17/442587317.db2.gz	GFFUNKFVKUQPBN-UHFFFAOYSA-N	-1	3	347.356	1.576	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2CCN(C3CC3)C2)s1	ZINC000173022159	442588091	/nfs/dbraw/zinc/58/80/91/442588091.db2.gz	JFSKNJAJNADRLT-VIFPVBQESA-N	-1	3	331.419	1.419	20	5		EDBDHM
CSCCC[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000265513544	442804167	/nfs/dbraw/zinc/80/41/67/442804167.db2.gz	PTFBOFSTFRLPTF-UHFFFAOYSA-N	-1	3	348.402	1.397	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2ccncc2C)c([N+](=O)[O-])c1	ZINC000188834100	442823342	/nfs/dbraw/zinc/82/33/42/442823342.db2.gz	FUKSDNNDVSOMMT-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCCN2CCCCC2)s1	ZINC000194397723	442889685	/nfs/dbraw/zinc/88/96/85/442889685.db2.gz	VBJBNMSFORKNTK-UHFFFAOYSA-N	-1	3	333.435	1.811	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)C1CCOCC1	ZINC000268602025	443049211	/nfs/dbraw/zinc/04/92/11/443049211.db2.gz	WWYKQLQXBOKEDM-JTQLQIEISA-N	-1	3	344.389	1.697	20	5		EDBDHM
COCCOCC[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000268879794	443135663	/nfs/dbraw/zinc/13/56/63/443135663.db2.gz	RJGZUNAYSRPYCP-UHFFFAOYSA-N	-1	3	332.378	1.153	20	5		EDBDHM
CC[C@H](C)[C@@H](O)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000269756778	443426629	/nfs/dbraw/zinc/42/66/29/443426629.db2.gz	ISHONGFDQAIJBD-CABZTGNLSA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@]2(O)CCO[C@H]2C)c1C	ZINC000278784577	443438656	/nfs/dbraw/zinc/43/86/56/443438656.db2.gz	PWWYGXOXXQQTSY-FZMZJTMJSA-N	-1	3	344.389	1.030	20	5		EDBDHM
CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@@]2(C1)NC(=O)[N-]C2=O	ZINC000278991379	443484274	/nfs/dbraw/zinc/48/42/74/443484274.db2.gz	BIERYKZZSOPNGK-INIZCTEOSA-N	-1	3	348.359	1.168	20	5		EDBDHM
CCC(CC)[C@@H](O)C[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000269803691	443447404	/nfs/dbraw/zinc/44/74/04/443447404.db2.gz	SVLYZKMJJQFVSJ-ZDUSSCGKSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)[N-]n2cn[nH]c2=O)CC1	ZINC000272161476	443544370	/nfs/dbraw/zinc/54/43/70/443544370.db2.gz	XHGRBYKOGQVTTL-UHFFFAOYSA-N	-1	3	346.347	1.100	20	5		EDBDHM
CS[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])C[C@H]1N(C)C	ZINC000436960928	320028717	/nfs/dbraw/zinc/02/87/17/320028717.db2.gz	SGIHJPUPBPVQOZ-DGCLKSJQSA-N	-1	3	325.390	1.418	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCC[C@@H]1C	ZINC000276194107	443666547	/nfs/dbraw/zinc/66/65/47/443666547.db2.gz	IKPAGSKWDGLWIS-JOYOIKCWSA-N	-1	3	342.373	1.848	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)[C@@H](O)C(F)F	ZINC000451717803	320238743	/nfs/dbraw/zinc/23/87/43/320238743.db2.gz	TWSHDLGHCVSCCI-GHMZBOCLSA-N	-1	3	338.332	1.419	20	5		EDBDHM
CC(C)n1cnnc1C[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000516650530	320439850	/nfs/dbraw/zinc/43/98/50/320439850.db2.gz	PEEQVLZZEUCNBP-UHFFFAOYSA-N	-1	3	325.350	1.246	20	5		EDBDHM
CN(CCCN1CCN(C)CC1)C(=O)c1cccc([O-])c1[N+](=O)[O-]	ZINC000281029611	443800522	/nfs/dbraw/zinc/80/05/22/443800522.db2.gz	VDLRXWLWMBNKCY-UHFFFAOYSA-N	-1	3	336.392	1.010	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](C)[C@H]2CCOC2)c1[N+](=O)[O-]	ZINC000276799535	443831659	/nfs/dbraw/zinc/83/16/59/443831659.db2.gz	KNJLBFDRZUOUMV-RYUDHWBXSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)Cn2ccnc2)cc1C	ZINC000299102348	443954845	/nfs/dbraw/zinc/95/48/45/443954845.db2.gz	YEZBZNOBYZESQP-GFCCVEGCSA-N	-1	3	338.389	1.775	20	5		EDBDHM
CC[C@@H](C)[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)OC	ZINC000295179371	444169013	/nfs/dbraw/zinc/16/90/13/444169013.db2.gz	BMZHGWZSISIKSX-ZWNOBZJWSA-N	-1	3	346.405	1.943	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1CC=CC1	ZINC000317532889	444316344	/nfs/dbraw/zinc/31/63/44/444316344.db2.gz	ZQTXKZUQJUMZDN-UHFFFAOYSA-N	-1	3	326.330	1.378	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H](C)C(C)C	ZINC000322375443	444339667	/nfs/dbraw/zinc/33/96/67/444339667.db2.gz	KKCMVPXQDCNMPN-JTQLQIEISA-N	-1	3	344.389	1.952	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CC1(C)C	ZINC000323240990	444342310	/nfs/dbraw/zinc/34/23/10/444342310.db2.gz	DUISGJBDSIDNNQ-VIFPVBQESA-N	-1	3	342.373	1.706	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@H]1CCC[C@H](CO)C1	ZINC000323365742	444342947	/nfs/dbraw/zinc/34/29/47/444342947.db2.gz	YLMHUDPKAYWJGD-STQMWFEESA-N	-1	3	342.417	1.980	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@](C)(O)C2CC2)c([N+](=O)[O-])c1	ZINC000319852063	444326358	/nfs/dbraw/zinc/32/63/58/444326358.db2.gz	HNBRSSGNBOSEEW-CYBMUJFWSA-N	-1	3	330.362	1.043	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)N[C@H]2CCN3CCCC[C@H]23)ccc1[O-]	ZINC000321396724	444335674	/nfs/dbraw/zinc/33/56/74/444335674.db2.gz	ZCJJSGWOUOXMEJ-NWDGAFQWSA-N	-1	3	341.389	1.206	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C2CCC(O)CC2)c([N+](=O)[O-])c1	ZINC000336859977	444807718	/nfs/dbraw/zinc/80/77/18/444807718.db2.gz	MMJFHUZZQZZQRR-UHFFFAOYSA-N	-1	3	330.362	1.185	20	5		EDBDHM
CS[C@H]1CN(C(=O)c2cc([O-])ccc2[N+](=O)[O-])C[C@H]1N(C)C	ZINC000330603844	445057243	/nfs/dbraw/zinc/05/72/43/445057243.db2.gz	KORFRNBDSCCDMB-OLZOCXBDSA-N	-1	3	325.390	1.418	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000362947629	445622066	/nfs/dbraw/zinc/62/20/66/445622066.db2.gz	BJVSPDWTBMVNAR-UHFFFAOYSA-N	-1	3	340.242	1.564	20	5		EDBDHM
CCc1ccc(C(=O)Nc2nnc(CC(=O)OC)[n-]2)cc1[N+](=O)[O-]	ZINC000349847930	445698279	/nfs/dbraw/zinc/69/82/79/445698279.db2.gz	HLYSKKMKXYGOGK-UHFFFAOYSA-N	-1	3	333.304	1.243	20	5		EDBDHM
CCc1ccc(C(=O)Nc2nc(CC(=O)OC)n[n-]2)cc1[N+](=O)[O-]	ZINC000349847930	445698284	/nfs/dbraw/zinc/69/82/84/445698284.db2.gz	HLYSKKMKXYGOGK-UHFFFAOYSA-N	-1	3	333.304	1.243	20	5		EDBDHM
CCc1ccc(C(=O)Nc2n[n-]c(CC(=O)OC)n2)cc1[N+](=O)[O-]	ZINC000349847930	445698290	/nfs/dbraw/zinc/69/82/90/445698290.db2.gz	HLYSKKMKXYGOGK-UHFFFAOYSA-N	-1	3	333.304	1.243	20	5		EDBDHM
COCc1nc(S[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)n[n-]1	ZINC000353831085	445774690	/nfs/dbraw/zinc/77/46/90/445774690.db2.gz	XJLXWZBMPMKUBQ-LLVKDONJSA-N	-1	3	349.372	1.757	20	5		EDBDHM
CN(C)c1ncncc1NC(=O)c1n[n-]c2ccc([N+](=O)[O-])cc21	ZINC000358891101	445834754	/nfs/dbraw/zinc/83/47/54/445834754.db2.gz	YIOBIDLQHYSQDG-UHFFFAOYSA-N	-1	3	327.304	1.579	20	5		EDBDHM
CN(C)c1nc(C(=O)NCCc2cccc([N+](=O)[O-])c2)cc(=O)[n-]1	ZINC000361592608	445838596	/nfs/dbraw/zinc/83/85/96/445838596.db2.gz	CGXAPENQKARGPL-UHFFFAOYSA-N	-1	3	331.332	1.129	20	5		EDBDHM
COC(=O)c1cccc2nc(NC(=O)c3cc([N+](=O)[O-])n[nH]3)[n-]c21	ZINC000354235428	446032345	/nfs/dbraw/zinc/03/23/45/446032345.db2.gz	GCJWOHIKMKKEIZ-UHFFFAOYSA-N	-1	3	330.260	1.233	20	5		EDBDHM
CNC(=O)c1ccc(N2CCc3c(nc[n-]c3=O)C2)c([N+](=O)[O-])c1	ZINC000583196917	326023800	/nfs/dbraw/zinc/02/38/00/326023800.db2.gz	TXNPUWVTRKMNOU-UHFFFAOYSA-N	-1	3	329.316	1.013	20	5		EDBDHM
COC(=O)C[C@@H](C)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000583635172	326109808	/nfs/dbraw/zinc/10/98/08/326109808.db2.gz	WTPXLTIIGUAHER-SNVBAGLBSA-N	-1	3	330.362	1.442	20	5		EDBDHM
COC(=O)c1cnc(SCC(=O)Nc2ccccc2[N+](=O)[O-])[n-]1	ZINC000361995677	446137609	/nfs/dbraw/zinc/13/76/09/446137609.db2.gz	ITBBIAWQMCHGAF-UHFFFAOYSA-N	-1	3	336.329	1.835	20	5		EDBDHM
O=C(Nc1cc(-c2ccccc2)[nH]n1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000435676546	446708578	/nfs/dbraw/zinc/70/85/78/446708578.db2.gz	VJAQFJYEXCYOLG-UHFFFAOYSA-N	-1	3	325.284	2.338	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2(CC(N)=O)CC2)c1C	ZINC000420707491	446761815	/nfs/dbraw/zinc/76/18/15/446761815.db2.gz	UEAUAMFVXTUPMH-UHFFFAOYSA-N	-1	3	341.389	1.146	20	5		EDBDHM
CC[C@@H](C[C@H](C)CO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000443328616	447034341	/nfs/dbraw/zinc/03/43/41/447034341.db2.gz	QJTNNSDDBIKWPX-QWRGUYRKSA-N	-1	3	346.405	1.679	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000524409621	447929293	/nfs/dbraw/zinc/92/92/93/447929293.db2.gz	DPLHZSMSLBHOKS-JTQLQIEISA-N	-1	3	329.316	1.318	20	5		EDBDHM
O=C([O-])C[C@H]1CSCCN1CCOc1cccc([N+](=O)[O-])c1	ZINC000577521667	448320910	/nfs/dbraw/zinc/32/09/10/448320910.db2.gz	MCYVLPPUKDGADX-LBPRGKRZSA-N	-1	3	326.374	1.866	20	5		EDBDHM
CNC(=O)Cn1nc([N-]c2ccc([N+](=O)[O-])c(OC(C)C)n2)cc1C	ZINC000579613638	448837271	/nfs/dbraw/zinc/83/72/71/448837271.db2.gz	XGRMVTIQTPHYIH-UHFFFAOYSA-N	-1	3	348.363	1.772	20	5		EDBDHM
CC(C)(C)[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCO1	ZINC000593569036	449076852	/nfs/dbraw/zinc/07/68/52/449076852.db2.gz	LWEMUDXUHLMXRS-JQWIXIFHSA-N	-1	3	343.405	1.862	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2cnc3n2CCCC3)nc1	ZINC000593592824	449094802	/nfs/dbraw/zinc/09/48/02/449094802.db2.gz	OKAVNENKRRKAAF-UHFFFAOYSA-N	-1	3	337.361	1.001	20	5		EDBDHM
CC(C)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)[C@@H](CO)C(C)C	ZINC000593600195	449099864	/nfs/dbraw/zinc/09/98/64/449099864.db2.gz	BOHRESMXPJWPPI-GXTWGEPZSA-N	-1	3	345.421	1.557	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCCC2CCOCC2)nc1	ZINC000593601995	449101116	/nfs/dbraw/zinc/10/11/16/449101116.db2.gz	AJRASHYPBNKQJR-UHFFFAOYSA-N	-1	3	329.378	1.475	20	5		EDBDHM
O=C(c1c[n-]c(=O)c([N+](=O)[O-])c1)N1C[C@@H](CO)Cc2ccccc21	ZINC000590404221	449149649	/nfs/dbraw/zinc/14/96/49/449149649.db2.gz	YZJGEGRAAOPWPW-JTQLQIEISA-N	-1	3	329.312	1.507	20	5		EDBDHM
O=c1[n-]ccc(NCc2cccnc2N2CCOCC2)c1[N+](=O)[O-]	ZINC000596073401	449350128	/nfs/dbraw/zinc/35/01/28/449350128.db2.gz	NRWNEMYPSVPIEB-UHFFFAOYSA-N	-1	3	331.332	1.539	20	5		EDBDHM
C[C@@H]1CN(c2ccc(CNc3cc[n-]c(=O)c3[N+](=O)[O-])cn2)CCO1	ZINC000596076862	449351131	/nfs/dbraw/zinc/35/11/31/449351131.db2.gz	QTKFPHWGBUNBNH-LLVKDONJSA-N	-1	3	345.359	1.928	20	5		EDBDHM
O=c1[n-]ccc(NC[C@@]2(N3CCOCC3)CCSC2)c1[N+](=O)[O-]	ZINC000596088244	449357417	/nfs/dbraw/zinc/35/74/17/449357417.db2.gz	JJDCNASLNWGHKD-AWEZNQCLSA-N	-1	3	340.405	1.315	20	5		EDBDHM
O=c1[n-]ccc(Sc2nnc(N3CCOCC3)s2)c1[N+](=O)[O-]	ZINC000596090954	449358291	/nfs/dbraw/zinc/35/82/91/449358291.db2.gz	SSNJWNJUPIZXPU-UHFFFAOYSA-N	-1	3	341.374	1.535	20	5		EDBDHM
CC1(C)C[C@@]1(C)NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000598386326	449375831	/nfs/dbraw/zinc/37/58/31/449375831.db2.gz	NSSMEXRSDDIUSW-CQSZACIVSA-N	-1	3	341.389	1.178	20	5		EDBDHM
CCOC(=O)[C@@]1(COC)CCCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1	ZINC000596219926	449423169	/nfs/dbraw/zinc/42/31/69/449423169.db2.gz	HSBVJFVQPKUPFL-HNNXBMFYSA-N	-1	3	339.348	1.492	20	5		EDBDHM
COC(=O)Cc1csc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)n1	ZINC000614295341	449546334	/nfs/dbraw/zinc/54/63/34/449546334.db2.gz	MUEGVGBSXGMVHE-UHFFFAOYSA-N	-1	3	338.301	1.120	20	5		EDBDHM
O=[N+]([O-])c1ccc([O-])cc1CN1CCC[C@@H](N2CCOCC2)CC1	ZINC000594616399	449595268	/nfs/dbraw/zinc/59/52/68/449595268.db2.gz	AXXRBXRQZRCWSN-OAHLLOKOSA-N	-1	3	335.404	1.987	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C1CCOCC1	ZINC000594799685	449710996	/nfs/dbraw/zinc/71/09/96/449710996.db2.gz	PHDPQVSKJQMVCX-GFCCVEGCSA-N	-1	3	344.389	1.315	20	5		EDBDHM
O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)[N-]C/C=C\CO	ZINC000594820134	449728530	/nfs/dbraw/zinc/72/85/30/449728530.db2.gz	RLXNLFQOQGWDQF-UPHRSURJSA-N	-1	3	340.279	1.440	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@@H](CO)CC2CC2)cc1[N+](=O)[O-]	ZINC000594865936	449780885	/nfs/dbraw/zinc/78/08/85/449780885.db2.gz	TULVLHIEHLHDDP-JTQLQIEISA-N	-1	3	334.419	1.652	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CCC[C@@H](C)O1	ZINC000594849983	449756926	/nfs/dbraw/zinc/75/69/26/449756926.db2.gz	BJSRVXFSPXDLBJ-ZYHUDNBSSA-N	-1	3	344.389	1.839	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H]1CCC[C@@H](C)O1	ZINC000594850670	449758066	/nfs/dbraw/zinc/75/80/66/449758066.db2.gz	FAAXZRIGUBFRFL-ZYHUDNBSSA-N	-1	3	344.389	1.839	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1CC=CC1	ZINC000599390007	449938210	/nfs/dbraw/zinc/93/82/10/449938210.db2.gz	FXSIWBILQURTCH-UHFFFAOYSA-N	-1	3	340.357	1.626	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@H]2CC[C@H](C)N2C)c(F)cc1[N+](=O)[O-]	ZINC000601468167	449991756	/nfs/dbraw/zinc/99/17/56/449991756.db2.gz	JTTQBLCABCYOGL-QWRGUYRKSA-N	-1	3	345.396	1.803	20	5		EDBDHM
CN(C)[C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000615293350	450051172	/nfs/dbraw/zinc/05/11/72/450051172.db2.gz	UPRBEQQYTJSHMO-GHMZBOCLSA-N	-1	3	331.369	1.495	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2cccc(OC)c2[N+](=O)[O-])n[n-]1	ZINC000618240680	450093798	/nfs/dbraw/zinc/09/37/98/450093798.db2.gz	XYSVDXWGLUXCEM-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2cccc(OC)c2[N+](=O)[O-])[n-]n1	ZINC000618240680	450093803	/nfs/dbraw/zinc/09/38/03/450093803.db2.gz	XYSVDXWGLUXCEM-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
CN(C)C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])[n-]2)c2ccccc2O1	ZINC000610764806	450327446	/nfs/dbraw/zinc/32/74/46/450327446.db2.gz	UZTUAVDHJZTTBZ-NSHDSACASA-N	-1	3	330.344	1.892	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)COc2ccccc2[N+](=O)[O-])[n-]1	ZINC000618919260	450340245	/nfs/dbraw/zinc/34/02/45/450340245.db2.gz	FIZLXWPSYKCOKT-UHFFFAOYSA-N	-1	3	334.288	1.512	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)COc2ccccc2[N+](=O)[O-])c[n-]1	ZINC000618919260	450340251	/nfs/dbraw/zinc/34/02/51/450340251.db2.gz	FIZLXWPSYKCOKT-UHFFFAOYSA-N	-1	3	334.288	1.512	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1ccoc1C	ZINC000619478231	450485066	/nfs/dbraw/zinc/48/50/66/450485066.db2.gz	SEPDJUKYQZUNLE-UHFFFAOYSA-N	-1	3	326.330	1.983	20	5		EDBDHM
CCc1ccc([N-]C(=O)c2ccc([N+](=O)[O-])o2)cc1S(N)(=O)=O	ZINC000067329305	491002830	/nfs/dbraw/zinc/00/28/30/491002830.db2.gz	JPABJKNQMZHMNS-UHFFFAOYSA-N	-1	3	339.329	1.650	20	5		EDBDHM
COC[C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000162692555	536553244	/nfs/dbraw/zinc/55/32/44/536553244.db2.gz	OLZZOEFLBULKMW-SSDOTTSWSA-N	-1	3	342.295	1.927	20	5		EDBDHM
CCO[C@@H]1COCC[C@H]1[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000352997442	535759918	/nfs/dbraw/zinc/75/99/18/535759918.db2.gz	CTUQBKFSQKATAX-TZMCWYRMSA-N	-1	3	344.389	1.208	20	5		EDBDHM
CN1C(=O)CN([N-]C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1=O	ZINC000271791384	536313889	/nfs/dbraw/zinc/31/38/89/536313889.db2.gz	GURJTEVBNATTBL-UHFFFAOYSA-N	-1	3	346.221	1.152	20	5		EDBDHM
COc1ccc(C[N-]S(=O)(=O)c2cnc(C)s2)cc1[N+](=O)[O-]	ZINC000269989418	536895474	/nfs/dbraw/zinc/89/54/74/536895474.db2.gz	OVDWMFXRHPQHFX-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
CN1CCC[C@H]([N-]S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000725827129	578284513	/nfs/dbraw/zinc/28/45/13/578284513.db2.gz	NALNGWWZIBDFJY-JTQLQIEISA-N	-1	3	333.797	1.621	20	5		EDBDHM
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000755318897	579924988	/nfs/dbraw/zinc/92/49/88/579924988.db2.gz	ZPVZPFBRHGFITI-AWEZNQCLSA-N	-1	3	349.387	1.674	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]CCCCn2ccnc2)cs1	ZINC000768883207	580223358	/nfs/dbraw/zinc/22/33/58/580223358.db2.gz	XKRHIAJPAOKVOU-UHFFFAOYSA-N	-1	3	330.391	1.612	20	5		EDBDHM
CCO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@@H]1OC	ZINC000772956642	580324116	/nfs/dbraw/zinc/32/41/16/580324116.db2.gz	CANBPGVYQSMBNB-KKZNHRDASA-N	-1	3	336.391	1.127	20	5		EDBDHM
CC[C@@H](C(=O)[N-]S(=O)(=O)c1cc([N+](=O)[O-])cs1)N(CC)CC	ZINC000778641299	580469416	/nfs/dbraw/zinc/46/94/16/580469416.db2.gz	SRXDKSIJJMDTGK-JTQLQIEISA-N	-1	3	349.434	1.582	20	5		EDBDHM
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000779665028	580494031	/nfs/dbraw/zinc/49/40/31/580494031.db2.gz	PBWSSTVWFFFVPM-AWEZNQCLSA-N	-1	3	349.387	1.674	20	5		EDBDHM
CCSCCOC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000796274036	580949820	/nfs/dbraw/zinc/94/98/20/580949820.db2.gz	QUMFPFBYRJAGJV-UHFFFAOYSA-N	-1	3	348.402	1.169	20	5		EDBDHM
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)[N-]N1CCc2ccccc2C1=O	ZINC000801948076	581088831	/nfs/dbraw/zinc/08/88/31/581088831.db2.gz	NVBMWWDLVTZNKE-UHFFFAOYSA-N	-1	3	344.302	1.659	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NCC[C@H](O)C(F)(F)F	ZINC000738358617	598896218	/nfs/dbraw/zinc/89/62/18/598896218.db2.gz	NQFYCKCQJHWKAI-VIFPVBQESA-N	-1	3	332.242	1.500	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NCC[C@H](O)C(F)(F)F	ZINC000738358617	598896220	/nfs/dbraw/zinc/89/62/20/598896220.db2.gz	NQFYCKCQJHWKAI-VIFPVBQESA-N	-1	3	332.242	1.500	20	5		EDBDHM
COc1c([O-])ccc(CN2C[C@H](C)N(CCO)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000894953665	591498543	/nfs/dbraw/zinc/49/85/43/591498543.db2.gz	HDOGLCLPPQDBSE-RYUDHWBXSA-N	-1	3	339.392	1.196	20	5		EDBDHM
O=C(NCCc1ccccc1[N+](=O)[O-])c1ccc(-c2nnn[n-]2)cc1	ZINC000738089600	591623076	/nfs/dbraw/zinc/62/30/76/591623076.db2.gz	YAGLLYYYKNGEKR-UHFFFAOYSA-N	-1	3	338.327	1.747	20	5		EDBDHM
O=C(NCCc1ccccc1[N+](=O)[O-])c1ccc(-c2nn[n-]n2)cc1	ZINC000738089600	591623079	/nfs/dbraw/zinc/62/30/79/591623079.db2.gz	YAGLLYYYKNGEKR-UHFFFAOYSA-N	-1	3	338.327	1.747	20	5		EDBDHM
O=C([N-]CCO[C@H]1CCOC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000902980047	592092395	/nfs/dbraw/zinc/09/23/95/592092395.db2.gz	IEAQSURZEUQIKK-LBPRGKRZSA-N	-1	3	346.286	1.488	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2COC[C@@H]2C2CC2)c(F)c1	ZINC000908416721	592487942	/nfs/dbraw/zinc/48/79/42/592487942.db2.gz	WMFXFFNUWYWCQN-PWSUYJOCSA-N	-1	3	330.337	1.437	20	5		EDBDHM
Cc1cc(N[C@H](C)[C@H]2CN(C)CCN2C)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000910364576	592844671	/nfs/dbraw/zinc/84/46/71/592844671.db2.gz	SGUBFJQLRGZFPB-BXUZGUMPSA-N	-1	3	336.392	1.648	20	5		EDBDHM
CCn1ccc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)n1	ZINC000841553620	593317116	/nfs/dbraw/zinc/31/71/16/593317116.db2.gz	FGYTYBBFDUJCCY-UHFFFAOYSA-N	-1	3	342.352	1.737	20	5		EDBDHM
Cc1cccc(NCC[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)n1	ZINC000768846773	593442240	/nfs/dbraw/zinc/44/22/40/593442240.db2.gz	NFHRDBZINZXHEV-UHFFFAOYSA-N	-1	3	342.402	1.750	20	5		EDBDHM
CC(C)OCCO[N-]C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000812806053	593509720	/nfs/dbraw/zinc/50/97/20/593509720.db2.gz	LZFBWRLYXPVBMG-UHFFFAOYSA-N	-1	3	326.305	1.452	20	5		EDBDHM
COCC1([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CCOCC1	ZINC000817226497	593583163	/nfs/dbraw/zinc/58/31/63/593583163.db2.gz	SRLBSINWQLNUHI-UHFFFAOYSA-N	-1	3	344.314	1.998	20	5		EDBDHM
COC(=O)c1cc(C(=O)OCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c[n-]1	ZINC000814530111	593592312	/nfs/dbraw/zinc/59/23/12/593592312.db2.gz	GCXGXZCGUGEZPZ-UHFFFAOYSA-N	-1	3	349.255	1.975	20	5		EDBDHM
COCCN(CC(=O)[O-])Cc1ccc(Br)c([N+](=O)[O-])c1	ZINC000820723591	593872393	/nfs/dbraw/zinc/87/23/93/593872393.db2.gz	WDYLCYNIYNQYHR-UHFFFAOYSA-N	-1	3	347.165	1.890	20	5		EDBDHM
CC(C)[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CCO1	ZINC000824215252	593958731	/nfs/dbraw/zinc/95/87/31/593958731.db2.gz	JSYMGJPJQVJBCN-BXKDBHETSA-N	-1	3	333.352	1.785	20	5		EDBDHM
CC(C)[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CCO1	ZINC000824215252	593958733	/nfs/dbraw/zinc/95/87/33/593958733.db2.gz	JSYMGJPJQVJBCN-BXKDBHETSA-N	-1	3	333.352	1.785	20	5		EDBDHM
C[C@@H](NC(=O)c1cc(-c2nnn[n-]2)cn1C)c1ccccc1[N+](=O)[O-]	ZINC000824513302	594027800	/nfs/dbraw/zinc/02/78/00/594027800.db2.gz	AWJDAJHHSCUGMM-SECBINFHSA-N	-1	3	341.331	1.604	20	5		EDBDHM
C[C@@H](NC(=O)c1cc(-c2nn[n-]n2)cn1C)c1ccccc1[N+](=O)[O-]	ZINC000824513302	594027803	/nfs/dbraw/zinc/02/78/03/594027803.db2.gz	AWJDAJHHSCUGMM-SECBINFHSA-N	-1	3	341.331	1.604	20	5		EDBDHM
C[C@]1(O)CCN(c2cc(-c3nnn[n-]3)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000824844408	594083333	/nfs/dbraw/zinc/08/33/33/594083333.db2.gz	XBFFFDXNUSKPBY-HNNXBMFYSA-N	-1	3	341.331	1.284	20	5		EDBDHM
C[C@]1(O)CCN(c2cc(-c3nn[n-]n3)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000824844408	594083334	/nfs/dbraw/zinc/08/33/34/594083334.db2.gz	XBFFFDXNUSKPBY-HNNXBMFYSA-N	-1	3	341.331	1.284	20	5		EDBDHM
O=C(CCn1cc([N+](=O)[O-])cn1)Oc1ccc(-c2nnn[n-]2)cc1F	ZINC000822986264	594132222	/nfs/dbraw/zinc/13/22/22/594132222.db2.gz	BPOYRAFELKFJDI-UHFFFAOYSA-N	-1	3	347.266	1.106	20	5		EDBDHM
O=C(CCn1cc([N+](=O)[O-])cn1)Oc1ccc(-c2nn[n-]n2)cc1F	ZINC000822986264	594132223	/nfs/dbraw/zinc/13/22/23/594132223.db2.gz	BPOYRAFELKFJDI-UHFFFAOYSA-N	-1	3	347.266	1.106	20	5		EDBDHM
CCN(CC)C(=O)CSc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825406078	594179894	/nfs/dbraw/zinc/17/98/94/594179894.db2.gz	IVRXBJKOWHGDTA-UHFFFAOYSA-N	-1	3	336.377	1.735	20	5		EDBDHM
CCN(CC)C(=O)CSc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825406078	594179896	/nfs/dbraw/zinc/17/98/96/594179896.db2.gz	IVRXBJKOWHGDTA-UHFFFAOYSA-N	-1	3	336.377	1.735	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N[C@@H]1c2ccccc2C[C@H]1O	ZINC000823629843	594222999	/nfs/dbraw/zinc/22/29/99/594222999.db2.gz	JKGBMRWGWNDFOI-HUUCEWRRSA-N	-1	3	338.327	1.845	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N[C@@H]1c2ccccc2C[C@H]1O	ZINC000823629843	594223000	/nfs/dbraw/zinc/22/30/00/594223000.db2.gz	JKGBMRWGWNDFOI-HUUCEWRRSA-N	-1	3	338.327	1.845	20	5		EDBDHM
O=[N+]([O-])c1cnn(CCSc2ccc(-c3nnn[n-]3)cc2F)c1	ZINC000823651079	594224597	/nfs/dbraw/zinc/22/45/97/594224597.db2.gz	DVBFRWTVAWANOY-UHFFFAOYSA-N	-1	3	335.324	1.903	20	5		EDBDHM
O=[N+]([O-])c1cnn(CCSc2ccc(-c3nn[n-]n3)cc2F)c1	ZINC000823651079	594224598	/nfs/dbraw/zinc/22/45/98/594224598.db2.gz	DVBFRWTVAWANOY-UHFFFAOYSA-N	-1	3	335.324	1.903	20	5		EDBDHM
O=[N+]([O-])c1cnn(CCNc2ncc(-c3nnn[n-]3)cc2Cl)c1	ZINC000823651227	594224644	/nfs/dbraw/zinc/22/46/44/594224644.db2.gz	ISSRXMHAJBPZDG-UHFFFAOYSA-N	-1	3	335.715	1.132	20	5		EDBDHM
O=[N+]([O-])c1cnn(CCNc2ncc(-c3nn[n-]n3)cc2Cl)c1	ZINC000823651227	594224645	/nfs/dbraw/zinc/22/46/45/594224645.db2.gz	ISSRXMHAJBPZDG-UHFFFAOYSA-N	-1	3	335.715	1.132	20	5		EDBDHM
C[C@]1(C(=O)[O-])CCN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000828020821	594323541	/nfs/dbraw/zinc/32/35/41/594323541.db2.gz	XLBFDUQMSKQONP-BBRMVZONSA-N	-1	3	333.344	1.497	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCC[C@H](OC(F)F)C1	ZINC000826497653	594502137	/nfs/dbraw/zinc/50/21/37/594502137.db2.gz	ONSVPTNIEGJERQ-VIFPVBQESA-N	-1	3	340.290	1.983	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCC[C@H](OC(F)F)C1	ZINC000826497653	594502138	/nfs/dbraw/zinc/50/21/38/594502138.db2.gz	ONSVPTNIEGJERQ-VIFPVBQESA-N	-1	3	340.290	1.983	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@@H]2CCCn3ccnc32)c(-c2nnn[n-]2)c1	ZINC000826498807	594502549	/nfs/dbraw/zinc/50/25/49/594502549.db2.gz	KMAXPRKVYWFPJG-JTQLQIEISA-N	-1	3	340.347	1.961	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@@H]2CCCn3ccnc32)c(-c2nn[n-]n2)c1	ZINC000826498807	594502551	/nfs/dbraw/zinc/50/25/51/594502551.db2.gz	KMAXPRKVYWFPJG-JTQLQIEISA-N	-1	3	340.347	1.961	20	5		EDBDHM
O=[N+]([O-])c1ccc([C@H](O)COc2ccc(-c3nnn[n-]3)cc2)cc1	ZINC000826498183	594502968	/nfs/dbraw/zinc/50/29/68/594502968.db2.gz	KIUAPBQQOUXGCM-CQSZACIVSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1ccc([C@H](O)COc2ccc(-c3nn[n-]n3)cc2)cc1	ZINC000826498183	594502969	/nfs/dbraw/zinc/50/29/69/594502969.db2.gz	KIUAPBQQOUXGCM-CQSZACIVSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H]2COC3(CCCC3)O2)c(-c2nnn[n-]2)c1	ZINC000826500900	594503667	/nfs/dbraw/zinc/50/36/67/594503667.db2.gz	QXSIINFHPYYLLN-SNVBAGLBSA-N	-1	3	347.335	1.268	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@@H]2COC3(CCCC3)O2)c(-c2nn[n-]n2)c1	ZINC000826500900	594503669	/nfs/dbraw/zinc/50/36/69/594503669.db2.gz	QXSIINFHPYYLLN-SNVBAGLBSA-N	-1	3	347.335	1.268	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2C(=O)OCC2(C)C)c1[N+](=O)[O-]	ZINC000841534817	594916964	/nfs/dbraw/zinc/91/69/64/594916964.db2.gz	LTWBNEOBIAAZRZ-LBPRGKRZSA-N	-1	3	342.373	1.442	20	5		EDBDHM
O=C([O-])NC[C@H]1CCC[C@H]1NCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000834211818	595055301	/nfs/dbraw/zinc/05/53/01/595055301.db2.gz	FIISHWWDCUGVOU-GHMZBOCLSA-N	-1	3	336.348	1.559	20	5		EDBDHM
O=C([O-])NC[C@@H]1CCC[C@H]1NCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000834211821	595055358	/nfs/dbraw/zinc/05/53/58/595055358.db2.gz	FIISHWWDCUGVOU-WDEREUQCSA-N	-1	3	336.348	1.559	20	5		EDBDHM
O=C([O-])CCN(C[C@@H](O)c1cccc([N+](=O)[O-])c1)C[C@@H]1CCCO1	ZINC000846272941	595193379	/nfs/dbraw/zinc/19/33/79/595193379.db2.gz	QKBXWPMBUBMBGV-LSDHHAIUSA-N	-1	3	338.360	1.584	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]CC2(N(C)C)CC2)cc1[N+](=O)[O-]	ZINC000867438249	595311577	/nfs/dbraw/zinc/31/15/77/595311577.db2.gz	AVWOFCYOKGUQTD-UHFFFAOYSA-N	-1	3	347.824	1.929	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])C(OC)OC	ZINC000849407486	595521962	/nfs/dbraw/zinc/52/19/62/595521962.db2.gz	SMRHYRMJVVCZQT-NSHDSACASA-N	-1	3	332.378	1.412	20	5		EDBDHM
CN1CCC(O[N-]C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC000854357441	596050811	/nfs/dbraw/zinc/05/08/11/596050811.db2.gz	FVXWKQHEWAPLSR-UHFFFAOYSA-N	-1	3	329.303	1.558	20	5		EDBDHM
COCOCCC[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000859383709	596075351	/nfs/dbraw/zinc/07/53/51/596075351.db2.gz	YQBFKIBBWYNNQD-UHFFFAOYSA-N	-1	3	338.769	1.537	20	5		EDBDHM
COCC1CC([N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C1	ZINC000867841373	596580472	/nfs/dbraw/zinc/58/04/72/596580472.db2.gz	ZCCWCURDTQHKOX-UHFFFAOYSA-N	-1	3	328.390	1.915	20	5		EDBDHM
CON(C)C(=O)[C@@H](C)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000863522545	596608692	/nfs/dbraw/zinc/60/86/92/596608692.db2.gz	VOVXTOTWWNJBPV-MRVPVSSYSA-N	-1	3	347.274	1.091	20	5		EDBDHM
O=[N+]([O-])c1ccc(CC[N-]S(=O)(=O)c2cccc3nonc32)cc1	ZINC000119863542	596761315	/nfs/dbraw/zinc/76/13/15/596761315.db2.gz	ALRZRIVOLYWSBV-UHFFFAOYSA-N	-1	3	348.340	1.652	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@H]1CC(C)(C)CO1	ZINC000872548887	596960329	/nfs/dbraw/zinc/96/03/29/596960329.db2.gz	IBGIFBBFMJPCJH-LLVKDONJSA-N	-1	3	328.390	1.997	20	5		EDBDHM
O=[N+]([O-])c1cnc(Nc2ccc(OCCO)cc2)c(-c2nnn[n-]2)c1	ZINC000738373851	598679235	/nfs/dbraw/zinc/67/92/35/598679235.db2.gz	ICXHAJRHPOJVFC-UHFFFAOYSA-N	-1	3	343.303	1.285	20	5		EDBDHM
O=[N+]([O-])c1cnc(Nc2ccc(OCCO)cc2)c(-c2nn[n-]n2)c1	ZINC000738373851	598679237	/nfs/dbraw/zinc/67/92/37/598679237.db2.gz	ICXHAJRHPOJVFC-UHFFFAOYSA-N	-1	3	343.303	1.285	20	5		EDBDHM
Cn1cc(-c2nnn[n-]2)cc1C(=O)NCc1ccccc1[N+](=O)[O-]	ZINC000822641091	606230242	/nfs/dbraw/zinc/23/02/42/606230242.db2.gz	CDLDUBPZHGEJGC-UHFFFAOYSA-N	-1	3	327.304	1.043	20	5		EDBDHM
Cn1cc(-c2nn[n-]n2)cc1C(=O)NCc1ccccc1[N+](=O)[O-]	ZINC000822641091	606230243	/nfs/dbraw/zinc/23/02/43/606230243.db2.gz	CDLDUBPZHGEJGC-UHFFFAOYSA-N	-1	3	327.304	1.043	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC[C@@H](O)C(C)C	ZINC000443237745	305237562	/nfs/dbraw/zinc/23/75/62/305237562.db2.gz	JYCIROFLQUBYLL-LLVKDONJSA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@H](C)[C@H](C)CO)c1	ZINC000183716285	235205574	/nfs/dbraw/zinc/20/55/74/235205574.db2.gz	LOVGKHXOUBZOAZ-RKDXNWHRSA-N	-1	3	336.797	1.852	20	5		EDBDHM
Cn1c(=O)oc2cc(NC(=O)c3cc([N+](=O)[O-])c[n-]c3=O)ccc21	ZINC000102900446	206387544	/nfs/dbraw/zinc/38/75/44/206387544.db2.gz	NWDRJCZFBZRWKX-UHFFFAOYSA-N	-1	3	330.256	1.393	20	5		EDBDHM
NC(=O)c1ccc(CN2CCCC[C@H]2CCC(=O)[O-])c([N+](=O)[O-])c1	ZINC000261798449	139227083	/nfs/dbraw/zinc/22/70/83/139227083.db2.gz	ZSJVPWKQRVTSCC-ZDUSSCGKSA-N	-1	3	335.360	1.913	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])[C@H](O)C(C)C	ZINC000416614084	251084309	/nfs/dbraw/zinc/08/43/09/251084309.db2.gz	FNFBKNSEONNTGN-SMDDNHRTSA-N	-1	3	330.406	1.977	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CCCC[C@@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC000487433238	255029843	/nfs/dbraw/zinc/02/98/43/255029843.db2.gz	QGPBCIBKCCTNKF-WDEREUQCSA-N	-1	3	341.389	1.226	20	5		EDBDHM
CC(C)[C@@H](CO)C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000344845112	143019022	/nfs/dbraw/zinc/01/90/22/143019022.db2.gz	CUMZVLXUSVUGLD-SECBINFHSA-N	-1	3	336.797	1.791	20	5		EDBDHM
COC(=O)c1sc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)nc1C	ZINC000344984062	143035166	/nfs/dbraw/zinc/03/51/66/143035166.db2.gz	ZCOWSRRFZITLNR-UHFFFAOYSA-N	-1	3	338.301	1.499	20	5		EDBDHM
CO[C@H](CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(F)(F)F	ZINC000345361558	143082355	/nfs/dbraw/zinc/08/23/55/143082355.db2.gz	YPKDLHMJUAOOSH-SNVBAGLBSA-N	-1	3	342.295	1.841	20	5		EDBDHM
CN1CCC[C@@H](CC[N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000416559830	304331385	/nfs/dbraw/zinc/33/13/85/304331385.db2.gz	KLQJEMPUYGHJGK-NSHDSACASA-N	-1	3	345.396	1.744	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](CO)C2CCCC2)c([N+](=O)[O-])c1	ZINC000352593347	149078583	/nfs/dbraw/zinc/07/85/83/149078583.db2.gz	PTJSOFYGFQKAPU-LBPRGKRZSA-N	-1	3	344.389	1.433	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCN(C)[C@@H](C)C2)cc1C	ZINC000360651730	152138468	/nfs/dbraw/zinc/13/84/68/152138468.db2.gz	IQQIHIRWTFHABK-QWHCGFSZSA-N	-1	3	341.433	1.973	20	5		EDBDHM
CNc1c(C(=O)NCc2nnc(C(F)(F)F)[n-]2)cccc1[N+](=O)[O-]	ZINC000361007152	152276439	/nfs/dbraw/zinc/27/64/39/152276439.db2.gz	CMLNJQZZXKIYQJ-UHFFFAOYSA-N	-1	3	344.253	1.703	20	5		EDBDHM
CNc1c(C(=O)NCc2n[n-]c(C(F)(F)F)n2)cccc1[N+](=O)[O-]	ZINC000361007152	152276440	/nfs/dbraw/zinc/27/64/40/152276440.db2.gz	CMLNJQZZXKIYQJ-UHFFFAOYSA-N	-1	3	344.253	1.703	20	5		EDBDHM
CNc1c(C(=O)NCc2nc(C(F)(F)F)n[n-]2)cccc1[N+](=O)[O-]	ZINC000361007152	152276441	/nfs/dbraw/zinc/27/64/41/152276441.db2.gz	CMLNJQZZXKIYQJ-UHFFFAOYSA-N	-1	3	344.253	1.703	20	5		EDBDHM
C[C@H](c1cccc([N+](=O)[O-])c1)N1CCO[C@@H](CN(C)CC(=O)[O-])C1	ZINC000363925519	153098432	/nfs/dbraw/zinc/09/84/32/153098432.db2.gz	QASJFPPAZYZZMX-DOMZBBRYSA-N	-1	3	337.376	1.373	20	5		EDBDHM
Cc1nccn1-c1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cn1	ZINC000373896047	157053331	/nfs/dbraw/zinc/05/33/31/157053331.db2.gz	ZXCFGAALHRDIIR-UHFFFAOYSA-N	-1	3	340.299	1.837	20	5		EDBDHM
C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCc1ncccc1[O-]	ZINC000352502446	162216240	/nfs/dbraw/zinc/21/62/40/162216240.db2.gz	UYQGIWXQOLNKDF-SNVBAGLBSA-N	-1	3	344.327	1.130	20	5		EDBDHM
CCc1cnc(C[N-]S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)o1	ZINC000274811150	268211239	/nfs/dbraw/zinc/21/12/39/268211239.db2.gz	OXEJTUYZFGFSBP-UHFFFAOYSA-N	-1	3	339.373	1.807	20	5		EDBDHM
C[C@H]([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1ncn(C)n1	ZINC000275636020	268366787	/nfs/dbraw/zinc/36/67/87/268366787.db2.gz	SRLQHTLHMRQSIU-QMMMGPOBSA-N	-1	3	325.275	1.693	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCN(C)C2CC2)c1[N+](=O)[O-]	ZINC000276902612	273168514	/nfs/dbraw/zinc/16/85/14/273168514.db2.gz	VXDVIUVZTOUHOH-UHFFFAOYSA-N	-1	3	327.406	1.584	20	5		EDBDHM
CN(C)[C@H](CNC(=O)c1cc([N+](=O)[O-])c[n-]c1=O)c1ccccc1	ZINC000194625330	273814612	/nfs/dbraw/zinc/81/46/12/273814612.db2.gz	AYDXTQIDMKGNNY-CQSZACIVSA-N	-1	3	330.344	1.728	20	5		EDBDHM
CCCN1CCC[C@@H]1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000352512060	276008755	/nfs/dbraw/zinc/00/87/55/276008755.db2.gz	NFKSRQGRZMDGNR-GFCCVEGCSA-N	-1	3	327.406	1.748	20	5		EDBDHM
CCN1CCC[C@@H]([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C1	ZINC000330410328	276369440	/nfs/dbraw/zinc/36/94/40/276369440.db2.gz	JLRUFQFAEADIEO-GFCCVEGCSA-N	-1	3	327.406	1.666	20	5		EDBDHM
COC(=O)c1ccnc([N-]C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])c1	ZINC000269458425	277166525	/nfs/dbraw/zinc/16/65/25/277166525.db2.gz	RYTCVOOQKYUJEZ-UHFFFAOYSA-N	-1	3	333.304	1.875	20	5		EDBDHM
COC(=O)[C@@H](CF)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000287405798	288230760	/nfs/dbraw/zinc/23/07/60/288230760.db2.gz	LCFOWHRQKPYMTF-SECBINFHSA-N	-1	3	334.325	1.001	20	5		EDBDHM
Cc1cc(C(=O)N2CCCC[C@H]2c2nc[nH]n2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375092783	301092918	/nfs/dbraw/zinc/09/29/18/301092918.db2.gz	DDMQDZVABGEJRS-JTQLQIEISA-N	-1	3	332.320	1.489	20	5		EDBDHM
Cc1cc(C(=O)N2CCCC[C@H]2c2nnc[nH]2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375092783	301092919	/nfs/dbraw/zinc/09/29/19/301092919.db2.gz	DDMQDZVABGEJRS-JTQLQIEISA-N	-1	3	332.320	1.489	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCCC[C@H]2O)cc1C	ZINC000120477725	301427418	/nfs/dbraw/zinc/42/74/18/301427418.db2.gz	MQNWHCKRBHXCGR-WCQYABFASA-N	-1	3	328.390	1.793	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CC(=O)N(C(C)C)C1	ZINC000263730634	302049906	/nfs/dbraw/zinc/04/99/06/302049906.db2.gz	ZWWVAFUJYCAMTK-NSHDSACASA-N	-1	3	341.389	1.191	20	5		EDBDHM
COC(=O)C(C)(C)c1csc([N-]C(=O)c2n[nH]cc2[N+](=O)[O-])n1	ZINC000294086148	303061271	/nfs/dbraw/zinc/06/12/71/303061271.db2.gz	QFTJLLLSOKSERY-UHFFFAOYSA-N	-1	3	339.333	1.477	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)[C@@H](O)C(F)F	ZINC000295712124	303256548	/nfs/dbraw/zinc/25/65/48/303256548.db2.gz	KWWMGECFQZTEKW-WDEREUQCSA-N	-1	3	338.332	1.419	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@H]1CC12CCOCC2	ZINC000431275221	305077241	/nfs/dbraw/zinc/07/72/41/305077241.db2.gz	LMLXVCPHRWEOGT-LLVKDONJSA-N	-1	3	326.374	1.690	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])[C@@H]1CCCO1	ZINC000433457538	305109764	/nfs/dbraw/zinc/10/97/64/305109764.db2.gz	PRKYCIJYWGJVSA-YPMHNXCESA-N	-1	3	344.389	1.376	20	5		EDBDHM
Cc1cc(F)cc(-n2cc(C(=O)[N-]c3c([N+](=O)[O-])cnn3C)nn2)c1	ZINC000448385557	305296546	/nfs/dbraw/zinc/29/65/46/305296546.db2.gz	GGLLPZSABMCSAO-UHFFFAOYSA-N	-1	3	345.294	1.609	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1ncccc1[O-]	ZINC000471684074	305538758	/nfs/dbraw/zinc/53/87/58/305538758.db2.gz	CFEZOHXTFKFMFV-UHFFFAOYSA-N	-1	3	332.316	1.703	20	5		EDBDHM
CCN(C)S(=O)(=O)[N-]c1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000072758819	441256907	/nfs/dbraw/zinc/25/69/07/441256907.db2.gz	NKFOJMQGMVTBAC-UHFFFAOYSA-N	-1	3	325.293	1.805	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1cccc(C)n1	ZINC000055276994	441636569	/nfs/dbraw/zinc/63/65/69/441636569.db2.gz	ARXZOGGXWROMPL-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2ncc(C)o2)c([N+](=O)[O-])c1	ZINC000173983039	441873142	/nfs/dbraw/zinc/87/31/42/441873142.db2.gz	PWJYHGZRYVQQPB-UHFFFAOYSA-N	-1	3	327.318	1.378	20	5		EDBDHM
C[C@]1(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCCC[C@H]1O	ZINC000124842798	441958067	/nfs/dbraw/zinc/95/80/67/441958067.db2.gz	WPZDWVUJMMVAOP-ZIAGYGMSSA-N	-1	3	328.390	1.814	20	5		EDBDHM
Cc1ccn(Cc2noc(-c3ccccc3[O-])n2)c(=O)c1[N+](=O)[O-]	ZINC000129997857	442337241	/nfs/dbraw/zinc/33/72/41/442337241.db2.gz	ZDYBNCMWFPOSSF-UHFFFAOYSA-N	-1	3	328.284	1.869	20	5		EDBDHM
CC1(C)[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1O	ZINC000130142930	442340047	/nfs/dbraw/zinc/34/00/47/442340047.db2.gz	PRDZEPFMNSPICO-MNOVXSKESA-N	-1	3	334.781	1.686	20	5		EDBDHM
CC(C)[C@H](O)C(C)(C)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000154990331	442369116	/nfs/dbraw/zinc/36/91/16/442369116.db2.gz	DQSAXTOPGZAEGV-ZDUSSCGKSA-N	-1	3	330.406	1.916	20	5		EDBDHM
CC(C)[C@@H](C)C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000172240157	442428570	/nfs/dbraw/zinc/42/85/70/442428570.db2.gz	BFKOYKRVOSBGDT-LLVKDONJSA-N	-1	3	343.405	1.281	20	5		EDBDHM
Cn1cnc(-c2ccc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)cc2)n1	ZINC000187572645	442681907	/nfs/dbraw/zinc/68/19/07/442681907.db2.gz	CHZUCPGWESIMSJ-UHFFFAOYSA-N	-1	3	340.299	1.743	20	5		EDBDHM
Cc1nc(N2CCN(C(=O)c3ccc([O-])cc3)CC2)ccc1[N+](=O)[O-]	ZINC000268463302	442998191	/nfs/dbraw/zinc/99/81/91/442998191.db2.gz	HQBRFUYMWCTQPR-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC1(OC)CCCC1	ZINC000297092181	318749316	/nfs/dbraw/zinc/74/93/16/318749316.db2.gz	NYJSSVWLUVJHOI-UHFFFAOYSA-N	-1	3	344.389	1.841	20	5		EDBDHM
CSC[C@](C)(O)C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000228584245	443124672	/nfs/dbraw/zinc/12/46/72/443124672.db2.gz	VTMCSYHSDMYZPE-GFCCVEGCSA-N	-1	3	334.419	1.296	20	5		EDBDHM
COC[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)OC	ZINC000272675410	443405232	/nfs/dbraw/zinc/40/52/32/443405232.db2.gz	LRXMISFUWCPBML-SECBINFHSA-N	-1	3	338.769	1.188	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H](C)C[C@@H](C)O	ZINC000269814251	443452898	/nfs/dbraw/zinc/45/28/98/443452898.db2.gz	UZXYBRXWAQEXJW-NXEZZACHSA-N	-1	3	332.378	1.289	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000265255046	443585511	/nfs/dbraw/zinc/58/55/11/443585511.db2.gz	XCVOYVKKHVCORM-UHFFFAOYSA-N	-1	3	346.361	1.223	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1C[C@@H]1C	ZINC000273159083	443552717	/nfs/dbraw/zinc/55/27/17/443552717.db2.gz	NHLXHBBCXOSDNN-IUCAKERBSA-N	-1	3	328.346	1.316	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1C[C@@H]1C	ZINC000273159082	443552739	/nfs/dbraw/zinc/55/27/39/443552739.db2.gz	NHLXHBBCXOSDNN-DTWKUNHWSA-N	-1	3	328.346	1.316	20	5		EDBDHM
N[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1)c1ccccc1	ZINC000440352245	320073275	/nfs/dbraw/zinc/07/32/75/320073275.db2.gz	FNYQHCGSJNFKMM-SNVBAGLBSA-N	-1	3	327.387	1.635	20	5		EDBDHM
CC(=O)N1CCC[C@H](C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000280123597	443668064	/nfs/dbraw/zinc/66/80/64/443668064.db2.gz	CVRCFNFBLJWSPF-GFCCVEGCSA-N	-1	3	341.389	1.132	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](CO)[C@@H]2CCCO2)c1[N+](=O)[O-]	ZINC000447934617	320148220	/nfs/dbraw/zinc/14/82/20/320148220.db2.gz	ZQMMZNHKYMEXNX-NEPJUHHUSA-N	-1	3	344.389	1.030	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])[C@@H](O)C(F)F	ZINC000451716476	320238481	/nfs/dbraw/zinc/23/84/81/320238481.db2.gz	RWLKHUJDXJEMHB-GZMMTYOYSA-N	-1	3	338.332	1.586	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC(C)(C)C	ZINC000276202782	443669439	/nfs/dbraw/zinc/66/94/39/443669439.db2.gz	JRTQUEFKKXRRCC-UHFFFAOYSA-N	-1	3	330.362	1.706	20	5		EDBDHM
C[C@@H](CN1CCCCC1)[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000530386514	320622920	/nfs/dbraw/zinc/62/29/20/320622920.db2.gz	XKMWOIAHYRAIAA-NSHDSACASA-N	-1	3	328.394	1.143	20	5		EDBDHM
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)Nc1ccc([O-])c([N+](=O)[O-])c1	ZINC000577176059	321629749	/nfs/dbraw/zinc/62/97/49/321629749.db2.gz	MAIMOBYZXDWDDT-OWRWGESLSA-N	-1	3	335.360	1.771	20	5		EDBDHM
CCC(CC)([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)C(=O)OC	ZINC000337960025	444471712	/nfs/dbraw/zinc/47/17/12/444471712.db2.gz	CDSYMZSXWIADSR-UHFFFAOYSA-N	-1	3	344.389	1.746	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCOCC2CCC2)c([N+](=O)[O-])c1	ZINC000580867148	322104554	/nfs/dbraw/zinc/10/45/54/322104554.db2.gz	MCGAURHVYOKPAK-UHFFFAOYSA-N	-1	3	344.389	1.698	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H](OC)C(C)(C)C	ZINC000342304891	444621619	/nfs/dbraw/zinc/62/16/19/444621619.db2.gz	HZMXXAURLSAHKW-CYBMUJFWSA-N	-1	3	346.405	1.943	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCCN(C)[C@@H]2C)c1C	ZINC000343982734	444708446	/nfs/dbraw/zinc/70/84/46/444708446.db2.gz	OVFVWPFTNWQJEM-OLZOCXBDSA-N	-1	3	341.433	1.973	20	5		EDBDHM
CSC[C@H](CCO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000342489974	444713349	/nfs/dbraw/zinc/71/33/49/444713349.db2.gz	GBKVGWVQUIEQCH-QMMMGPOBSA-N	-1	3	340.448	1.357	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCO[C@H](C)C1	ZINC000330614150	445061680	/nfs/dbraw/zinc/06/16/80/445061680.db2.gz	ZULCJKGUNMHUAB-NXEZZACHSA-N	-1	3	330.362	1.449	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H]2CCC[C@H]2F)cc1[N+](=O)[O-]	ZINC000339121948	445041325	/nfs/dbraw/zinc/04/13/25/445041325.db2.gz	FYQIGURKOWYHKT-SCZZXKLOSA-N	-1	3	336.316	1.911	20	5		EDBDHM
COc1ccc(NC(=O)[C@H]([N-]S(C)(=O)=O)C(C)C)cc1[N+](=O)[O-]	ZINC000360001666	445521919	/nfs/dbraw/zinc/52/19/19/445521919.db2.gz	BQMGGVVFRGTNLS-GFCCVEGCSA-N	-1	3	345.377	1.116	20	5		EDBDHM
CCN1CC[C@H]([N-]S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1	ZINC000359945365	445499561	/nfs/dbraw/zinc/49/95/61/445499561.db2.gz	RSJMPXGNKKIVDL-VIFPVBQESA-N	-1	3	333.797	1.621	20	5		EDBDHM
CCn1cc(S(=O)(=O)[N-]Cc2cccc([N+](=O)[O-])c2C)nc1C	ZINC000360132817	445586110	/nfs/dbraw/zinc/58/61/10/445586110.db2.gz	QGKRJZYJLSASNE-UHFFFAOYSA-N	-1	3	338.389	1.907	20	5		EDBDHM
COC(=O)[C@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C(C)C	ZINC000360176827	445614432	/nfs/dbraw/zinc/61/44/32/445614432.db2.gz	DPXJSGYZPXSDFA-GFCCVEGCSA-N	-1	3	344.389	1.688	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2CCN(C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000360258164	445661924	/nfs/dbraw/zinc/66/19/24/445661924.db2.gz	OEFUBOQHBSUCEP-QWHCGFSZSA-N	-1	3	341.433	1.973	20	5		EDBDHM
COC(=O)c1ccc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)o1	ZINC000359094915	445941844	/nfs/dbraw/zinc/94/18/44/445941844.db2.gz	LTIHISNLDSZGEH-UHFFFAOYSA-N	-1	3	340.313	1.453	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)[N-]c2ccncc2F)c1	ZINC000351608453	446203234	/nfs/dbraw/zinc/20/32/34/446203234.db2.gz	HRTWYCQPXHFRCB-UHFFFAOYSA-N	-1	3	325.321	1.968	20	5		EDBDHM
CC[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])CCO1	ZINC000420722814	446772021	/nfs/dbraw/zinc/77/20/21/446772021.db2.gz	JHGOHAXWMXNKGA-GHMZBOCLSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CN1CCC[C@H](N2CCN(C(=O)c3ccc([O-])c([N+](=O)[O-])c3)CC2)C1	ZINC000368320446	446784678	/nfs/dbraw/zinc/78/46/78/446784678.db2.gz	YFRCTGMMRBIZSU-AWEZNQCLSA-N	-1	3	348.403	1.152	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1C(=O)[N-]c1ncn(-c2cccnc2)n1	ZINC000368413069	446846226	/nfs/dbraw/zinc/84/62/26/446846226.db2.gz	UOYWTPDDVPRFOR-UHFFFAOYSA-N	-1	3	340.299	1.831	20	5		EDBDHM
COc1ccc([O-])c(C(=O)N2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)c1	ZINC000372477667	447074712	/nfs/dbraw/zinc/07/47/12/447074712.db2.gz	ILCTVWCIKXGRNH-NSHDSACASA-N	-1	3	346.343	1.983	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2cncnc2-n2cccn2)n1	ZINC000427398394	447590235	/nfs/dbraw/zinc/59/02/35/447590235.db2.gz	JORAOTTZVHVGRE-UHFFFAOYSA-N	-1	3	328.292	1.039	20	5		EDBDHM
CCn1ccc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(OC)c2)n1	ZINC000416587493	447654923	/nfs/dbraw/zinc/65/49/23/447654923.db2.gz	PVTZVVLUMPSROQ-UHFFFAOYSA-N	-1	3	340.361	1.298	20	5		EDBDHM
COC(=O)[C@](C)([N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000522971063	447865829	/nfs/dbraw/zinc/86/58/29/447865829.db2.gz	WXQUWHRYMKPSKG-CQSZACIVSA-N	-1	3	342.373	1.356	20	5		EDBDHM
O=C([O-])c1ccc([N+](=O)[O-])c(N2CCN(C[C@H]3CCOC3)CC2)c1	ZINC000569727685	447878690	/nfs/dbraw/zinc/87/86/90/447878690.db2.gz	MDJSXWSBOLTOON-GFCCVEGCSA-N	-1	3	335.360	1.452	20	5		EDBDHM
COC(=O)c1cc(NC(=O)c2cccc3nn[n-]c32)cc([N+](=O)[O-])c1	ZINC000527358450	448215441	/nfs/dbraw/zinc/21/54/41/448215441.db2.gz	SXYBAVOHZWZSEX-UHFFFAOYSA-N	-1	3	341.283	1.905	20	5		EDBDHM
COC(=O)c1cc(NC(=O)c2cccc3[n-]nnc32)cc([N+](=O)[O-])c1	ZINC000527358450	448215447	/nfs/dbraw/zinc/21/54/47/448215447.db2.gz	SXYBAVOHZWZSEX-UHFFFAOYSA-N	-1	3	341.283	1.905	20	5		EDBDHM
COC(=O)c1cc(NC(=O)c2cccc3n[n-]nc32)cc([N+](=O)[O-])c1	ZINC000527358450	448215449	/nfs/dbraw/zinc/21/54/49/448215449.db2.gz	SXYBAVOHZWZSEX-UHFFFAOYSA-N	-1	3	341.283	1.905	20	5		EDBDHM
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)Nc1ccc([O-])c([N+](=O)[O-])c1	ZINC000577176061	448225935	/nfs/dbraw/zinc/22/59/35/448225935.db2.gz	MAIMOBYZXDWDDT-WNMQOVRZSA-N	-1	3	335.360	1.771	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC)[C@@H](O)C(C)C	ZINC000591332327	448327035	/nfs/dbraw/zinc/32/70/35/448327035.db2.gz	DUJCFUXDIYBLJW-MFKMUULPSA-N	-1	3	346.405	1.677	20	5		EDBDHM
CC[C@@H](C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(=O)OC	ZINC000592076065	448662351	/nfs/dbraw/zinc/66/23/51/448662351.db2.gz	BIFBBCFUDSQLHE-NSHDSACASA-N	-1	3	344.389	1.689	20	5		EDBDHM
CO[C@@H]1[C@H](C)[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1(C)C	ZINC000593572271	449081170	/nfs/dbraw/zinc/08/11/70/449081170.db2.gz	HGHVKTZHORDMFA-JFUSQASVSA-N	-1	3	329.378	1.328	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCC2(CO)CCC2)c(F)c1	ZINC000593664288	449137615	/nfs/dbraw/zinc/13/76/15/449137615.db2.gz	JLPLZGKWHWSAPZ-UHFFFAOYSA-N	-1	3	332.353	1.565	20	5		EDBDHM
CO[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C12CCC2	ZINC000593605790	449103265	/nfs/dbraw/zinc/10/32/65/449103265.db2.gz	KQUWOCSVGFIVFB-WDEREUQCSA-N	-1	3	327.362	1.226	20	5		EDBDHM
CCC[C@@H](C)[C@H](CO)[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000593624219	449114481	/nfs/dbraw/zinc/11/44/81/449114481.db2.gz	GRVSBNPOIJAQSR-MNOVXSKESA-N	-1	3	346.405	1.679	20	5		EDBDHM
COC(=O)[C@@H](CCF)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000593631609	449118079	/nfs/dbraw/zinc/11/80/79/449118079.db2.gz	CSCIPGUPTNWIFZ-SNVBAGLBSA-N	-1	3	348.352	1.391	20	5		EDBDHM
CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000590401649	449148537	/nfs/dbraw/zinc/14/85/37/449148537.db2.gz	MYQGYSYGFRJDDC-ZIAGYGMSSA-N	-1	3	335.360	1.236	20	5		EDBDHM
COCCOC[C@@H]1CCN(Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1	ZINC000593739391	449173469	/nfs/dbraw/zinc/17/34/69/449173469.db2.gz	CQNUPSQCEAERQS-GFCCVEGCSA-N	-1	3	338.360	1.778	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1CC12CCOCC2	ZINC000590762832	449283119	/nfs/dbraw/zinc/28/31/19/449283119.db2.gz	DESGZFHFNUWDHQ-GFCCVEGCSA-N	-1	3	342.373	1.451	20	5		EDBDHM
O=C(c1ccsc1)N1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596085100	449354707	/nfs/dbraw/zinc/35/47/07/449354707.db2.gz	ITEGYQHIKOLNLW-UHFFFAOYSA-N	-1	3	334.357	1.719	20	5		EDBDHM
CN1CCN(c2ncccc2CNc2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596092871	449359580	/nfs/dbraw/zinc/35/95/80/449359580.db2.gz	PNSISQSAIYGOMB-UHFFFAOYSA-N	-1	3	344.375	1.454	20	5		EDBDHM
COc1ccnc(N2CCN(c3cc[n-]c(=O)c3[N+](=O)[O-])CC2)c1	ZINC000596113196	449367667	/nfs/dbraw/zinc/36/76/67/449367667.db2.gz	PWHKXPYLPDDLGD-UHFFFAOYSA-N	-1	3	331.332	1.426	20	5		EDBDHM
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)c2cccc([O-])c2[N+](=O)[O-])C1	ZINC000600624468	449464648	/nfs/dbraw/zinc/46/46/48/449464648.db2.gz	ZYJIPCZQRPVBLY-FPMFFAJLSA-N	-1	3	349.387	1.672	20	5		EDBDHM
O=C(NC[C@H]1CCN1Cc1ccccc1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000598511897	449435586	/nfs/dbraw/zinc/43/55/86/449435586.db2.gz	ULGSYPOWODTKFS-CQSZACIVSA-N	-1	3	342.355	1.700	20	5		EDBDHM
CC(C)C[C@@H](C(=O)[O-])N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000600698966	449499910	/nfs/dbraw/zinc/49/99/10/449499910.db2.gz	GNTAJRAOTIWQHR-HNNXBMFYSA-N	-1	3	349.387	1.852	20	5		EDBDHM
COC(=O)[C@@H]1CCCN1Cc1cn(-c2ccc([O-])cc2[N+](=O)[O-])nn1	ZINC000594653393	449608609	/nfs/dbraw/zinc/60/86/09/449608609.db2.gz	RYLDYCCMSJYGAR-ZDUSSCGKSA-N	-1	3	347.331	1.019	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@H](C)C2(CO)CC2)cc1[N+](=O)[O-]	ZINC000594826584	449734187	/nfs/dbraw/zinc/73/41/87/449734187.db2.gz	GOMMQVJSBHQDNM-MRVPVSSYSA-N	-1	3	348.352	1.182	20	5		EDBDHM
Cc1cc(NCCNc2cc[n-]c(=O)c2[N+](=O)[O-])nc(C(C)C)n1	ZINC000599147315	449763468	/nfs/dbraw/zinc/76/34/68/449763468.db2.gz	KKRBGLMQXBTBDE-UHFFFAOYSA-N	-1	3	332.364	2.441	20	5		EDBDHM
CCN(CC)CC[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F	ZINC000601279833	449794085	/nfs/dbraw/zinc/79/40/85/449794085.db2.gz	BLNLPUPZVHTJLQ-UHFFFAOYSA-N	-1	3	333.385	1.662	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](CO)CCC(C)C	ZINC000599410854	449956434	/nfs/dbraw/zinc/95/64/34/449956434.db2.gz	SVZJCQWBSKPFFE-NSHDSACASA-N	-1	3	346.405	1.679	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@]23C[C@H]2COC3(C)C)c(F)cc1[N+](=O)[O-]	ZINC000601474591	449997654	/nfs/dbraw/zinc/99/76/54/449997654.db2.gz	RMDNEONNWRNEOI-LKFCYVNXSA-N	-1	3	344.364	1.888	20	5		EDBDHM
C[C@@H]1[C@@H](C)[S@](=O)CCN1c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000736225930	578964899	/nfs/dbraw/zinc/96/48/99/578964899.db2.gz	UCLUJRLGPRJZBM-DNKNOMGSSA-N	-1	3	336.377	1.121	20	5		EDBDHM
C[C@@H]1[C@@H](C)[S@](=O)CCN1c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000736225930	578964900	/nfs/dbraw/zinc/96/49/00/578964900.db2.gz	UCLUJRLGPRJZBM-DNKNOMGSSA-N	-1	3	336.377	1.121	20	5		EDBDHM
C[C@H]1COCCN1c1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000736295064	578973749	/nfs/dbraw/zinc/97/37/49/578973749.db2.gz	XXLJDUIQSCCKNQ-VIFPVBQESA-N	-1	3	341.331	1.548	20	5		EDBDHM
C[C@H]1COCCN1c1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000736295064	578973750	/nfs/dbraw/zinc/97/37/50/578973750.db2.gz	XXLJDUIQSCCKNQ-VIFPVBQESA-N	-1	3	341.331	1.548	20	5		EDBDHM
COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nnn[n-]3)cn2)c1	ZINC000737116904	579048603	/nfs/dbraw/zinc/04/86/03/579048603.db2.gz	UAESAVMYSOXKAX-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nn[n-]n3)cn2)c1	ZINC000737116904	579048604	/nfs/dbraw/zinc/04/86/04/579048604.db2.gz	UAESAVMYSOXKAX-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
NC(=O)CC[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C1	ZINC000737748923	579127877	/nfs/dbraw/zinc/12/78/77/579127877.db2.gz	SLNZIUYBYRRRKL-JTQLQIEISA-N	-1	3	345.363	1.257	20	5		EDBDHM
NC(=O)CC[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C1	ZINC000737748923	579127878	/nfs/dbraw/zinc/12/78/78/579127878.db2.gz	SLNZIUYBYRRRKL-JTQLQIEISA-N	-1	3	345.363	1.257	20	5		EDBDHM
Cn1ncc2c1nc(COC(=O)Cc1cccc([N+](=O)[O-])c1)[n-]c2=O	ZINC000745333538	579546536	/nfs/dbraw/zinc/54/65/36/579546536.db2.gz	OMEFWNCHGQEVNO-UHFFFAOYSA-N	-1	3	343.299	1.263	20	5		EDBDHM
O=C(Nc1cnn(-c2ccccc2)n1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000777524251	580443324	/nfs/dbraw/zinc/44/33/24/580443324.db2.gz	FMKHYIPSXRWLLE-UHFFFAOYSA-N	-1	3	326.272	1.528	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@H](C)OC(=O)c2c(N)cccc2[N+](=O)[O-])on1	ZINC000778144998	580457514	/nfs/dbraw/zinc/45/75/14/580457514.db2.gz	GIHMJUQUFNHKJC-QMMMGPOBSA-N	-1	3	334.288	1.657	20	5		EDBDHM
O=[N+]([O-])c1ccc[n-]c1=NNS(=O)(=O)N1CCc2ccccc2C1	ZINC000759168910	580000125	/nfs/dbraw/zinc/00/01/25/580000125.db2.gz	UMMSDCYXAPDMQK-UHFFFAOYSA-N	-1	3	349.372	1.209	20	5		EDBDHM
COC(=O)c1cc([N-]C(=O)c2c([N+](=O)[O-])cnn2C)cc([N+](=O)[O-])c1	ZINC000767002811	580179414	/nfs/dbraw/zinc/17/94/14/580179414.db2.gz	YCVPAJGCILVIFH-UHFFFAOYSA-N	-1	3	349.259	1.275	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CC2(CO)CC2)c1	ZINC000779904795	580502164	/nfs/dbraw/zinc/50/21/64/580502164.db2.gz	MFXDNNYYXLSUKL-UHFFFAOYSA-N	-1	3	334.781	1.607	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)[N-]N1CCc2ccccc2C1=O	ZINC000781064297	580541200	/nfs/dbraw/zinc/54/12/00/580541200.db2.gz	GYMIWUKEXXWJDK-UHFFFAOYSA-N	-1	3	326.312	1.642	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](CCO)C1CC1	ZINC000795120643	580913758	/nfs/dbraw/zinc/91/37/58/580913758.db2.gz	LQLUFCBHWBPPMY-JTQLQIEISA-N	-1	3	330.362	1.043	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](C)c1ccc[nH]1	ZINC000795147533	580914364	/nfs/dbraw/zinc/91/43/64/580914364.db2.gz	CEXDXEXYDQBQET-SECBINFHSA-N	-1	3	325.346	1.971	20	5		EDBDHM
O=[N+]([O-])c1cccc(-c2noc(-c3ccc(-c4nnn[n-]4)cn3)n2)c1	ZINC000738366639	598860307	/nfs/dbraw/zinc/86/03/07/598860307.db2.gz	GNQMIBNMMJIFQN-UHFFFAOYSA-N	-1	3	336.271	1.887	20	5		EDBDHM
O=[N+]([O-])c1cccc(-c2noc(-c3ccc(-c4nn[n-]n4)cn3)n2)c1	ZINC000738366639	598860308	/nfs/dbraw/zinc/86/03/08/598860308.db2.gz	GNQMIBNMMJIFQN-UHFFFAOYSA-N	-1	3	336.271	1.887	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1OS(=O)(=O)c1c(C)n[n-]c1C	ZINC000010511212	590906730	/nfs/dbraw/zinc/90/67/30/590906730.db2.gz	VUROKXMDFFGKDI-UHFFFAOYSA-N	-1	3	327.318	1.711	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2COC[C@@H]2C2CC2)c(F)c1	ZINC000908416724	592487845	/nfs/dbraw/zinc/48/78/45/592487845.db2.gz	WMFXFFNUWYWCQN-ZYHUDNBSSA-N	-1	3	330.337	1.437	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1C(=O)OCC1(C)C	ZINC000841534627	593218176	/nfs/dbraw/zinc/21/81/76/593218176.db2.gz	LACWDXKDFIJANK-NSHDSACASA-N	-1	3	328.346	1.133	20	5		EDBDHM
CC(C)(CNc1ccc(-c2nnn[n-]2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000819984003	593781129	/nfs/dbraw/zinc/78/11/29/593781129.db2.gz	MCNOFJRLHQUDMG-UHFFFAOYSA-N	-1	3	347.379	1.298	20	5		EDBDHM
CC(C)(CNc1ccc(-c2nn[n-]n2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000819984003	593781130	/nfs/dbraw/zinc/78/11/30/593781130.db2.gz	MCNOFJRLHQUDMG-UHFFFAOYSA-N	-1	3	347.379	1.298	20	5		EDBDHM
CN(C)CCN(CC(=O)[O-])C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000820539209	593827326	/nfs/dbraw/zinc/82/73/26/593827326.db2.gz	GZRKRIOOKJJIOG-UHFFFAOYSA-N	-1	3	334.332	1.165	20	5		EDBDHM
C[C@@H]1C[C@@H]1N1C[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1=O	ZINC000820674916	593859896	/nfs/dbraw/zinc/85/98/96/593859896.db2.gz	HHEJUPYRWDRMJT-ZDMBXUJBSA-N	-1	3	343.347	1.196	20	5		EDBDHM
C[C@@H]1C[C@@H]1N1C[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1=O	ZINC000820674916	593859899	/nfs/dbraw/zinc/85/98/99/593859899.db2.gz	HHEJUPYRWDRMJT-ZDMBXUJBSA-N	-1	3	343.347	1.196	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)Oc1ccc(-c2nnn[n-]2)cc1F	ZINC000822471594	594053498	/nfs/dbraw/zinc/05/34/98/594053498.db2.gz	DYRQRRNNKXSSIA-UHFFFAOYSA-N	-1	3	344.262	1.837	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)Oc1ccc(-c2nn[n-]n2)cc1F	ZINC000822471594	594053500	/nfs/dbraw/zinc/05/35/00/594053500.db2.gz	DYRQRRNNKXSSIA-UHFFFAOYSA-N	-1	3	344.262	1.837	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])n1CCCOc1cccc(-c2nnn[n-]2)c1	ZINC000822471872	594053819	/nfs/dbraw/zinc/05/38/19/594053819.db2.gz	LQEDTOWOJGQSTR-UHFFFAOYSA-N	-1	3	329.320	1.749	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])n1CCCOc1cccc(-c2nn[n-]n2)c1	ZINC000822471872	594053821	/nfs/dbraw/zinc/05/38/21/594053821.db2.gz	LQEDTOWOJGQSTR-UHFFFAOYSA-N	-1	3	329.320	1.749	20	5		EDBDHM
O=C(NCc1cc(-c2nnn[n-]2)ccc1F)c1ccc([N+](=O)[O-])cc1	ZINC000823242028	594174638	/nfs/dbraw/zinc/17/46/38/594174638.db2.gz	OBLRFFUKQBRGIK-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
O=C(NCc1cc(-c2nn[n-]n2)ccc1F)c1ccc([N+](=O)[O-])cc1	ZINC000823242028	594174639	/nfs/dbraw/zinc/17/46/39/594174639.db2.gz	OBLRFFUKQBRGIK-UHFFFAOYSA-N	-1	3	342.290	1.844	20	5		EDBDHM
CC(C)[C@H](CO)ON=C([O-])Nc1cc(Cl)cc([N+](=O)[O-])c1N	ZINC000825567299	594201639	/nfs/dbraw/zinc/20/16/39/594201639.db2.gz	HMUUSBCCBOIHBP-JTQLQIEISA-N	-1	3	332.744	1.900	20	5		EDBDHM
CC(C)[C@H](CO)O[N-]C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N	ZINC000825567299	594201641	/nfs/dbraw/zinc/20/16/41/594201641.db2.gz	HMUUSBCCBOIHBP-JTQLQIEISA-N	-1	3	332.744	1.900	20	5		EDBDHM
O=[N+]([O-])c1c(-c2nnn[n-]2)ccnc1N1CCC[C@H](c2ncc[nH]2)C1	ZINC000823620249	594221905	/nfs/dbraw/zinc/22/19/05/594221905.db2.gz	IYCQEPNAGZBCKP-VIFPVBQESA-N	-1	3	341.335	1.277	20	5		EDBDHM
O=[N+]([O-])c1c(-c2nn[n-]n2)ccnc1N1CCC[C@H](c2ncc[nH]2)C1	ZINC000823620249	594221906	/nfs/dbraw/zinc/22/19/06/594221906.db2.gz	IYCQEPNAGZBCKP-VIFPVBQESA-N	-1	3	341.335	1.277	20	5		EDBDHM
CN(Cc1ncc(Cl)n1C)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825999384	594301971	/nfs/dbraw/zinc/30/19/71/594301971.db2.gz	ZDMJFWPZDTVMBR-UHFFFAOYSA-N	-1	3	348.754	1.798	20	5		EDBDHM
CN(Cc1ncc(Cl)n1C)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825999384	594301975	/nfs/dbraw/zinc/30/19/75/594301975.db2.gz	ZDMJFWPZDTVMBR-UHFFFAOYSA-N	-1	3	348.754	1.798	20	5		EDBDHM
Cc1cc(-c2nnn[n-]2)ccc1COC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000826254653	594400480	/nfs/dbraw/zinc/40/04/80/594400480.db2.gz	VNBCREJCSJJYIY-UHFFFAOYSA-N	-1	3	342.315	1.779	20	5		EDBDHM
Cc1cc(-c2nn[n-]n2)ccc1COC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000826254653	594400482	/nfs/dbraw/zinc/40/04/82/594400482.db2.gz	VNBCREJCSJJYIY-UHFFFAOYSA-N	-1	3	342.315	1.779	20	5		EDBDHM
Cc1ccnc(NCCOc2ccc([N+](=O)[O-])cc2)c1-c1nnn[n-]1	ZINC000826314393	594420518	/nfs/dbraw/zinc/42/05/18/594420518.db2.gz	UOSGOZXLNJAZAN-UHFFFAOYSA-N	-1	3	341.331	1.969	20	5		EDBDHM
Cc1ccnc(NCCOc2ccc([N+](=O)[O-])cc2)c1-c1nn[n-]n1	ZINC000826314393	594420520	/nfs/dbraw/zinc/42/05/20/594420520.db2.gz	UOSGOZXLNJAZAN-UHFFFAOYSA-N	-1	3	341.331	1.969	20	5		EDBDHM
Cn1c(CNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)nnc1C1CC1	ZINC000826355217	594441433	/nfs/dbraw/zinc/44/14/33/594441433.db2.gz	PECXYIJNOLMZCA-UHFFFAOYSA-N	-1	3	341.335	1.393	20	5		EDBDHM
Cn1c(CNc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)nnc1C1CC1	ZINC000826355217	594441434	/nfs/dbraw/zinc/44/14/34/594441434.db2.gz	PECXYIJNOLMZCA-UHFFFAOYSA-N	-1	3	341.335	1.393	20	5		EDBDHM
O=C(NCCc1cccc([N+](=O)[O-])c1)c1ccc(-c2nnn[n-]2)cc1	ZINC000826439885	594477712	/nfs/dbraw/zinc/47/77/12/594477712.db2.gz	PAVCUUSKMIUKPQ-UHFFFAOYSA-N	-1	3	338.327	1.747	20	5		EDBDHM
O=C(NCCc1cccc([N+](=O)[O-])c1)c1ccc(-c2nn[n-]n2)cc1	ZINC000826439885	594477715	/nfs/dbraw/zinc/47/77/15/594477715.db2.gz	PAVCUUSKMIUKPQ-UHFFFAOYSA-N	-1	3	338.327	1.747	20	5		EDBDHM
O=C(OCc1cc(F)ccc1[N+](=O)[O-])c1c[nH]c(-c2nnn[n-]2)c1	ZINC000826464582	594486438	/nfs/dbraw/zinc/48/64/38/594486438.db2.gz	CVXOASNAQVJJQP-UHFFFAOYSA-N	-1	3	332.251	1.599	20	5		EDBDHM
O=C(OCc1cc(F)ccc1[N+](=O)[O-])c1c[nH]c(-c2nn[n-]n2)c1	ZINC000826464582	594486439	/nfs/dbraw/zinc/48/64/39/594486439.db2.gz	CVXOASNAQVJJQP-UHFFFAOYSA-N	-1	3	332.251	1.599	20	5		EDBDHM
O=C1C[C@H](CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CN1C1CC1	ZINC000826478813	594493251	/nfs/dbraw/zinc/49/32/51/594493251.db2.gz	KBOQKGUWOZIQLJ-SECBINFHSA-N	-1	3	343.347	1.198	20	5		EDBDHM
O=C1C[C@H](CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CN1C1CC1	ZINC000826478813	594493253	/nfs/dbraw/zinc/49/32/53/594493253.db2.gz	KBOQKGUWOZIQLJ-SECBINFHSA-N	-1	3	343.347	1.198	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N[C@@H](CO)CC(F)(F)F	ZINC000826497654	594501869	/nfs/dbraw/zinc/50/18/69/594501869.db2.gz	OPMJSIOZVVMVFA-SSDOTTSWSA-N	-1	3	332.242	1.500	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N[C@@H](CO)CC(F)(F)F	ZINC000826497654	594501871	/nfs/dbraw/zinc/50/18/71/594501871.db2.gz	OPMJSIOZVVMVFA-SSDOTTSWSA-N	-1	3	332.242	1.500	20	5		EDBDHM
O=[N+]([O-])c1cccc(OC[C@H](O)c2ccc(-c3nnn[n-]3)cc2)c1	ZINC000826499504	594503474	/nfs/dbraw/zinc/50/34/74/594503474.db2.gz	LDDYFSDDZUNIDH-AWEZNQCLSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1cccc(OC[C@H](O)c2ccc(-c3nn[n-]n3)cc2)c1	ZINC000826499504	594503475	/nfs/dbraw/zinc/50/34/75/594503475.db2.gz	LDDYFSDDZUNIDH-AWEZNQCLSA-N	-1	3	327.300	1.887	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl)[C@H](C)O	ZINC000832309662	594741857	/nfs/dbraw/zinc/74/18/57/594741857.db2.gz	JKGVRZHUUKGSHI-WCBMZHEXSA-N	-1	3	336.797	1.994	20	5		EDBDHM
CCOc1cc(C(=O)[N-]O[C@H](CO)C(C)C)c([N+](=O)[O-])cc1OC	ZINC000836899407	595011771	/nfs/dbraw/zinc/01/17/71/595011771.db2.gz	CGQGQWQGBDGBDL-CQSZACIVSA-N	-1	3	342.348	1.680	20	5		EDBDHM
CCNC(=O)[C@@H](C)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848580496	595408419	/nfs/dbraw/zinc/40/84/19/595408419.db2.gz	WBAOSCXOWUJKIT-MRVPVSSYSA-N	-1	3	331.275	1.207	20	5		EDBDHM
CC1(C)OC[C@H](C[N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)O1	ZINC000848584530	595409718	/nfs/dbraw/zinc/40/97/18/595409718.db2.gz	AQSKTYFBPPMRBL-NSHDSACASA-N	-1	3	346.286	1.834	20	5		EDBDHM
CC(C)(C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1)OCCO	ZINC000848589075	595410931	/nfs/dbraw/zinc/41/09/31/595410931.db2.gz	FMGBOULZXYXORA-UHFFFAOYSA-N	-1	3	348.302	1.470	20	5		EDBDHM
COC(=O)NCC[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848592462	595412312	/nfs/dbraw/zinc/41/23/12/595412312.db2.gz	UBJPFDSQBMCFLF-UHFFFAOYSA-N	-1	3	333.247	1.039	20	5		EDBDHM
CCO/C=C/[C@](O)(CNc1cc[n-]c(=O)c1[N+](=O)[O-])C(F)(F)F	ZINC000853624511	595836633	/nfs/dbraw/zinc/83/66/33/595836633.db2.gz	JEEYOQQZLHUHHL-MALLOTDXSA-N	-1	3	337.254	1.951	20	5		EDBDHM
O=C([N-]C[C@H]1CCCN(c2cc[nH]c(=O)c2[N+](=O)[O-])C1)C(F)(F)F	ZINC000853637293	595841928	/nfs/dbraw/zinc/84/19/28/595841928.db2.gz	QBYYLQLTOBAUAI-MRVPVSSYSA-N	-1	3	348.281	1.590	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@H]2CCCN(CCF)C2)cs1	ZINC000867711171	596509003	/nfs/dbraw/zinc/50/90/03/596509003.db2.gz	OSCQTSTULPFSML-VIFPVBQESA-N	-1	3	337.398	1.369	20	5		EDBDHM
COC[C@H]1C[C@@H]([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000882697130	598024848	/nfs/dbraw/zinc/02/48/48/598024848.db2.gz	DMSTXRXGDGVPIY-WAAGHKOSSA-N	-1	3	334.781	1.952	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NCc1cn2c(n1)CCCC2	ZINC000738357115	598395432	/nfs/dbraw/zinc/39/54/32/598395432.db2.gz	BUMSJSIKOSLJFK-UHFFFAOYSA-N	-1	3	340.347	1.920	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NCc1cn2c(n1)CCCC2	ZINC000738357115	598395435	/nfs/dbraw/zinc/39/54/35/598395435.db2.gz	BUMSJSIKOSLJFK-UHFFFAOYSA-N	-1	3	340.347	1.920	20	5		EDBDHM
C[C@H]1CCCCN1CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000066000552	215002943	/nfs/dbraw/zinc/00/29/43/215002943.db2.gz	INWUZYVHUDXPAO-JTQLQIEISA-N	-1	3	333.435	1.809	20	5		EDBDHM
CN(C)[C@@]1(CNc2nccc(C(=O)[O-])c2[N+](=O)[O-])CCSC1	ZINC000563205430	306323518	/nfs/dbraw/zinc/32/35/18/306323518.db2.gz	FXBZRZIVHFVRGA-CYBMUJFWSA-N	-1	3	326.378	1.537	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCc1nccs1	ZINC000051163024	138134903	/nfs/dbraw/zinc/13/49/03/138134903.db2.gz	ZOABORFMSBRDDA-UHFFFAOYSA-N	-1	3	343.386	1.581	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]c2ccc(=O)n(C)c2)cc1C	ZINC000098052366	138297419	/nfs/dbraw/zinc/29/74/19/138297419.db2.gz	JETPVAICRRCQGL-UHFFFAOYSA-N	-1	3	337.357	1.711	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1C[C@@H](O)C1(C)C	ZINC000275370288	201290196	/nfs/dbraw/zinc/29/01/96/201290196.db2.gz	KLLLRDMOTRGWTL-NWDGAFQWSA-N	-1	3	330.362	1.041	20	5		EDBDHM
CCn1cc(C[N-]S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)cn1	ZINC000285644333	201333243	/nfs/dbraw/zinc/33/32/43/201333243.db2.gz	OOUXSGRWKUKKRO-UHFFFAOYSA-N	-1	3	342.352	1.737	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1ncoc1C	ZINC000161971950	206378970	/nfs/dbraw/zinc/37/89/70/206378970.db2.gz	PCOGIMMOTLEZIX-UHFFFAOYSA-N	-1	3	327.318	1.378	20	5		EDBDHM
O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)[N-][C@H]1CCOC1	ZINC000416442181	251069017	/nfs/dbraw/zinc/06/90/17/251069017.db2.gz	FODDXFMLZDRDMQ-QMMMGPOBSA-N	-1	3	340.279	1.681	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CC[C@H](C)O1	ZINC000416536400	251075245	/nfs/dbraw/zinc/07/52/45/251075245.db2.gz	PTWDUMDEVLGYAH-GXSJLCMTSA-N	-1	3	330.362	1.449	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@H]2CC23CC3)cc1[N+](=O)[O-]	ZINC000416653558	251095860	/nfs/dbraw/zinc/09/58/60/251095860.db2.gz	UKARLSUKFDQVNM-MRVPVSSYSA-N	-1	3	330.337	1.821	20	5		EDBDHM
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCc2nc[n-]c(=O)c2C1	ZINC000179941480	291824158	/nfs/dbraw/zinc/82/41/58/291824158.db2.gz	ZOWWFETZODTCHB-UHFFFAOYSA-N	-1	3	342.355	1.802	20	5		EDBDHM
COC(=O)[C@H](CC(C)C)[N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000264109414	139380991	/nfs/dbraw/zinc/38/09/91/139380991.db2.gz	IRNYZMXHLDBKNC-ZDUSSCGKSA-N	-1	3	344.389	1.602	20	5		EDBDHM
C[C@@]1([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CCS(=O)(=O)C1	ZINC000272133561	140406510	/nfs/dbraw/zinc/40/65/10/140406510.db2.gz	XLNCNEJJVSWJEL-GFCCVEGCSA-N	-1	3	348.327	1.380	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@@H](CO)C(C)C)c1C	ZINC000344809458	143014385	/nfs/dbraw/zinc/01/43/85/143014385.db2.gz	MOHCRBFOLBSIRN-LBPRGKRZSA-N	-1	3	330.406	1.754	20	5		EDBDHM
COc1cc(C(=O)NCc2cnc(C)[n-]c2=O)cc([N+](=O)[O-])c1OC	ZINC000345098133	143049943	/nfs/dbraw/zinc/04/99/43/143049943.db2.gz	RQJBJIXVTNKNBJ-UHFFFAOYSA-N	-1	3	348.315	1.346	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1(C)CCCC1	ZINC000345242629	143068840	/nfs/dbraw/zinc/06/88/40/143068840.db2.gz	ZUCCZIKYFILTAD-UHFFFAOYSA-N	-1	3	342.373	1.992	20	5		EDBDHM
CC[C@@H](C)[C@@](C)(O)C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000352869576	149196245	/nfs/dbraw/zinc/19/62/45/149196245.db2.gz	HSUUAJUMAOLLPG-RISCZKNCSA-N	-1	3	330.406	1.811	20	5		EDBDHM
CC(C)([N-]S(C)(=O)=O)c1nc(Cc2ccccc2[N+](=O)[O-])no1	ZINC000355684521	150359195	/nfs/dbraw/zinc/35/91/95/150359195.db2.gz	YZRKKFHTPHBFSC-UHFFFAOYSA-N	-1	3	340.361	1.353	20	5		EDBDHM
NC(=O)CCOc1ccccc1NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000362338834	152682810	/nfs/dbraw/zinc/68/28/10/152682810.db2.gz	GVBGRTTVYHVELW-UHFFFAOYSA-N	-1	3	346.299	1.202	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1C[C@@H]2OCCC[C@@H]12	ZINC000364842407	153349294	/nfs/dbraw/zinc/34/92/94/153349294.db2.gz	JHSULZJBUPKICK-TUAOUCFPSA-N	-1	3	342.373	1.449	20	5		EDBDHM
CC[C@@H](C[C@@H](C)CO)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000443327877	286858154	/nfs/dbraw/zinc/85/81/54/286858154.db2.gz	OGCSMIILNSKTEL-PWSUYJOCSA-N	-1	3	330.406	1.979	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2C[C@H](C)N(C3CC3)C2)c([N+](=O)[O-])c1	ZINC000124036233	222367632	/nfs/dbraw/zinc/36/76/32/222367632.db2.gz	LYKJSCUZAZKNHQ-RYUDHWBXSA-N	-1	3	339.417	1.807	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCOC[C@H]1C	ZINC000278065890	273245811	/nfs/dbraw/zinc/24/58/11/273245811.db2.gz	YZBBVWWTPDPKEO-MWLCHTKSSA-N	-1	3	330.362	1.307	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C1(CN(C)C)CCC1	ZINC000281463080	273477196	/nfs/dbraw/zinc/47/71/96/273477196.db2.gz	INQXTDQHUBXJMG-UHFFFAOYSA-N	-1	3	327.406	1.666	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H]1CCOC[C@H]1C	ZINC000285622468	274598597	/nfs/dbraw/zinc/59/85/97/274598597.db2.gz	NJEFXUMAVBLFCS-NEPJUHHUSA-N	-1	3	328.390	1.854	20	5		EDBDHM
C[C@]1(C[C@@H]2CCCN2C(=O)c2ccccc2[N+](=O)[O-])NC(=O)[N-]C1=O	ZINC000286154330	287948010	/nfs/dbraw/zinc/94/80/10/287948010.db2.gz	IYUMSTOMOFLFNN-MGPLVRAMSA-N	-1	3	346.343	1.188	20	5		EDBDHM
CC[C@H](C)[C@H]([N-]S(C)(=O)=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1	ZINC000114115196	280793193	/nfs/dbraw/zinc/79/31/93/280793193.db2.gz	SQLGPMRXAQRGMO-ZANVPECISA-N	-1	3	343.405	1.806	20	5		EDBDHM
CO[C@@H]1C[C@H](CN2CCCC2)N(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C1	ZINC000347893861	293940345	/nfs/dbraw/zinc/94/03/45/293940345.db2.gz	CGRZQMDMSNDJJF-ZIAGYGMSSA-N	-1	3	349.387	1.626	20	5		EDBDHM
Cn1ncc([N+](=O)[O-])c1C(=O)[N-]c1cc(-c2ccccc2F)on1	ZINC000448490244	447324460	/nfs/dbraw/zinc/32/44/60/447324460.db2.gz	ASKQYZCWRUIVJE-UHFFFAOYSA-N	-1	3	331.263	2.375	20	5		EDBDHM
CCNC(=O)[C@@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C(C)C	ZINC000432298401	305090640	/nfs/dbraw/zinc/09/06/40/305090640.db2.gz	AHQIBXMENNOOGG-ZDUSSCGKSA-N	-1	3	343.405	1.342	20	5		EDBDHM
Cc1cc(OCC(=O)NCc2cnc(C)[n-]c2=O)ccc1[N+](=O)[O-]	ZINC000435816901	305147726	/nfs/dbraw/zinc/14/77/26/305147726.db2.gz	JHZWUILUCOXIJB-UHFFFAOYSA-N	-1	3	332.316	1.402	20	5		EDBDHM
CO[C@H]1C[C@@H]([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C1(C)C	ZINC000440406421	305205881	/nfs/dbraw/zinc/20/58/81/305205881.db2.gz	XRAMKFCPJJENAY-OLZOCXBDSA-N	-1	3	328.390	1.995	20	5		EDBDHM
O=C(Nc1ccc2c(c1)OCC(=O)N2)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000445196313	305257877	/nfs/dbraw/zinc/25/78/77/305257877.db2.gz	QZBHCQUMGZOXNJ-UHFFFAOYSA-N	-1	3	330.256	1.279	20	5		EDBDHM
CN1CCC[C@@H](N2CCN(C(=O)c3cccc([N+](=O)[O-])c3[O-])CC2)C1	ZINC000378177232	447405559	/nfs/dbraw/zinc/40/55/59/447405559.db2.gz	SKIMUQMBSPRIFN-CYBMUJFWSA-N	-1	3	348.403	1.152	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]CCCn1cccn1	ZINC000045932589	441063074	/nfs/dbraw/zinc/06/30/74/441063074.db2.gz	RTWCJKIYTNCAJB-UHFFFAOYSA-N	-1	3	344.780	1.813	20	5		EDBDHM
O=c1ccc([N+](=O)[O-])cn1Cc1nc2c3ccccc3oc2c(=O)[n-]1	ZINC000071073641	441138394	/nfs/dbraw/zinc/13/83/94/441138394.db2.gz	QNTQBXKXDSOPHF-UHFFFAOYSA-N	-1	3	338.279	1.788	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)N1CCCC1	ZINC000047543726	441203332	/nfs/dbraw/zinc/20/33/32/441203332.db2.gz	RTUZNBLYSGCBSW-UHFFFAOYSA-N	-1	3	347.780	1.149	20	5		EDBDHM
CC(=O)NCCC[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000060498936	441247194	/nfs/dbraw/zinc/24/71/94/441247194.db2.gz	IZSCDQWEBLYWHI-UHFFFAOYSA-N	-1	3	329.378	1.016	20	5		EDBDHM
CS(=O)(=O)c1cc(C(=O)Nc2ncccc2[O-])cc([N+](=O)[O-])c1	ZINC000063090586	441311813	/nfs/dbraw/zinc/31/18/13/441311813.db2.gz	RKLQEPFILOQJPP-UHFFFAOYSA-N	-1	3	337.313	1.351	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C2CCN(C3CC3)CC2)c(F)c1	ZINC000055219385	441630589	/nfs/dbraw/zinc/63/05/89/441630589.db2.gz	MZBAXVACGNSKNF-UHFFFAOYSA-N	-1	3	343.380	1.639	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])N1CCC(C)CC1	ZINC000068961088	441874607	/nfs/dbraw/zinc/87/46/07/441874607.db2.gz	FQFHDJCZVZGMIA-ZDUSSCGKSA-N	-1	3	341.433	1.994	20	5		EDBDHM
CCc1nn(C)c(NCCNC(=O)c2ccc([O-])cc2)c1[N+](=O)[O-]	ZINC000092828795	441831606	/nfs/dbraw/zinc/83/16/06/441831606.db2.gz	AYORSRUDOMTWGZ-UHFFFAOYSA-N	-1	3	333.348	1.438	20	5		EDBDHM
CCC(CC)C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000116651660	441835464	/nfs/dbraw/zinc/83/54/64/441835464.db2.gz	NJELCRLJAOTGSI-UHFFFAOYSA-N	-1	3	343.405	1.426	20	5		EDBDHM
Cc1noc(C)c1C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000147474474	441907785	/nfs/dbraw/zinc/90/77/85/441907785.db2.gz	MQVRFJMEGDYQQC-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
Cc1ccc(NCCC[N-]S(=O)(=O)c2c[nH]cn2)c([N+](=O)[O-])c1	ZINC000151688568	442107471	/nfs/dbraw/zinc/10/74/71/442107471.db2.gz	IEPYELDYFHGFKX-UHFFFAOYSA-N	-1	3	339.377	1.407	20	5		EDBDHM
Cc1ccc(CN(CCN(C)C)C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)o1	ZINC000188311220	442737001	/nfs/dbraw/zinc/73/70/01/442737001.db2.gz	HLQDEGRBANHWCW-UHFFFAOYSA-N	-1	3	348.359	1.801	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]C[C@H]2CC[C@@H](O)C2)cc1[N+](=O)[O-]	ZINC000188352360	442742401	/nfs/dbraw/zinc/74/24/01/442742401.db2.gz	RZJXDCCRNOOZAS-VHSXEESVSA-N	-1	3	332.353	1.482	20	5		EDBDHM
C[C@H]1CN(C2CC2)C[C@H]1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000268117234	442855000	/nfs/dbraw/zinc/85/50/00/442855000.db2.gz	AEGPJQQCEUPGLU-CMPLNLGQSA-N	-1	3	325.390	1.356	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCCC[C@H]1OC	ZINC000266127139	443027013	/nfs/dbraw/zinc/02/70/13/443027013.db2.gz	AJPZXHGHDABFOK-VXGBXAGGSA-N	-1	3	344.389	1.839	20	5		EDBDHM
C/C=C/C[C@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000185280444	443175211	/nfs/dbraw/zinc/17/52/11/443175211.db2.gz	GUPHMOSNDTXZCS-GKQMSVHHSA-N	-1	3	334.781	1.854	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])[C@H]1CCCO1	ZINC000278736822	443420343	/nfs/dbraw/zinc/42/03/43/443420343.db2.gz	MKSSXACLUDOYKW-ZYHUDNBSSA-N	-1	3	330.362	1.067	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@@H](O)C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000269752388	443423883	/nfs/dbraw/zinc/42/38/83/443423883.db2.gz	ZLTHFPHAUZMLKM-SECBINFHSA-N	-1	3	328.268	1.105	20	5		EDBDHM
CCOC1CC(O)(C[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C1	ZINC000443986082	320118089	/nfs/dbraw/zinc/11/80/89/320118089.db2.gz	ZDHWQSFJAZSUQW-UHFFFAOYSA-N	-1	3	344.389	1.112	20	5		EDBDHM
CCOCC(C)(C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000292698581	443820659	/nfs/dbraw/zinc/82/06/59/443820659.db2.gz	CZWOYEYLFSVJLK-UHFFFAOYSA-N	-1	3	332.378	1.697	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](C)[C@H]2CCOC2)c1[N+](=O)[O-]	ZINC000276799517	443831799	/nfs/dbraw/zinc/83/17/99/443831799.db2.gz	KNJLBFDRZUOUMV-NEPJUHHUSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H](C)Cn2ccnc2)c1[N+](=O)[O-]	ZINC000276805260	443834070	/nfs/dbraw/zinc/83/40/70/443834070.db2.gz	LGAHSOMQOUBFQT-LBPRGKRZSA-N	-1	3	338.389	1.775	20	5		EDBDHM
CCOC(=O)C(C)(C)ON=C([O-])Nc1ccc(OC)c([N+](=O)[O-])c1	ZINC000296604913	444243166	/nfs/dbraw/zinc/24/31/66/444243166.db2.gz	DSJZZADYONLVKS-UHFFFAOYSA-N	-1	3	341.320	1.998	20	5		EDBDHM
CCOC(=O)C(C)(C)O[N-]C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1	ZINC000296604913	444243167	/nfs/dbraw/zinc/24/31/67/444243167.db2.gz	DSJZZADYONLVKS-UHFFFAOYSA-N	-1	3	341.320	1.998	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCC[C@@H]1CO	ZINC000312674523	444294892	/nfs/dbraw/zinc/29/48/92/444294892.db2.gz	ZOGGCJXATDJRGE-MWLCHTKSSA-N	-1	3	330.362	1.043	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCC[C@H](CO)C1	ZINC000323679384	444345175	/nfs/dbraw/zinc/34/51/75/444345175.db2.gz	YPYGLCWICFMZNN-QWRGUYRKSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CCOc1cc(N2CCN(C(C)(C)C(=O)[O-])CC2)ccc1[N+](=O)[O-]	ZINC000578894580	321850264	/nfs/dbraw/zinc/85/02/64/321850264.db2.gz	ORJWTCFMQQPNIL-UHFFFAOYSA-N	-1	3	337.376	1.979	20	5		EDBDHM
CCN(C)S(=O)(=O)[N-]c1cc(Br)cc([N+](=O)[O-])c1	ZINC000340725764	444489832	/nfs/dbraw/zinc/48/98/32/444489832.db2.gz	CMVFCUNPDACDGS-UHFFFAOYSA-N	-1	3	338.183	1.966	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCCN(C)[C@H]2C)cc1C	ZINC000343975633	444704903	/nfs/dbraw/zinc/70/49/03/444704903.db2.gz	IVNXAQOOGYYEPZ-QWHCGFSZSA-N	-1	3	341.433	1.973	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCCN(C)[C@H]2C)c1C	ZINC000343982743	444708579	/nfs/dbraw/zinc/70/85/79/444708579.db2.gz	OVFVWPFTNWQJEM-STQMWFEESA-N	-1	3	341.433	1.973	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@]1(C)CCO[C@H]1C	ZINC000344124455	444794096	/nfs/dbraw/zinc/79/40/96/444794096.db2.gz	WXKJGMHCXVWQEE-TVQRCGJNSA-N	-1	3	330.362	1.449	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1CCOCC1	ZINC000330697659	445101248	/nfs/dbraw/zinc/10/12/48/445101248.db2.gz	VSUZBCQXLAFWGV-UHFFFAOYSA-N	-1	3	330.362	1.308	20	5		EDBDHM
CC[C@@H](C)[C@H](C)NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000343487330	445232525	/nfs/dbraw/zinc/23/25/25/445232525.db2.gz	CEXXANCHATWELC-MNOVXSKESA-N	-1	3	343.405	1.424	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CCN3CCCC[C@@H]23)cc1[N+](=O)[O-]	ZINC000343528588	445239153	/nfs/dbraw/zinc/23/91/53/445239153.db2.gz	ALUGBYLIMDEBFQ-QWRGUYRKSA-N	-1	3	345.446	1.870	20	5		EDBDHM
Cc1ncc(CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c(=O)[n-]1	ZINC000343591457	445254363	/nfs/dbraw/zinc/25/43/63/445254363.db2.gz	JIYWOGJARYOPER-UHFFFAOYSA-N	-1	3	338.345	1.414	20	5		EDBDHM
COc1c(C(=O)Nc2cc(-c3nccn3C)[n-]n2)cccc1[N+](=O)[O-]	ZINC000359737883	445399942	/nfs/dbraw/zinc/39/99/42/445399942.db2.gz	VVBCSKCFYZFDQP-UHFFFAOYSA-N	-1	3	342.315	1.979	20	5		EDBDHM
COc1c(C(=O)Nc2cc(-c3nccn3C)n[n-]2)cccc1[N+](=O)[O-]	ZINC000359737883	445399946	/nfs/dbraw/zinc/39/99/46/445399946.db2.gz	VVBCSKCFYZFDQP-UHFFFAOYSA-N	-1	3	342.315	1.979	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)c1ncc(C)o1	ZINC000352084112	445481601	/nfs/dbraw/zinc/48/16/01/445481601.db2.gz	SUHVFAOKHIUDCD-SECBINFHSA-N	-1	3	341.345	1.939	20	5		EDBDHM
Cn1c2cc([O-])c(NC(=O)c3ccc([N+](=O)[O-])s3)cc2n(C)c1=O	ZINC000359819359	445444269	/nfs/dbraw/zinc/44/42/69/445444269.db2.gz	HZDPOKZZXRIKLF-UHFFFAOYSA-N	-1	3	348.340	1.805	20	5		EDBDHM
O=C(Nc1ccn(-c2ncccc2F)n1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000369327211	446075798	/nfs/dbraw/zinc/07/57/98/446075798.db2.gz	PKLNUSSBAYQVPQ-UHFFFAOYSA-N	-1	3	344.262	1.668	20	5		EDBDHM
CCCn1c(=O)[n-]nc1S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000453012632	446537850	/nfs/dbraw/zinc/53/78/50/446537850.db2.gz	DJFMHSXMDOKDBK-UHFFFAOYSA-N	-1	3	326.334	1.276	20	5		EDBDHM
CN1CCC[C@H](N2CCN(C(=O)c3cc([O-])ccc3[N+](=O)[O-])CC2)C1	ZINC000375758533	447026642	/nfs/dbraw/zinc/02/66/42/447026642.db2.gz	OVZUPRDIHPMROB-ZDUSSCGKSA-N	-1	3	348.403	1.152	20	5		EDBDHM
CN1CCc2ccc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)cc2C1=O	ZINC000444971039	447151151	/nfs/dbraw/zinc/15/11/51/447151151.db2.gz	ZZHDGPHBYDWTRQ-UHFFFAOYSA-N	-1	3	342.311	1.576	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2cc(OC(F)F)n(C)n2)n1	ZINC000427335549	447583494	/nfs/dbraw/zinc/58/34/94/447583494.db2.gz	BHMBMVOJNBMCAL-UHFFFAOYSA-N	-1	3	330.251	1.398	20	5		EDBDHM
Cn1c2cc([O-])c(NC(=O)c3cc([N+](=O)[O-])c[nH]3)cc2n(C)c1=O	ZINC000427871871	447666099	/nfs/dbraw/zinc/66/60/99/447666099.db2.gz	BLQASTSPWHKABK-UHFFFAOYSA-N	-1	3	331.288	1.071	20	5		EDBDHM
C[C@@H]1CCCN(CC[N-]S(=O)(=O)c2cccnc2[N+](=O)[O-])C1	ZINC000524648887	447937445	/nfs/dbraw/zinc/93/74/45/447937445.db2.gz	MIOAYPPGEPRDEL-LLVKDONJSA-N	-1	3	328.394	1.000	20	5		EDBDHM
CN(CC[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-])C1CCCC1	ZINC000525688393	448012300	/nfs/dbraw/zinc/01/23/00/448012300.db2.gz	BMFCVRROKALWJL-UHFFFAOYSA-N	-1	3	328.394	1.143	20	5		EDBDHM
O=C(C=Cc1ccc(F)cc1[N+](=O)[O-])N1CCc2c(=O)[n-]cnc2C1	ZINC000493002086	448344650	/nfs/dbraw/zinc/34/46/50/448344650.db2.gz	DMPNLYSCZGQJIR-DUXPYHPUSA-N	-1	3	344.302	1.828	20	5		EDBDHM
CCC1(CC)[C@H](OC)C[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593566861	449075914	/nfs/dbraw/zinc/07/59/14/449075914.db2.gz	PFHCSCBZWQSFAC-NWDGAFQWSA-N	-1	3	343.405	1.862	20	5		EDBDHM
CN1CCCC(C)(C)[C@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593585738	449091619	/nfs/dbraw/zinc/09/16/19/449091619.db2.gz	ISXBRLXKARKVJN-GFCCVEGCSA-N	-1	3	342.421	1.389	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]([C@@H](CO)C2CC2)C2CC2)nc1	ZINC000593601858	449101250	/nfs/dbraw/zinc/10/12/50/449101250.db2.gz	QWFMPVNPWKKFRB-JSGCOSHPSA-N	-1	3	341.389	1.065	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC2(CF)CCOCC2)nc1	ZINC000593601207	449101534	/nfs/dbraw/zinc/10/15/34/449101534.db2.gz	LYVYSVJLXOZXKA-UHFFFAOYSA-N	-1	3	333.341	1.034	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCCCc2cc(=O)[nH][n-]2)c1	ZINC000590549740	449184827	/nfs/dbraw/zinc/18/48/27/449184827.db2.gz	IIRNVMHAPXSMBK-UHFFFAOYSA-N	-1	3	348.359	1.444	20	5		EDBDHM
CSc1ccc(C(=O)NCCCc2cc(=O)[nH][n-]2)cc1[N+](=O)[O-]	ZINC000590550255	449184996	/nfs/dbraw/zinc/18/49/96/449184996.db2.gz	PJKIQAVEDULFNV-UHFFFAOYSA-N	-1	3	336.373	1.703	20	5		EDBDHM
CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000590562465	449191282	/nfs/dbraw/zinc/19/12/82/449191282.db2.gz	LOUJTYYNNGHOPK-GXTWGEPZSA-N	-1	3	335.360	1.236	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CC[C@@H](CO)CC1	ZINC000611157928	449191335	/nfs/dbraw/zinc/19/13/35/449191335.db2.gz	XEPUWFFKLOVQTM-PHIMTYICSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CCCn1cc(C(=O)[N-]c2cc(C(=O)OC)cc([N+](=O)[O-])c2)nn1	ZINC000611228830	449227689	/nfs/dbraw/zinc/22/76/89/449227689.db2.gz	NDNPQOWHYGQULQ-UHFFFAOYSA-N	-1	3	333.304	1.635	20	5		EDBDHM
CCOc1ccc([N+](=O)[O-])cc1CN1C[C@@H]2COC[C@]2(C(=O)[O-])C1	ZINC000595884673	449231460	/nfs/dbraw/zinc/23/14/60/449231460.db2.gz	JUMYNGJPJHAONR-MLGOLLRUSA-N	-1	3	336.344	1.527	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H](CO)C2CCCCC2)nc1	ZINC000593556127	449346858	/nfs/dbraw/zinc/34/68/58/449346858.db2.gz	JQLRCPHVYXEGLI-GFCCVEGCSA-N	-1	3	329.378	1.209	20	5		EDBDHM
CC(C)(C)OC(=O)Cn1cc(Nc2cc[n-]c(=O)c2[N+](=O)[O-])cn1	ZINC000596286280	449456802	/nfs/dbraw/zinc/45/68/02/449456802.db2.gz	SADSPHHTNDQQQF-UHFFFAOYSA-N	-1	3	335.320	1.977	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2c2ncnc3ccc([N+](=O)[O-])cc32)nc1=N	ZINC000596253157	449440732	/nfs/dbraw/zinc/44/07/32/449440732.db2.gz	YAFGZYCHTAWEQB-LBPRGKRZSA-N	-1	3	340.347	1.421	20	5		EDBDHM
C[C@@H](CO)C[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594762234	449675386	/nfs/dbraw/zinc/67/53/86/449675386.db2.gz	MCHIGCGDJWXBIK-SECBINFHSA-N	-1	3	325.346	1.050	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1C[C@H](O)C12CCC2	ZINC000594864907	449777828	/nfs/dbraw/zinc/77/78/28/449777828.db2.gz	PVXPMKXAOIYDBD-NEPJUHHUSA-N	-1	3	342.373	1.185	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2C[C@H](O)C23CCC3)cc1C	ZINC000594866971	449782678	/nfs/dbraw/zinc/78/26/78/449782678.db2.gz	ZYXTUDQDMZJTMY-KBPBESRZSA-N	-1	3	340.401	1.793	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCO[C@H]2CC2(F)F)c(F)c1	ZINC000594838870	449746341	/nfs/dbraw/zinc/74/63/41/449746341.db2.gz	DIQUUYJUJKLUSU-JTQLQIEISA-N	-1	3	340.279	1.436	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@]1(C)CC1(F)F	ZINC000594851763	449760191	/nfs/dbraw/zinc/76/01/91/449760191.db2.gz	LSQYKAFIXQVMSI-NSHDSACASA-N	-1	3	336.316	1.927	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H](CO)CC2CC2)c([N+](=O)[O-])c1	ZINC000594862348	449772663	/nfs/dbraw/zinc/77/26/63/449772663.db2.gz	APTXBSWKOKKYFV-NSHDSACASA-N	-1	3	344.389	1.290	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@H](C)N2CCCC2)c([N+](=O)[O-])s1	ZINC000601303161	449813548	/nfs/dbraw/zinc/81/35/48/449813548.db2.gz	CFFRLBHJINIDPN-VIFPVBQESA-N	-1	3	333.435	1.727	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@H]2CCN(C3CC3)C2)c([N+](=O)[O-])s1	ZINC000601305452	449815530	/nfs/dbraw/zinc/81/55/30/449815530.db2.gz	YGTFWYROHQHRME-SNVBAGLBSA-N	-1	3	345.446	1.727	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](CO)CCC(C)C	ZINC000599408822	449953264	/nfs/dbraw/zinc/95/32/64/449953264.db2.gz	BGVHBHCAYRKJCD-LLVKDONJSA-N	-1	3	346.405	1.679	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C(C)(C)CN(C)C)c(F)cc1[N+](=O)[O-]	ZINC000601435427	449957551	/nfs/dbraw/zinc/95/75/51/449957551.db2.gz	QQXJFYWBZSIQDR-UHFFFAOYSA-N	-1	3	333.385	1.661	20	5		EDBDHM
CSCC[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000609121077	449961172	/nfs/dbraw/zinc/96/11/72/449961172.db2.gz	SZPPCJCMKLDXFK-UHFFFAOYSA-N	-1	3	334.375	1.007	20	5		EDBDHM
CCCN1CC[C@H]([N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000595354961	450070746	/nfs/dbraw/zinc/07/07/46/450070746.db2.gz	PTHQIJPOZDXNRB-NSHDSACASA-N	-1	3	343.405	1.366	20	5		EDBDHM
CC1([N-]S(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])COC1	ZINC000601504233	450026491	/nfs/dbraw/zinc/02/64/91/450026491.db2.gz	AQLXNWLXUKEEPD-UHFFFAOYSA-N	-1	3	340.279	1.681	20	5		EDBDHM
C[C@@H](C(=O)NCCCc1cc(=O)[nH][n-]1)c1ccc([N+](=O)[O-])cc1F	ZINC000597665548	450181378	/nfs/dbraw/zinc/18/13/78/450181378.db2.gz	QJJGALWXKYUIDO-SECBINFHSA-N	-1	3	336.323	1.610	20	5		EDBDHM
CCN(C)C(=O)[C@@H](C)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000190187755	527753581	/nfs/dbraw/zinc/75/35/81/527753581.db2.gz	XAQPGEGRCMONPW-LLVKDONJSA-N	-1	3	343.405	1.357	20	5		EDBDHM
CO[C@@H]1[C@H](C)[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1(C)C	ZINC000332447376	536815242	/nfs/dbraw/zinc/81/52/42/536815242.db2.gz	LLVZLCKZMBZRGV-JIMOISOXSA-N	-1	3	328.390	1.933	20	5		EDBDHM
CNC(=O)COc1cccc(CNCc2cc([N+](=O)[O-])ccc2[O-])c1	ZINC000725846570	578288659	/nfs/dbraw/zinc/28/86/59/578288659.db2.gz	IBKZUFYZQMSENY-UHFFFAOYSA-N	-1	3	345.355	1.715	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1cncc([O-])c1	ZINC000731915541	578683095	/nfs/dbraw/zinc/68/30/95/578683095.db2.gz	ZYFGLGDEEVSEDO-UHFFFAOYSA-N	-1	3	347.283	1.500	20	5		EDBDHM
CC1(C)CN(CCNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CCO1	ZINC000736215006	578965476	/nfs/dbraw/zinc/96/54/76/578965476.db2.gz	ZKZXZTYQNJFWRV-UHFFFAOYSA-N	-1	3	347.379	1.298	20	5		EDBDHM
CC1(C)CN(CCNc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CCO1	ZINC000736215006	578965477	/nfs/dbraw/zinc/96/54/77/578965477.db2.gz	ZKZXZTYQNJFWRV-UHFFFAOYSA-N	-1	3	347.379	1.298	20	5		EDBDHM
Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccncc1-c1nnn[n-]1	ZINC000737283335	579065627	/nfs/dbraw/zinc/06/56/27/579065627.db2.gz	QQVWHJPBARUMHS-UHFFFAOYSA-N	-1	3	325.288	1.153	20	5		EDBDHM
Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccncc1-c1nn[n-]n1	ZINC000737283335	579065628	/nfs/dbraw/zinc/06/56/28/579065628.db2.gz	QQVWHJPBARUMHS-UHFFFAOYSA-N	-1	3	325.288	1.153	20	5		EDBDHM
CN(C)C[C@@H]1CN(c2ccc(/C=C\C(=O)[O-])cc2[N+](=O)[O-])CCO1	ZINC000737364256	579079146	/nfs/dbraw/zinc/07/91/46/579079146.db2.gz	AJSORONVOZOMPY-RYWCDNDXSA-N	-1	3	335.360	1.459	20	5		EDBDHM
CN1CCC[C@H]1[C@H]1CCCN1C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000737519132	579103668	/nfs/dbraw/zinc/10/36/68/579103668.db2.gz	GZIMIYOPWJJUDD-LSDHHAIUSA-N	-1	3	347.371	1.992	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@@H](C)OC(=O)CCn2cc([N+](=O)[O-])cn2)on1	ZINC000746596960	579602355	/nfs/dbraw/zinc/60/23/55/579602355.db2.gz	VOKVIOXNSPSKNC-SECBINFHSA-N	-1	3	337.292	1.048	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]C[C@@H](O)c1ccco1	ZINC000751205010	579797204	/nfs/dbraw/zinc/79/72/04/579797204.db2.gz	LGRJSQNRDDNKEN-SNVBAGLBSA-N	-1	3	346.748	1.853	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)n[nH]1	ZINC000758467024	579983212	/nfs/dbraw/zinc/98/32/12/579983212.db2.gz	FIJIBFBQYMTKJD-UHFFFAOYSA-N	-1	3	338.389	1.976	20	5		EDBDHM
Cc1nc(C)c(S(=O)(=O)[N-]N=c2[nH]cccc2[N+](=O)[O-])s1	ZINC000759169056	580000138	/nfs/dbraw/zinc/00/01/38/580000138.db2.gz	XIDMJOISRZRWSI-UHFFFAOYSA-N	-1	3	329.363	1.369	20	5		EDBDHM
Cc1nc(C)c(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])s1	ZINC000759169056	580000139	/nfs/dbraw/zinc/00/01/39/580000139.db2.gz	XIDMJOISRZRWSI-UHFFFAOYSA-N	-1	3	329.363	1.369	20	5		EDBDHM
COC(=O)c1ccc(OS(=O)(=O)c2cn[n-]c2C)cc1[N+](=O)[O-]	ZINC000763610865	580102532	/nfs/dbraw/zinc/10/25/32/580102532.db2.gz	JNWGDRGXSLALHU-UHFFFAOYSA-N	-1	3	341.301	1.181	20	5		EDBDHM
COc1ccc(C(=O)[N-]N2CCc3ccccc3C2=O)cc1[N+](=O)[O-]	ZINC000770551650	580264263	/nfs/dbraw/zinc/26/42/63/580264263.db2.gz	YFNKNWKVEPUZCA-UHFFFAOYSA-N	-1	3	341.323	1.947	20	5		EDBDHM
CCN(CC)C(=O)C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000790833879	580779704	/nfs/dbraw/zinc/77/97/04/580779704.db2.gz	KJPOUJZWLHTJHO-UHFFFAOYSA-N	-1	3	343.405	1.358	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]Cc2cccnc2F)c([N+](=O)[O-])c1	ZINC000795265440	580917061	/nfs/dbraw/zinc/91/70/61/580917061.db2.gz	MPSYZKOFTZERJW-UHFFFAOYSA-N	-1	3	341.320	1.616	20	5		EDBDHM
COc1c([O-])ccc(CN2CC[C@H]3CC[C@@H](C2)[S@@]3=O)c1[N+](=O)[O-]	ZINC000895627942	591235304	/nfs/dbraw/zinc/23/53/04/591235304.db2.gz	IXGYDCMOTMBXDL-YCDSQXFLSA-N	-1	3	340.401	1.794	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2COC[C@@H]2C2CC2)cc1C	ZINC000908411510	592485505	/nfs/dbraw/zinc/48/55/05/592485505.db2.gz	NPKBTCODHRKKQL-OLZOCXBDSA-N	-1	3	340.401	1.915	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@@H]2CC[C@@H](C3CC3)O2)cs1	ZINC000907468129	592650631	/nfs/dbraw/zinc/65/06/31/592650631.db2.gz	CWZBABQWLLTJNR-ONGXEEELSA-N	-1	3	332.403	1.892	20	5		EDBDHM
C[C@H]1CN(C2CC2)C[C@@H]1[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768847128	593442316	/nfs/dbraw/zinc/44/23/16/593442316.db2.gz	CUWWPIBSXZPDJB-KWQFWETISA-N	-1	3	331.419	1.417	20	5		EDBDHM
C[C@@H](NC(=O)c1cc([N+](=O)[O-])cn1C)c1cccc(-c2nnn[n-]2)c1	ZINC000820390217	593815512	/nfs/dbraw/zinc/81/55/12/593815512.db2.gz	GGLDOKJHTWAWKM-SECBINFHSA-N	-1	3	341.331	1.604	20	5		EDBDHM
C[C@@H](NC(=O)c1cc([N+](=O)[O-])cn1C)c1cccc(-c2nn[n-]n2)c1	ZINC000820390217	593815513	/nfs/dbraw/zinc/81/55/13/593815513.db2.gz	GGLDOKJHTWAWKM-SECBINFHSA-N	-1	3	341.331	1.604	20	5		EDBDHM
CCc1ccc(C(=O)Nc2ccncc2-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000821476955	593843401	/nfs/dbraw/zinc/84/34/01/593843401.db2.gz	WMUCJZULYZFUCQ-UHFFFAOYSA-N	-1	3	339.315	1.407	20	5		EDBDHM
CCc1ccc(C(=O)Nc2ccncc2-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000821476955	593843404	/nfs/dbraw/zinc/84/34/04/593843404.db2.gz	WMUCJZULYZFUCQ-UHFFFAOYSA-N	-1	3	339.315	1.407	20	5		EDBDHM
CN(c1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1)[C@@H]1CCOC1	ZINC000821619418	593883347	/nfs/dbraw/zinc/88/33/47/593883347.db2.gz	WKDHGFFDWYONSA-SNVBAGLBSA-N	-1	3	341.331	1.548	20	5		EDBDHM
CN(c1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1)[C@@H]1CCOC1	ZINC000821619418	593883349	/nfs/dbraw/zinc/88/33/49/593883349.db2.gz	WKDHGFFDWYONSA-SNVBAGLBSA-N	-1	3	341.331	1.548	20	5		EDBDHM
CC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)[C@H](C)C1	ZINC000823974486	593899052	/nfs/dbraw/zinc/89/90/52/593899052.db2.gz	PMZCJWHEHRYXBM-RNCFNFMXSA-N	-1	3	345.363	1.444	20	5		EDBDHM
CC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)[C@H](C)C1	ZINC000823974486	593899053	/nfs/dbraw/zinc/89/90/53/593899053.db2.gz	PMZCJWHEHRYXBM-RNCFNFMXSA-N	-1	3	345.363	1.444	20	5		EDBDHM
COc1ccc([N+](=O)[O-])c(C(=O)OC[C@@H]2CCCN2CC(=O)[O-])c1	ZINC000820853035	593905894	/nfs/dbraw/zinc/90/58/94/593905894.db2.gz	AMQLCFOZKPZEHL-JTQLQIEISA-N	-1	3	338.316	1.309	20	5		EDBDHM
CC(C)[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CCO1	ZINC000824215253	593958579	/nfs/dbraw/zinc/95/85/79/593958579.db2.gz	JSYMGJPJQVJBCN-CABZTGNLSA-N	-1	3	333.352	1.785	20	5		EDBDHM
CC(C)[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CCO1	ZINC000824215253	593958580	/nfs/dbraw/zinc/95/85/80/593958580.db2.gz	JSYMGJPJQVJBCN-CABZTGNLSA-N	-1	3	333.352	1.785	20	5		EDBDHM
Cc1cc(C)c(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)c(=O)[nH]1	ZINC000822194135	594006822	/nfs/dbraw/zinc/00/68/22/594006822.db2.gz	KMFATRXJFZLJQA-UHFFFAOYSA-N	-1	3	342.319	1.499	20	5		EDBDHM
Cc1cc(C)c(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)c(=O)[nH]1	ZINC000822194135	594006824	/nfs/dbraw/zinc/00/68/24/594006824.db2.gz	KMFATRXJFZLJQA-UHFFFAOYSA-N	-1	3	342.319	1.499	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(Cc2cc(F)ccc2-c2nnn[n-]2)c1=O	ZINC000822213140	594011903	/nfs/dbraw/zinc/01/19/03/594011903.db2.gz	WJHAJTAERQEIJP-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cn(Cc2cc(F)ccc2-c2nn[n-]n2)c1=O	ZINC000822213140	594011907	/nfs/dbraw/zinc/01/19/07/594011907.db2.gz	WJHAJTAERQEIJP-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
C[C@H](NC(=O)c1ccc(-c2nnn[n-]2)cn1)c1ccccc1[N+](=O)[O-]	ZINC000824515005	594029074	/nfs/dbraw/zinc/02/90/74/594029074.db2.gz	RHWWFCUOJIJZMZ-VIFPVBQESA-N	-1	3	339.315	1.661	20	5		EDBDHM
C[C@H](NC(=O)c1ccc(-c2nn[n-]n2)cn1)c1ccccc1[N+](=O)[O-]	ZINC000824515005	594029075	/nfs/dbraw/zinc/02/90/75/594029075.db2.gz	RHWWFCUOJIJZMZ-VIFPVBQESA-N	-1	3	339.315	1.661	20	5		EDBDHM
NC(=O)[C@@H]1CCCCC[C@@H]1Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000822860409	594112335	/nfs/dbraw/zinc/11/23/35/594112335.db2.gz	UGXRQDFXTJBQOJ-MNOVXSKESA-N	-1	3	345.363	1.621	20	5		EDBDHM
NC(=O)[C@@H]1CCCCC[C@@H]1Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000822860409	594112336	/nfs/dbraw/zinc/11/23/36/594112336.db2.gz	UGXRQDFXTJBQOJ-MNOVXSKESA-N	-1	3	345.363	1.621	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOc2ccc(-c3nnn[n-]3)cc2)nc1	ZINC000823639644	594223944	/nfs/dbraw/zinc/22/39/44/594223944.db2.gz	FERCTRBICOFTAG-UHFFFAOYSA-N	-1	3	327.304	1.661	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOc2ccc(-c3nn[n-]n3)cc2)nc1	ZINC000823639644	594223945	/nfs/dbraw/zinc/22/39/45/594223945.db2.gz	FERCTRBICOFTAG-UHFFFAOYSA-N	-1	3	327.304	1.661	20	5		EDBDHM
O=[N+]([O-])c1cn(Cc2ccc(-c3nnn[n-]3)cc2OC(F)F)cn1	ZINC000823647130	594224444	/nfs/dbraw/zinc/22/44/44/594224444.db2.gz	GSOQCUJXELTAIX-UHFFFAOYSA-N	-1	3	337.246	1.621	20	5		EDBDHM
O=[N+]([O-])c1cn(Cc2ccc(-c3nn[n-]n3)cc2OC(F)F)cn1	ZINC000823647130	594224445	/nfs/dbraw/zinc/22/44/45/594224445.db2.gz	GSOQCUJXELTAIX-UHFFFAOYSA-N	-1	3	337.246	1.621	20	5		EDBDHM
CN(C[C@H](O)C(F)(F)F)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825902003	594273584	/nfs/dbraw/zinc/27/35/84/594273584.db2.gz	NJWXTCFOTOAUEN-VIFPVBQESA-N	-1	3	332.242	1.134	20	5		EDBDHM
CN(C[C@H](O)C(F)(F)F)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825902003	594273586	/nfs/dbraw/zinc/27/35/86/594273586.db2.gz	NJWXTCFOTOAUEN-VIFPVBQESA-N	-1	3	332.242	1.134	20	5		EDBDHM
COc1ccc(NC(=O)CNC(C)(C)CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000832393653	594747086	/nfs/dbraw/zinc/74/70/86/594747086.db2.gz	FAFMPXGVVGRLGS-UHFFFAOYSA-N	-1	3	325.321	1.385	20	5		EDBDHM
O=C([O-])NC[C@H]1CCCN1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000832572893	594760405	/nfs/dbraw/zinc/76/04/05/594760405.db2.gz	JAJKJPUVTNRHPR-OLZOCXBDSA-N	-1	3	339.348	1.067	20	5		EDBDHM
CC(C)[C@@H](CO)O[N-]C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000836895047	595010668	/nfs/dbraw/zinc/01/06/68/595010668.db2.gz	BAOZUUOTLQFBLK-GFCCVEGCSA-N	-1	3	326.305	1.044	20	5		EDBDHM
COC[C@]1(C(=O)[O-])CCCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000846287387	595198778	/nfs/dbraw/zinc/19/87/78/595198778.db2.gz	XRTAGHNSQMALFK-ZBFHGGJFSA-N	-1	3	338.360	1.441	20	5		EDBDHM
CCON(C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(C)C	ZINC000844074200	595267589	/nfs/dbraw/zinc/26/75/89/595267589.db2.gz	OBLOWUMXXGFCEZ-UHFFFAOYSA-N	-1	3	345.377	1.062	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H]2CCN(C)C2)cc1F	ZINC000867374683	595410325	/nfs/dbraw/zinc/41/03/25/595410325.db2.gz	KLUDOOYHZGJOSQ-SNVBAGLBSA-N	-1	3	331.369	1.272	20	5		EDBDHM
COCC(COC)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848591375	595412042	/nfs/dbraw/zinc/41/20/42/595412042.db2.gz	LGHGFLZKUHIWRW-UHFFFAOYSA-N	-1	3	334.275	1.344	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC)C(OC)OC	ZINC000849405211	595521337	/nfs/dbraw/zinc/52/13/37/595521337.db2.gz	GBBLWEDNOWKQDN-SECBINFHSA-N	-1	3	348.377	1.279	20	5		EDBDHM
O=C([N-]OCCN1CCCC1=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000856045263	595885191	/nfs/dbraw/zinc/88/51/91/595885191.db2.gz	POKKASXZELSYNE-UONOGXRCSA-N	-1	3	333.344	1.369	20	5		EDBDHM
CCOC(=O)C1=CC[C@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000859317131	596047989	/nfs/dbraw/zinc/04/79/89/596047989.db2.gz	KUYGSAPXEOLVHA-VIFPVBQESA-N	-1	3	346.386	1.587	20	5		EDBDHM
Cc1cc(=O)[n-]c(C(C)(C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000852144833	596060974	/nfs/dbraw/zinc/06/09/74/596060974.db2.gz	CXPXHFXORPKDHQ-ZDUSSCGKSA-N	-1	3	332.360	1.957	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]CCN2CCCCCC2)cs1	ZINC000119499279	596605612	/nfs/dbraw/zinc/60/56/12/596605612.db2.gz	ZWGBCMZUCXGPJJ-UHFFFAOYSA-N	-1	3	333.435	1.811	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@]23CCC[C@H]2OCC3)c(F)c1	ZINC000921586438	703629020	/nfs/dbraw/zinc/62/90/20/703629020.db2.gz	ANBAQVZVWHRGQT-ZIAGYGMSSA-N	-1	3	344.364	1.971	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]CCC1CC(O)C1	ZINC000432295326	305090676	/nfs/dbraw/zinc/09/06/76/305090676.db2.gz	WEDQDQVAIAYMBV-UHFFFAOYSA-N	-1	3	334.781	1.688	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCNCc1ccccn1	ZINC000007093236	138094850	/nfs/dbraw/zinc/09/48/50/138094850.db2.gz	FWHQWRBSYHRFIA-UHFFFAOYSA-N	-1	3	336.373	1.058	20	5		EDBDHM
CN(C)[C@H](CNC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)c1ccc(F)cc1	ZINC000186980327	236085170	/nfs/dbraw/zinc/08/51/70/236085170.db2.gz	MNGMFDLGUUMJSQ-CQSZACIVSA-N	-1	3	348.334	1.867	20	5		EDBDHM
COC[C@]1(C(=O)[O-])CCCN(CCOc2ccccc2[N+](=O)[O-])C1	ZINC000565781049	306391502	/nfs/dbraw/zinc/39/15/02/306391502.db2.gz	XTVZAXDTPAWPJD-INIZCTEOSA-N	-1	3	338.360	1.787	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCCn2cccn2)c(F)c1	ZINC000055236502	202685248	/nfs/dbraw/zinc/68/52/48/202685248.db2.gz	VRVDTDWNFRORFX-UHFFFAOYSA-N	-1	3	328.325	1.299	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CCCC(=O)NC2CC2)c([N+](=O)[O-])c1	ZINC000101572114	204012199	/nfs/dbraw/zinc/01/21/99/204012199.db2.gz	JBBFBRNEFDLTQV-UHFFFAOYSA-N	-1	3	341.389	1.240	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCn1cccc1	ZINC000487110627	255026364	/nfs/dbraw/zinc/02/63/64/255026364.db2.gz	BGCFKDBJNBNVIS-UHFFFAOYSA-N	-1	3	325.346	1.383	20	5		EDBDHM
Cn1[n-]c([C@H]2CCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)nc1=N	ZINC000493314988	255203436	/nfs/dbraw/zinc/20/34/36/255203436.db2.gz	FAGDUIRZTGWAFL-YSKGHYERSA-N	-1	3	342.359	1.513	20	5		EDBDHM
CCOC(=O)[C@@H](C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000269288349	139909526	/nfs/dbraw/zinc/90/95/26/139909526.db2.gz	NICYXSUZLAJADM-QMMMGPOBSA-N	-1	3	334.325	1.211	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](CCO)C(C)C)c([N+](=O)[O-])c1	ZINC000269860775	140007920	/nfs/dbraw/zinc/00/79/20/140007920.db2.gz	RZHXNVFGXNMDIW-NSHDSACASA-N	-1	3	332.378	1.289	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C(C)(C)C(C)(C)O)c([N+](=O)[O-])c1	ZINC000271303923	140274559	/nfs/dbraw/zinc/27/45/59/140274559.db2.gz	GDTBJQGHDFDYCM-UHFFFAOYSA-N	-1	3	332.378	1.431	20	5		EDBDHM
CCC1([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)CCOCC1	ZINC000330517568	140867119	/nfs/dbraw/zinc/86/71/19/140867119.db2.gz	FONPHTRSUIVXFX-UHFFFAOYSA-N	-1	3	344.389	1.841	20	5		EDBDHM
CO[C@]1(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)CCOC1	ZINC000342488945	142726176	/nfs/dbraw/zinc/72/61/76/142726176.db2.gz	LQNKORYKRXXHCY-NSHDSACASA-N	-1	3	336.391	1.049	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H](C)CN2CCCC2=O)cc1[N+](=O)[O-]	ZINC000343438651	142845007	/nfs/dbraw/zinc/84/50/07/142845007.db2.gz	FZAPJCLBFSGOLJ-MRVPVSSYSA-N	-1	3	347.418	1.254	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](CO)C(C)C)cc1C	ZINC000344821000	143015977	/nfs/dbraw/zinc/01/59/77/143015977.db2.gz	FPLNVWXXCDPUQR-GFCCVEGCSA-N	-1	3	330.406	1.754	20	5		EDBDHM
COC(=O)c1cc([N-]C(=O)c2cnc3n[nH]nc3c2)cc([N+](=O)[O-])c1	ZINC000349111402	143480014	/nfs/dbraw/zinc/48/00/14/143480014.db2.gz	SBJGAGHIYFQNSZ-UHFFFAOYSA-N	-1	3	342.271	1.300	20	5		EDBDHM
O=c1cc(Cn2cc(Br)c(=O)c([N+](=O)[O-])c2)occ1[O-]	ZINC000357385565	151014720	/nfs/dbraw/zinc/01/47/20/151014720.db2.gz	TXOJVRUPVDKBOI-UHFFFAOYSA-N	-1	3	343.089	1.226	20	5		EDBDHM
COCCC1([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)CCC1	ZINC000360352167	152003837	/nfs/dbraw/zinc/00/38/37/152003837.db2.gz	KZSIHTJQUPTAHO-UHFFFAOYSA-N	-1	3	344.389	1.841	20	5		EDBDHM
Cc1nc([C@H]2CCCCN2C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)n[nH]1	ZINC000367297593	154069815	/nfs/dbraw/zinc/06/98/15/154069815.db2.gz	CUYWFWUVSGXBHW-SNVBAGLBSA-N	-1	3	332.320	1.489	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCO[C@H]1C1CC1	ZINC000372257902	156290419	/nfs/dbraw/zinc/29/04/19/156290419.db2.gz	HQULLWHYQVFGEE-FZMZJTMJSA-N	-1	3	342.373	1.449	20	5		EDBDHM
CN1CCN(CCCCNC(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC1	ZINC000063739744	287238982	/nfs/dbraw/zinc/23/89/82/287238982.db2.gz	QQOBZEJCBCRJAY-UHFFFAOYSA-N	-1	3	336.392	1.058	20	5		EDBDHM
CC[C@@H](C)[C@@](C)(O)C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000119230202	287350847	/nfs/dbraw/zinc/35/08/47/287350847.db2.gz	XCZZUNIWWUUHBC-RISCZKNCSA-N	-1	3	330.406	1.979	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCN2CCCCC2)cc1[N+](=O)[O-]	ZINC000123175678	222229246	/nfs/dbraw/zinc/22/92/46/222229246.db2.gz	VWEOGMKGDUCKFP-UHFFFAOYSA-N	-1	3	333.435	1.729	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C2(C(N)=O)CCCCC2)cc1[N+](=O)[O-]	ZINC000123353764	222262402	/nfs/dbraw/zinc/26/24/02/222262402.db2.gz	CCTPJJACDSJWFM-UHFFFAOYSA-N	-1	3	347.418	1.431	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])N1CCCCC1=O	ZINC000194597431	273003895	/nfs/dbraw/zinc/00/38/95/273003895.db2.gz	QTNRORVNPSPQEX-LLVKDONJSA-N	-1	3	341.389	1.274	20	5		EDBDHM
O=C(Nc1ccccc1[O-])C1CCN(c2ncc([N+](=O)[O-])cn2)CC1	ZINC000273621542	268066472	/nfs/dbraw/zinc/06/64/72/268066472.db2.gz	ORRKNZKLJNAKQT-UHFFFAOYSA-N	-1	3	343.343	1.946	20	5		EDBDHM
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000274885934	268230421	/nfs/dbraw/zinc/23/04/21/268230421.db2.gz	KFPOQIDCHCXYSJ-CQSZACIVSA-N	-1	3	342.355	1.700	20	5		EDBDHM
CCOCCC[N-]S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	ZINC000275192019	268294301	/nfs/dbraw/zinc/29/43/01/268294301.db2.gz	MNYNXKDYFDLMNA-UHFFFAOYSA-N	-1	3	336.341	1.447	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]Cc1nncn1C1CC1	ZINC000281305864	273459345	/nfs/dbraw/zinc/45/93/45/273459345.db2.gz	ZNSWDSDWNWFHTE-UHFFFAOYSA-N	-1	3	337.361	1.141	20	5		EDBDHM
CC(C)c1n[nH]c(C(=O)N2CCc3nc[n-]c(=O)c3C2)c1[N+](=O)[O-]	ZINC000356997801	276041174	/nfs/dbraw/zinc/04/11/74/276041174.db2.gz	NQDJWAFIOUSYPW-UHFFFAOYSA-N	-1	3	332.320	1.135	20	5		EDBDHM
CC(C)c1[nH]nc(C(=O)N2CCc3nc[n-]c(=O)c3C2)c1[N+](=O)[O-]	ZINC000356997801	276041177	/nfs/dbraw/zinc/04/11/77/276041177.db2.gz	NQDJWAFIOUSYPW-UHFFFAOYSA-N	-1	3	332.320	1.135	20	5		EDBDHM
Cc1cnc(N2CCC[C@@H]2C[C@]2(C)NC(=O)[N-]C2=O)c([N+](=O)[O-])c1	ZINC000286419158	288001022	/nfs/dbraw/zinc/00/10/22/288001022.db2.gz	PRSOWZRCZRZNBU-BMIGLBTASA-N	-1	3	333.348	1.255	20	5		EDBDHM
CC1(C)CC[C@@H]1NC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000287176085	288172804	/nfs/dbraw/zinc/17/28/04/288172804.db2.gz	OJZLLQVNIZZXQU-LBPRGKRZSA-N	-1	3	341.389	1.178	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@]2(C)CCOC2=O)c1[N+](=O)[O-]	ZINC000289627096	288746397	/nfs/dbraw/zinc/74/63/97/288746397.db2.gz	RRSZYOSPOBJBBG-ZDUSSCGKSA-N	-1	3	328.346	1.196	20	5		EDBDHM
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CNCCC1(F)F	ZINC000420442855	304758668	/nfs/dbraw/zinc/75/86/68/304758668.db2.gz	KUBZLKTZAHKHAV-GFCCVEGCSA-N	-1	3	349.359	1.433	20	5		EDBDHM
CC(C)(CCC(=O)Nc1ccc(F)c([N-]S(C)(=O)=O)c1)[N+](=O)[O-]	ZINC000294554234	303122999	/nfs/dbraw/zinc/12/29/99/303122999.db2.gz	UEPPXPUPDWXRPE-UHFFFAOYSA-N	-1	3	347.368	1.971	20	5		EDBDHM
O=C(NC1CCN([C@@H]2CCOC2)CC1)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000361258245	303744629	/nfs/dbraw/zinc/74/46/29/303744629.db2.gz	OFCDZWZRXCODKQ-CYBMUJFWSA-N	-1	3	335.360	1.284	20	5		EDBDHM
O=C(NCCNC(=O)c1ccc([O-])cc1)Nc1ccc([N+](=O)[O-])cc1	ZINC000436481706	305158390	/nfs/dbraw/zinc/15/83/90/305158390.db2.gz	CYZDHHDWUBCJDL-UHFFFAOYSA-N	-1	3	344.327	1.852	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000440392406	305205167	/nfs/dbraw/zinc/20/51/67/305205167.db2.gz	XFYBXMJOZZNMRN-UHFFFAOYSA-N	-1	3	333.304	1.545	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)[C@@H](O)C(F)F	ZINC000451706389	305363362	/nfs/dbraw/zinc/36/33/62/305363362.db2.gz	GGPBWASTEJZVBA-HZGVNTEJSA-N	-1	3	344.361	1.648	20	5		EDBDHM
CC/C=C\C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC	ZINC000451770718	305368268	/nfs/dbraw/zinc/36/82/68/305368268.db2.gz	GEDZUMSQTXSWRH-PLNGDYQASA-N	-1	3	328.346	1.626	20	5		EDBDHM
Cn1cc(Cl)c(C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])n1	ZINC000451803447	305369983	/nfs/dbraw/zinc/36/99/83/305369983.db2.gz	QNBRWBBQVYRKLR-UHFFFAOYSA-N	-1	3	344.780	1.601	20	5		EDBDHM
CCC1(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)COC1	ZINC000451950341	305373516	/nfs/dbraw/zinc/37/35/16/305373516.db2.gz	GVSOSGDJEPWMFV-UHFFFAOYSA-N	-1	3	330.362	1.308	20	5		EDBDHM
CCc1ncc(C[N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)o1	ZINC000451963023	305374619	/nfs/dbraw/zinc/37/46/19/305374619.db2.gz	YFJTXDGMUGOTLL-UHFFFAOYSA-N	-1	3	325.346	1.765	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2COCC2(C)C)c1[N+](=O)[O-]	ZINC000451979057	305375864	/nfs/dbraw/zinc/37/58/64/305375864.db2.gz	PPUVKFAKVYOIHS-LLVKDONJSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1	ZINC000532664433	305988562	/nfs/dbraw/zinc/98/85/62/305988562.db2.gz	NBXBBOAKQUSBGJ-ZDUSSCGKSA-N	-1	3	332.360	1.501	20	5		EDBDHM
CC[C@@H](C)[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000016083540	441215205	/nfs/dbraw/zinc/21/52/05/441215205.db2.gz	KYILFFWWKQIEEZ-SKDRFNHKSA-N	-1	3	330.362	1.461	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]CC1(O)CCCC1	ZINC000087041537	441477398	/nfs/dbraw/zinc/47/73/98/441477398.db2.gz	NNRVEPIHPRLAPU-UHFFFAOYSA-N	-1	3	334.781	1.832	20	5		EDBDHM
C[C@@H](CN1CCCC1=O)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000055280169	441637155	/nfs/dbraw/zinc/63/71/55/441637155.db2.gz	FLOAWNYSHHQDSU-VIFPVBQESA-N	-1	3	345.352	1.023	20	5		EDBDHM
CCN1CCN([C@@H]2CCN(Cc3cc([O-])ccc3[N+](=O)[O-])C2)CC1	ZINC000093132660	441858990	/nfs/dbraw/zinc/85/89/90/441858990.db2.gz	DRNDFEVZRVZEHF-OAHLLOKOSA-N	-1	3	334.420	1.512	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1cc(C)on1	ZINC000147075099	441903909	/nfs/dbraw/zinc/90/39/09/441903909.db2.gz	AACFMDPUGMBFEY-UHFFFAOYSA-N	-1	3	327.318	1.378	20	5		EDBDHM
CC(C)C[C@@H](CCO)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000124163860	441909963	/nfs/dbraw/zinc/90/99/63/441909963.db2.gz	JJIXXOVCCSKCCG-GFCCVEGCSA-N	-1	3	330.406	1.918	20	5		EDBDHM
COC(=O)CCCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000069044128	441882920	/nfs/dbraw/zinc/88/29/20/441882920.db2.gz	HFWBANQXUYEFSJ-UHFFFAOYSA-N	-1	3	334.325	1.356	20	5		EDBDHM
CN1CCC([N-]S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1	ZINC000119511285	441939179	/nfs/dbraw/zinc/93/91/79/441939179.db2.gz	IZQLIOGIMBMYFK-UHFFFAOYSA-N	-1	3	333.797	1.621	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCCCNC2=O)c1C	ZINC000119609602	441943496	/nfs/dbraw/zinc/94/34/96/441943496.db2.gz	LCTLESXSNQHMER-NSHDSACASA-N	-1	3	341.389	1.159	20	5		EDBDHM
Cc1ccsc1[C@@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000125319785	442009554	/nfs/dbraw/zinc/00/95/54/442009554.db2.gz	KCFCENUAFSRUBQ-GFCCVEGCSA-N	-1	3	342.398	1.977	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCC[S@@](C)=O)c1C	ZINC000120683043	442116637	/nfs/dbraw/zinc/11/66/37/442116637.db2.gz	CBWOWTVHFGHXJJ-FQEVSTJZSA-N	-1	3	334.419	1.259	20	5		EDBDHM
CC[C@@H](CCO)C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000121180897	442188266	/nfs/dbraw/zinc/18/82/66/442188266.db2.gz	SBYLYQRQUHNBAI-LBPRGKRZSA-N	-1	3	330.406	1.899	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC2(CCO)CCC2)c(F)c1	ZINC000127338106	442194788	/nfs/dbraw/zinc/19/47/88/442194788.db2.gz	BAPKWNLZXGRKOR-UHFFFAOYSA-N	-1	3	332.353	1.565	20	5		EDBDHM
Cc1c(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cnn1C	ZINC000152609915	442230453	/nfs/dbraw/zinc/23/04/53/442230453.db2.gz	OACLTDYOCVIWOA-UHFFFAOYSA-N	-1	3	344.780	1.769	20	5		EDBDHM
O=C(Cn1cnc([N+](=O)[O-])n1)Nc1ccc(Br)cc1[O-]	ZINC000130025200	442337602	/nfs/dbraw/zinc/33/76/02/442337602.db2.gz	ARRKJVSLBQJKCD-UHFFFAOYSA-N	-1	3	342.109	1.293	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC(F)(F)C(F)F)cc1[N+](=O)[O-]	ZINC000192134895	442600896	/nfs/dbraw/zinc/60/08/96/442600896.db2.gz	RPVRVIWXLLVQIC-UHFFFAOYSA-N	-1	3	346.258	1.782	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2CCN(C3CC3)C2)c(F)c1	ZINC000193871783	442802134	/nfs/dbraw/zinc/80/21/34/442802134.db2.gz	WEOXCDZAWPFJJS-SNVBAGLBSA-N	-1	3	343.380	1.497	20	5		EDBDHM
CN1CC[C@@H](NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)[C@@H]1c1ccccc1	ZINC000193763730	442782714	/nfs/dbraw/zinc/78/27/14/442782714.db2.gz	NQHTZBVGUVIPNH-HIFRSBDPSA-N	-1	3	342.355	1.871	20	5		EDBDHM
NC(=O)c1ccc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)cc1	ZINC000194396187	442888789	/nfs/dbraw/zinc/88/87/89/442888789.db2.gz	PALNIIJJIOIBPE-UHFFFAOYSA-N	-1	3	341.370	1.234	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]CCCn1ccnn1	ZINC000183169200	442894347	/nfs/dbraw/zinc/89/43/47/442894347.db2.gz	YYOWNHKVNVBOIY-UHFFFAOYSA-N	-1	3	345.768	1.208	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1nnc[nH]1	ZINC000183202369	442901782	/nfs/dbraw/zinc/90/17/82/442901782.db2.gz	VNCOMHDFCFQOHJ-LURJTMIESA-N	-1	3	331.741	1.406	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CCCC[C@H]1OC	ZINC000266127134	443027044	/nfs/dbraw/zinc/02/70/44/443027044.db2.gz	AJPZXHGHDABFOK-NWDGAFQWSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CCOC(=O)[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])[C@H](C)CC	ZINC000266312937	443094408	/nfs/dbraw/zinc/09/44/08/443094408.db2.gz	QANQUWXFTUFRRT-ZWNOBZJWSA-N	-1	3	344.389	1.851	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]C[C@]2(C)CCCO2)cc1[N+](=O)[O-]	ZINC000185121812	443141684	/nfs/dbraw/zinc/14/16/84/443141684.db2.gz	FIKWYEWBDIHGCM-ZDUSSCGKSA-N	-1	3	332.353	1.890	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCC[C@H]2CO)c(Cl)c1	ZINC000228604534	443124604	/nfs/dbraw/zinc/12/46/04/443124604.db2.gz	ZCRYGYHJTNCWPA-KWQFWETISA-N	-1	3	334.781	1.688	20	5		EDBDHM
C[C@H](CCCO)C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000384659735	319127098	/nfs/dbraw/zinc/12/70/98/319127098.db2.gz	BAYZLRNZKPKYIN-SECBINFHSA-N	-1	3	336.797	1.935	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)C(=O)NC(C)C)cc1C	ZINC000416623391	319450615	/nfs/dbraw/zinc/45/06/15/319450615.db2.gz	OEZGDEGTOOTGRD-NSHDSACASA-N	-1	3	343.405	1.403	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)C(=O)OC	ZINC000272585223	443372260	/nfs/dbraw/zinc/37/22/60/443372260.db2.gz	YYDBMXZIMGMLPI-GFCCVEGCSA-N	-1	3	330.362	1.008	20	5		EDBDHM
C[C@@]1([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CCO[C@@H]1C1CC1	ZINC000273102172	443539895	/nfs/dbraw/zinc/53/98/95/443539895.db2.gz	OWNLTWZHZSEVDR-ZIAGYGMSSA-N	-1	3	326.374	1.831	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2=CCN(C)CC2)c1C	ZINC000272275160	443576826	/nfs/dbraw/zinc/57/68/26/443576826.db2.gz	SMXLLOHHKNYAOH-UHFFFAOYSA-N	-1	3	339.417	1.752	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CCC[C@H]1C	ZINC000276194108	443666516	/nfs/dbraw/zinc/66/65/16/443666516.db2.gz	IKPAGSKWDGLWIS-SKDRFNHKSA-N	-1	3	342.373	1.848	20	5		EDBDHM
CN(C)C[C@H](NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)c1ccc(F)cc1	ZINC000288100445	443771162	/nfs/dbraw/zinc/77/11/62/443771162.db2.gz	HZVDBVHCLKBKIH-ZDUSSCGKSA-N	-1	3	348.334	1.867	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ncnn1C	ZINC000276745309	443810529	/nfs/dbraw/zinc/81/05/29/443810529.db2.gz	SFUGVWSFYBRPJO-SSDOTTSWSA-N	-1	3	345.768	1.416	20	5		EDBDHM
CCOC(=O)CC[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276909338	443870086	/nfs/dbraw/zinc/87/00/86/443870086.db2.gz	WXQDODABGDHHJQ-UHFFFAOYSA-N	-1	3	330.362	1.443	20	5		EDBDHM
Cc1nnc(C[N-]S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)s1	ZINC000540941544	320765971	/nfs/dbraw/zinc/76/59/71/320765971.db2.gz	WONJAHYEVABIQL-UHFFFAOYSA-N	-1	3	342.402	1.417	20	5		EDBDHM
CCn1cc(C[N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])cn1	ZINC000285757143	444097748	/nfs/dbraw/zinc/09/77/48/444097748.db2.gz	WYESLTJRHWWNDL-UHFFFAOYSA-N	-1	3	338.389	1.907	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC2(CO)CCCC2)c([N+](=O)[O-])c1	ZINC000322467146	444339910	/nfs/dbraw/zinc/33/99/10/444339910.db2.gz	ZKKJLEBFWSHECK-UHFFFAOYSA-N	-1	3	344.389	1.434	20	5		EDBDHM
CSc1ccc(C(=O)N(CCN(C)C)CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000322581396	444340114	/nfs/dbraw/zinc/34/01/14/444340114.db2.gz	MGYGRGOSSVFJMQ-UHFFFAOYSA-N	-1	3	341.389	1.405	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CC[C@H](OC)C1	ZINC000331002268	444354105	/nfs/dbraw/zinc/35/41/05/444354105.db2.gz	OMIMGLYELNHFSM-KOLCDFICSA-N	-1	3	330.362	1.449	20	5		EDBDHM
CSC1(CNc2nc(C(=O)[O-])ccc2[N+](=O)[O-])CCN(C)CC1	ZINC000581192844	322147604	/nfs/dbraw/zinc/14/76/04/322147604.db2.gz	HYATVKJERYSECE-UHFFFAOYSA-N	-1	3	340.405	1.927	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC[C@@H]2CCOC2)c1C	ZINC000343991609	444714223	/nfs/dbraw/zinc/71/42/23/444714223.db2.gz	LIHJUKFPBDDZQG-GFCCVEGCSA-N	-1	3	328.390	1.917	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCN(C)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000342502349	444719779	/nfs/dbraw/zinc/71/97/79/444719779.db2.gz	GJRIMOJQQJWADV-WCBMZHEXSA-N	-1	3	333.435	1.726	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC[C@H]2CCOC2)c(Cl)c1	ZINC000344015365	444728967	/nfs/dbraw/zinc/72/89/67/444728967.db2.gz	RORVELWDVFSJEI-VIFPVBQESA-N	-1	3	334.781	1.953	20	5		EDBDHM
COC(=O)[C@H](CC(F)F)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000341720085	444968765	/nfs/dbraw/zinc/96/87/65/444968765.db2.gz	YBKRCQCWPQNEJL-ZETCQYMHSA-N	-1	3	338.288	1.070	20	5		EDBDHM
COC(=O)c1cccc2nc(NC(=O)c3ccc([N+](=O)[O-])n3C)[n-]c21	ZINC000344494402	445010156	/nfs/dbraw/zinc/01/01/56/445010156.db2.gz	VAQKYHUBARSUDX-UHFFFAOYSA-N	-1	3	343.299	1.849	20	5		EDBDHM
COC(=O)c1cccc2[n-]c(NC(=O)c3ccc([N+](=O)[O-])n3C)nc21	ZINC000344494402	445010161	/nfs/dbraw/zinc/01/01/61/445010161.db2.gz	VAQKYHUBARSUDX-UHFFFAOYSA-N	-1	3	343.299	1.849	20	5		EDBDHM
CC[C@@H](C)[C@H]([N-]S(C)(=O)=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1	ZINC000348013424	445261233	/nfs/dbraw/zinc/26/12/33/445261233.db2.gz	OORAXDRWHNFPCK-PELKAZGASA-N	-1	3	347.368	1.636	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCN2CC=CCC2)c([N+](=O)[O-])c1	ZINC000357238929	445500330	/nfs/dbraw/zinc/50/03/30/445500330.db2.gz	OAJHOPZLIDEVPA-UHFFFAOYSA-N	-1	3	341.389	1.144	20	5		EDBDHM
CCO[C@H]1COCC[C@@H]1[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000352983968	445569333	/nfs/dbraw/zinc/56/93/33/445569333.db2.gz	PGMNHTFCOZYOOE-AAEUAGOBSA-N	-1	3	344.389	1.376	20	5		EDBDHM
O=C(c1csc(=O)[n-]1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000349853799	445700197	/nfs/dbraw/zinc/70/01/97/445700197.db2.gz	NGLNHWCPWNMPQJ-MRVPVSSYSA-N	-1	3	335.345	1.479	20	5		EDBDHM
CC(C)(O)CN1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC1	ZINC000370411887	446266537	/nfs/dbraw/zinc/26/65/37/446266537.db2.gz	DQVPFZOMXOWYOY-UHFFFAOYSA-N	-1	3	337.376	1.219	20	5		EDBDHM
CN(C)CC[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000416357507	447579930	/nfs/dbraw/zinc/57/99/30/447579930.db2.gz	DNHIDDFUIAYNOR-UHFFFAOYSA-N	-1	3	341.311	1.454	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CCC[C@H]1OC	ZINC000451876504	447770534	/nfs/dbraw/zinc/77/05/34/447770534.db2.gz	FRZLAJCNKZWHIK-GHMZBOCLSA-N	-1	3	330.362	1.449	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000523694490	447901886	/nfs/dbraw/zinc/90/18/86/447901886.db2.gz	XOERWZPZRYOUOA-GFCCVEGCSA-N	-1	3	345.359	1.411	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC)[C@@H](O)C(C)C	ZINC000591332325	448327127	/nfs/dbraw/zinc/32/71/27/448327127.db2.gz	DUJCFUXDIYBLJW-GWCFXTLKSA-N	-1	3	346.405	1.677	20	5		EDBDHM
CC[C@H](C)C[C@H](CO)[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000592082156	448667943	/nfs/dbraw/zinc/66/79/43/448667943.db2.gz	GUCCXTDRBFWWBS-WDEREUQCSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)n[n-]1	ZINC000543761258	448747726	/nfs/dbraw/zinc/74/77/26/448747726.db2.gz	HLFOBPIDWCRWIO-UHFFFAOYSA-N	-1	3	343.299	2.228	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)[n-]n1	ZINC000543761258	448747729	/nfs/dbraw/zinc/74/77/29/448747729.db2.gz	HLFOBPIDWCRWIO-UHFFFAOYSA-N	-1	3	343.299	2.228	20	5		EDBDHM
CC(C)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C1(CO)CCC1	ZINC000593597390	449097998	/nfs/dbraw/zinc/09/79/98/449097998.db2.gz	HTESHVBRWXWEFC-CYBMUJFWSA-N	-1	3	343.405	1.455	20	5		EDBDHM
CS(=O)(=O)c1cc([N+](=O)[O-])c([N-]CC(=O)NC2CCCC2)s1	ZINC000611280958	449248586	/nfs/dbraw/zinc/24/85/86/449248586.db2.gz	CYQZQKXDLDDCCU-UHFFFAOYSA-N	-1	3	347.418	1.531	20	5		EDBDHM
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCc1nc(CN)cc(=O)[n-]1	ZINC000595947802	449274430	/nfs/dbraw/zinc/27/44/30/449274430.db2.gz	OCRUOVFYONTJMM-UHFFFAOYSA-N	-1	3	331.332	1.096	20	5		EDBDHM
Nc1cc(NCCNC(=O)c2ccc([O-])cc2)cc(CO)c1[N+](=O)[O-]	ZINC000611525451	449321677	/nfs/dbraw/zinc/32/16/77/449321677.db2.gz	CSHBXSHBLADOJQ-UHFFFAOYSA-N	-1	3	346.343	1.217	20	5		EDBDHM
CN1CC[C@@H]([N-]S(=O)(=O)c2ccc3ncccc3c2[N+](=O)[O-])C1	ZINC000594749882	449665669	/nfs/dbraw/zinc/66/56/69/449665669.db2.gz	CTYYHSCSOTZWKE-SNVBAGLBSA-N	-1	3	336.373	1.125	20	5		EDBDHM
CC(C)[C@@H](CO)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594762235	449675893	/nfs/dbraw/zinc/67/58/93/449675893.db2.gz	GHPFPRWSIJARDI-GFCCVEGCSA-N	-1	3	339.373	1.438	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1COC(C)(C)C1	ZINC000594793783	449702963	/nfs/dbraw/zinc/70/29/63/449702963.db2.gz	CTLBIBDFIHAVRR-VIFPVBQESA-N	-1	3	330.362	1.449	20	5		EDBDHM
COC[C@@H](CC[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])OC	ZINC000594795261	449706395	/nfs/dbraw/zinc/70/63/95/449706395.db2.gz	JOLSYUWQEDHSIZ-LLVKDONJSA-N	-1	3	332.378	1.233	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)C2(CO)CC2)c([N+](=O)[O-])c1	ZINC000594826664	449733955	/nfs/dbraw/zinc/73/39/55/449733955.db2.gz	HVHILOQYTLMSLD-VIFPVBQESA-N	-1	3	330.362	1.043	20	5		EDBDHM
O=c1[n-]ccc(NC[C@@H]2CN(Cc3ccncc3)CCO2)c1[N+](=O)[O-]	ZINC000599183871	449784923	/nfs/dbraw/zinc/78/49/23/449784923.db2.gz	CGHHAGHFJDTVMC-CYBMUJFWSA-N	-1	3	345.359	1.403	20	5		EDBDHM
CCN1CCC([N-]S(=O)(=O)c2cc(C)sc2[N+](=O)[O-])CC1	ZINC000601303002	449813014	/nfs/dbraw/zinc/81/30/14/449813014.db2.gz	AGTOEGOWXWQIDT-UHFFFAOYSA-N	-1	3	333.435	1.727	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)COc2ccc([N+](=O)[O-])cc2)[n-]1	ZINC000617870045	449887616	/nfs/dbraw/zinc/88/76/16/449887616.db2.gz	BFXCBGKHUOQMHL-UHFFFAOYSA-N	-1	3	334.288	1.512	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c[n-]1	ZINC000617870045	449887619	/nfs/dbraw/zinc/88/76/19/449887619.db2.gz	BFXCBGKHUOQMHL-UHFFFAOYSA-N	-1	3	334.288	1.512	20	5		EDBDHM
CN(C)CCNC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])[n-]2)cc1	ZINC000609163544	449972172	/nfs/dbraw/zinc/97/21/72/449972172.db2.gz	IYHDIMUFJVHYLH-UHFFFAOYSA-N	-1	3	345.359	1.467	20	5		EDBDHM
CCCN1CC[C@H]([N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C1	ZINC000595353377	450067217	/nfs/dbraw/zinc/06/72/17/450067217.db2.gz	HHRGPZLKPTXQJM-ZDUSSCGKSA-N	-1	3	341.433	1.974	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H](C)c2nccn2C)cc1[N+](=O)[O-]	ZINC000595382401	450096792	/nfs/dbraw/zinc/09/67/92/450096792.db2.gz	HHMAXALELULCKF-SSDOTTSWSA-N	-1	3	330.391	1.738	20	5		EDBDHM
CNC(=O)Cc1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc1	ZINC000618346582	450166008	/nfs/dbraw/zinc/16/60/08/450166008.db2.gz	VAWULJJNEASFNQ-UHFFFAOYSA-N	-1	3	330.300	1.236	20	5		EDBDHM
O=C(c1ccc([O-])cc1)N1CCN(c2cccnc2[N+](=O)[O-])CC1	ZINC000610754508	450323460	/nfs/dbraw/zinc/32/34/60/450323460.db2.gz	FNIQYQJZNMUYRS-UHFFFAOYSA-N	-1	3	328.328	1.658	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](C)[C@@H]1CCCCO1	ZINC000619495422	450491128	/nfs/dbraw/zinc/49/11/28/450491128.db2.gz	RQFJCKJZAODQGQ-PWSUYJOCSA-N	-1	3	344.389	1.839	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1ncccc1[O-]	ZINC000619503204	450494355	/nfs/dbraw/zinc/49/43/55/450494355.db2.gz	TYMTYCHXVULZCA-UHFFFAOYSA-N	-1	3	339.329	1.183	20	5		EDBDHM
C[C@H](CCN1CCN(C)CC1)NC(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000184069218	533916390	/nfs/dbraw/zinc/91/63/90/533916390.db2.gz	UMQXOAYKRAPTFV-GFCCVEGCSA-N	-1	3	336.392	1.056	20	5		EDBDHM
CCCNC(=O)C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000189806309	528402857	/nfs/dbraw/zinc/40/28/57/528402857.db2.gz	BTSIEKCPYRGKMV-UHFFFAOYSA-N	-1	3	329.378	1.016	20	5		EDBDHM
CC(C)(C)[C@@H]([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C(N)=O	ZINC000272166634	535051504	/nfs/dbraw/zinc/05/15/04/535051504.db2.gz	OZWAPECTIMOHFM-JTQLQIEISA-N	-1	3	329.303	1.703	20	5		EDBDHM
CCO[C@H]1COCC[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000352979667	535642664	/nfs/dbraw/zinc/64/26/64/535642664.db2.gz	FKXQUZAELURZCW-RYUDHWBXSA-N	-1	3	348.352	1.206	20	5		EDBDHM
CCO[C@@H]1COCC[C@H]1[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000352987726	535759978	/nfs/dbraw/zinc/75/99/78/535759978.db2.gz	UFVSNHUWGRRDQW-ZIAGYGMSSA-N	-1	3	344.389	1.208	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)OC	ZINC000270464656	535807430	/nfs/dbraw/zinc/80/74/30/535807430.db2.gz	DYWRNWCDXAWHCA-SECBINFHSA-N	-1	3	336.753	1.478	20	5		EDBDHM
COC(=O)c1ccc(F)c([N-]C(=O)c2c([N+](=O)[O-])c(C)nn2C)c1	ZINC000352962368	536718895	/nfs/dbraw/zinc/71/88/95/536718895.db2.gz	LYAYXBQXZNHQLZ-UHFFFAOYSA-N	-1	3	336.279	1.815	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCC(=O)OC(C)C)c([N+](=O)[O-])c1	ZINC000340426034	536875560	/nfs/dbraw/zinc/87/55/60/536875560.db2.gz	DRGOEEWUHFNJSY-UHFFFAOYSA-N	-1	3	346.361	1.223	20	5		EDBDHM
C[C@@H](OC(=O)c1cncc([O-])c1)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000731915255	578683145	/nfs/dbraw/zinc/68/31/45/578683145.db2.gz	FVGUJDASGKKUKQ-SECBINFHSA-N	-1	3	331.284	1.879	20	5		EDBDHM
C[C@H](O)c1ccc(CNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cc1	ZINC000736154569	578959867	/nfs/dbraw/zinc/95/98/67/578959867.db2.gz	WJYNMIBCBUPGNQ-VIFPVBQESA-N	-1	3	341.331	1.835	20	5		EDBDHM
C[C@H](O)c1ccc(CNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)cc1	ZINC000736154569	578959868	/nfs/dbraw/zinc/95/98/68/578959868.db2.gz	WJYNMIBCBUPGNQ-VIFPVBQESA-N	-1	3	341.331	1.835	20	5		EDBDHM
O=C1CCCCN1CCCNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000738301563	579183362	/nfs/dbraw/zinc/18/33/62/579183362.db2.gz	DCYUVEGSAWWGQX-UHFFFAOYSA-N	-1	3	345.363	1.589	20	5		EDBDHM
O=C1CCCCN1CCCNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000738301563	579183364	/nfs/dbraw/zinc/18/33/64/579183364.db2.gz	DCYUVEGSAWWGQX-UHFFFAOYSA-N	-1	3	345.363	1.589	20	5		EDBDHM
O=C([O-])/C=C/c1ccc(NC[C@@H]2CN3CCC[C@@H]3CO2)c([N+](=O)[O-])c1	ZINC000739622363	579227482	/nfs/dbraw/zinc/22/74/82/579227482.db2.gz	AWSROUWYKRQCIT-IOKDEZFASA-N	-1	3	347.371	1.968	20	5		EDBDHM
CC1(O)CCC([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000751480848	579809459	/nfs/dbraw/zinc/80/94/59/579809459.db2.gz	YCRNZJPMKOWZRH-UHFFFAOYSA-N	-1	3	332.353	1.706	20	5		EDBDHM
O=Cc1n[n-]c2cc(C(=O)OCCn3ccc([N+](=O)[O-])n3)ccc12	ZINC000766172025	580160850	/nfs/dbraw/zinc/16/08/50/580160850.db2.gz	DECAPZJIRQYGJC-UHFFFAOYSA-N	-1	3	329.272	1.337	20	5		EDBDHM
O=Cc1[n-]nc2cc(C(=O)OCCn3ccc([N+](=O)[O-])n3)ccc12	ZINC000766172025	580160851	/nfs/dbraw/zinc/16/08/51/580160851.db2.gz	DECAPZJIRQYGJC-UHFFFAOYSA-N	-1	3	329.272	1.337	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@@H](O)c2ccccn2)cc1[N+](=O)[O-]	ZINC000767845909	580201916	/nfs/dbraw/zinc/20/19/16/580201916.db2.gz	ZLLXNELLKYXVOG-LLVKDONJSA-N	-1	3	343.386	1.372	20	5		EDBDHM
COCCN1CCC[C@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000768837218	580221830	/nfs/dbraw/zinc/22/18/30/580221830.db2.gz	TYJJPHMJCWTWGE-JTQLQIEISA-N	-1	3	349.434	1.045	20	5		EDBDHM
COc1nnc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)[n-]1	ZINC000778955180	580476735	/nfs/dbraw/zinc/47/67/35/580476735.db2.gz	AIXCYWFHDFVTJA-UHFFFAOYSA-N	-1	3	336.264	1.499	20	5		EDBDHM
COc1nc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)n[n-]1	ZINC000778955180	580476736	/nfs/dbraw/zinc/47/67/36/580476736.db2.gz	AIXCYWFHDFVTJA-UHFFFAOYSA-N	-1	3	336.264	1.499	20	5		EDBDHM
COc1n[n-]c(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)n1	ZINC000778955180	580476737	/nfs/dbraw/zinc/47/67/37/580476737.db2.gz	AIXCYWFHDFVTJA-UHFFFAOYSA-N	-1	3	336.264	1.499	20	5		EDBDHM
O=C(CNC(=O)c1cccc([O-])c1)OCc1cc(F)ccc1[N+](=O)[O-]	ZINC000785699811	580650588	/nfs/dbraw/zinc/65/05/88/580650588.db2.gz	RRTJBJMXGKXFKE-UHFFFAOYSA-N	-1	3	348.286	1.913	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCO[C@@H](C(F)(F)F)C1	ZINC000738360376	598856066	/nfs/dbraw/zinc/85/60/66/598856066.db2.gz	WCJDIFJIUULHNB-SNVBAGLBSA-N	-1	3	344.253	1.542	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCO[C@@H](C(F)(F)F)C1	ZINC000738360376	598856067	/nfs/dbraw/zinc/85/60/67/598856067.db2.gz	WCJDIFJIUULHNB-SNVBAGLBSA-N	-1	3	344.253	1.542	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CS(=O)(=O)[N-]C1(c2ccccc2)COC1	ZINC000903665419	592262060	/nfs/dbraw/zinc/26/20/60/592262060.db2.gz	SQOWKNOMGNPTAF-UHFFFAOYSA-N	-1	3	348.380	1.940	20	5		EDBDHM
O=C1[C@@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C[C@@H]2CCCCN12	ZINC000841532488	593206949	/nfs/dbraw/zinc/20/69/49/593206949.db2.gz	TUQUKBCIHTVKEG-WPRPVWTQSA-N	-1	3	345.402	1.088	20	5		EDBDHM
C[C@@H](O)[C@@H](CO)[N-]c1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000840348759	593629864	/nfs/dbraw/zinc/62/98/64/593629864.db2.gz	UPVGZEIZRVEFGM-IYSWYEEDSA-N	-1	3	339.226	1.675	20	5		EDBDHM
CC(C)[C@@H](CO)Nc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820184327	593797844	/nfs/dbraw/zinc/79/78/44/593797844.db2.gz	ZWZIQVNWCBJUCT-CYBMUJFWSA-N	-1	3	343.347	1.752	20	5		EDBDHM
CC(C)[C@@H](CO)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820184327	593797845	/nfs/dbraw/zinc/79/78/45/593797845.db2.gz	ZWZIQVNWCBJUCT-CYBMUJFWSA-N	-1	3	343.347	1.752	20	5		EDBDHM
Cc1cc(=O)n(Cc2ccc(F)cc2-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000822161393	594002056	/nfs/dbraw/zinc/00/20/56/594002056.db2.gz	PAPNZRMCFIJCSJ-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cc1cc(=O)n(Cc2ccc(F)cc2-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000822161393	594002058	/nfs/dbraw/zinc/00/20/58/594002058.db2.gz	PAPNZRMCFIJCSJ-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cn1cc(-c2nnn[n-]2)cc1C(=O)OCc1cc(F)ccc1[N+](=O)[O-]	ZINC000822659229	594081208	/nfs/dbraw/zinc/08/12/08/594081208.db2.gz	HUBCJXSYDVEKKD-UHFFFAOYSA-N	-1	3	346.278	1.610	20	5		EDBDHM
Cn1cc(-c2nn[n-]n2)cc1C(=O)OCc1cc(F)ccc1[N+](=O)[O-]	ZINC000822659229	594081209	/nfs/dbraw/zinc/08/12/09/594081209.db2.gz	HUBCJXSYDVEKKD-UHFFFAOYSA-N	-1	3	346.278	1.610	20	5		EDBDHM
CC[C@@H](Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@H](O)C(F)(F)F	ZINC000825146312	594136099	/nfs/dbraw/zinc/13/60/99/594136099.db2.gz	CCKHTWVJRWWZJV-XCBNKYQSSA-N	-1	3	346.269	1.889	20	5		EDBDHM
CC[C@@H](Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])[C@H](O)C(F)(F)F	ZINC000825146312	594136101	/nfs/dbraw/zinc/13/61/01/594136101.db2.gz	CCKHTWVJRWWZJV-XCBNKYQSSA-N	-1	3	346.269	1.889	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCO[C@H](c2ccco2)C1	ZINC000823630057	594223063	/nfs/dbraw/zinc/22/30/63/594223063.db2.gz	QJSIMQUACDAPRA-AWEZNQCLSA-N	-1	3	342.315	1.946	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCO[C@H](c2ccco2)C1	ZINC000823630057	594223064	/nfs/dbraw/zinc/22/30/64/594223064.db2.gz	QJSIMQUACDAPRA-AWEZNQCLSA-N	-1	3	342.315	1.946	20	5		EDBDHM
O=[N+]([O-])c1ccn(CCSc2ccc(-c3nnn[n-]3)cc2F)n1	ZINC000823647475	594224468	/nfs/dbraw/zinc/22/44/68/594224468.db2.gz	KMIMRSPHYLRYKJ-UHFFFAOYSA-N	-1	3	335.324	1.903	20	5		EDBDHM
O=[N+]([O-])c1ccn(CCSc2ccc(-c3nn[n-]n3)cc2F)n1	ZINC000823647475	594224469	/nfs/dbraw/zinc/22/44/69/594224469.db2.gz	KMIMRSPHYLRYKJ-UHFFFAOYSA-N	-1	3	335.324	1.903	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCOC[C@@H]2CCCO2)c(-c2nnn[n-]2)c1	ZINC000823651168	594224605	/nfs/dbraw/zinc/22/46/05/594224605.db2.gz	HRJXFDNWUHKAEM-NSHDSACASA-N	-1	3	349.351	1.168	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCOC[C@@H]2CCCO2)c(-c2nn[n-]n2)c1	ZINC000823651168	594224606	/nfs/dbraw/zinc/22/46/06/594224606.db2.gz	HRJXFDNWUHKAEM-NSHDSACASA-N	-1	3	349.351	1.168	20	5		EDBDHM
CN(C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C(=O)[O-])C1	ZINC000828167631	594356067	/nfs/dbraw/zinc/35/60/67/594356067.db2.gz	ARUMHQSGEMZCMP-CHWSQXEVSA-N	-1	3	339.348	1.019	20	5		EDBDHM
O=C(Nc1cc(-c2nnn[n-]2)cc([N+](=O)[O-])c1Cl)[C@@H]1CCOC1	ZINC000826451135	594481334	/nfs/dbraw/zinc/48/13/34/594481334.db2.gz	RFJZPJJETYUKTB-ZCFIWIBFSA-N	-1	3	338.711	1.403	20	5		EDBDHM
O=C(Nc1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl)[C@@H]1CCOC1	ZINC000826451135	594481335	/nfs/dbraw/zinc/48/13/35/594481335.db2.gz	RFJZPJJETYUKTB-ZCFIWIBFSA-N	-1	3	338.711	1.403	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NCCOc1ncccc1F	ZINC000826497484	594502190	/nfs/dbraw/zinc/50/21/90/594502190.db2.gz	IXUTZDVJGYQRIR-UHFFFAOYSA-N	-1	3	345.294	1.800	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NCCOc1ncccc1F	ZINC000826497484	594502192	/nfs/dbraw/zinc/50/21/92/594502192.db2.gz	IXUTZDVJGYQRIR-UHFFFAOYSA-N	-1	3	345.294	1.800	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC(c3ncc[nH]3)CC2)cc1-c1nnn[n-]1	ZINC000826498745	594502895	/nfs/dbraw/zinc/50/28/95/594502895.db2.gz	IATYBUDXXYYLKM-UHFFFAOYSA-N	-1	3	340.347	1.882	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC(c3ncc[nH]3)CC2)cc1-c1nn[n-]n1	ZINC000826498745	594502897	/nfs/dbraw/zinc/50/28/97/594502897.db2.gz	IATYBUDXXYYLKM-UHFFFAOYSA-N	-1	3	340.347	1.882	20	5		EDBDHM
O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1ccccc1-c1nnn[n-]1	ZINC000826501506	594504154	/nfs/dbraw/zinc/50/41/54/594504154.db2.gz	TUFMTQWSOFGDFS-UHFFFAOYSA-N	-1	3	349.310	1.533	20	5		EDBDHM
O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1ccccc1-c1nn[n-]n1	ZINC000826501506	594504156	/nfs/dbraw/zinc/50/41/56/594504156.db2.gz	TUFMTQWSOFGDFS-UHFFFAOYSA-N	-1	3	349.310	1.533	20	5		EDBDHM
CCCC[C@H](C(=O)[O-])N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000829276824	594591654	/nfs/dbraw/zinc/59/16/54/594591654.db2.gz	NDYIAMPXZZTFQC-OAHLLOKOSA-N	-1	3	349.387	1.996	20	5		EDBDHM
CS(=O)(=O)c1ccc(C(=O)[N-]OCCC2CC2)c([N+](=O)[O-])c1	ZINC000836790549	594998339	/nfs/dbraw/zinc/99/83/39/594998339.db2.gz	QDJJSQZNXDROJN-UHFFFAOYSA-N	-1	3	328.346	1.460	20	5		EDBDHM
O=C([N-][C@H](CO)C1CCC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000853820322	595891410	/nfs/dbraw/zinc/89/14/10/595891410.db2.gz	MTHIXKUIAMBXRZ-GFCCVEGCSA-N	-1	3	330.287	1.844	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@H]2c3ccccc3C[C@H]2O)cs1	ZINC000119813792	596743654	/nfs/dbraw/zinc/74/36/54/596743654.db2.gz	UELYMLAEHVLCAR-YPMHNXCESA-N	-1	3	340.382	1.593	20	5		EDBDHM
CC[C@@H]1COCCN1CCNCc1cc(OC)c([O-])cc1[N+](=O)[O-]	ZINC000873188451	597222202	/nfs/dbraw/zinc/22/22/02/597222202.db2.gz	GXUSIIBGGWEYCC-CYBMUJFWSA-N	-1	3	339.392	1.509	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C1CC(C)C1	ZINC000273608765	201260339	/nfs/dbraw/zinc/26/03/39/201260339.db2.gz	SVNJCPKOTXDRKX-UHFFFAOYSA-N	-1	3	328.346	1.458	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](CO)C(C)(C)C	ZINC000276804031	201299735	/nfs/dbraw/zinc/29/97/35/201299735.db2.gz	LBBLGCUXHMVDMS-LBPRGKRZSA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cn1cc(CCC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)cn1	ZINC000102661871	204044567	/nfs/dbraw/zinc/04/45/67/204044567.db2.gz	YRFIDMMGNLCOJW-UHFFFAOYSA-N	-1	3	342.352	1.379	20	5		EDBDHM
CCN1CCCC[C@@H]1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000111353041	204352300	/nfs/dbraw/zinc/35/23/00/204352300.db2.gz	CHEJGNHYBKNQGS-GFCCVEGCSA-N	-1	3	327.406	1.748	20	5		EDBDHM
Cc1c(F)cc(S(=O)(=O)[N-]C[C@@H]2CCCCO2)cc1[N+](=O)[O-]	ZINC000133730703	205375572	/nfs/dbraw/zinc/37/55/72/205375572.db2.gz	CEARICHAQQWZFR-JTQLQIEISA-N	-1	3	332.353	1.890	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])[C@@H](O)C(C)C	ZINC000416618488	251085968	/nfs/dbraw/zinc/08/59/68/251085968.db2.gz	JPXXPEYNISBTQU-RISCZKNCSA-N	-1	3	346.405	1.677	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CCCC[C@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC000487433232	255029916	/nfs/dbraw/zinc/02/99/16/255029916.db2.gz	QGPBCIBKCCTNKF-MNOVXSKESA-N	-1	3	341.389	1.226	20	5		EDBDHM
COC(=O)c1cc2c(cc1[N-]C(=O)c1nn(C)cc1[N+](=O)[O-])OCO2	ZINC000489685234	255071114	/nfs/dbraw/zinc/07/11/14/255071114.db2.gz	LSHOTEQAFDYVRY-UHFFFAOYSA-N	-1	3	348.271	1.096	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CCn3ccnc3C2)cc1[N+](=O)[O-]	ZINC000491867668	255153540	/nfs/dbraw/zinc/15/35/40/255153540.db2.gz	JLQZDTUAYQDIBX-VIFPVBQESA-N	-1	3	342.402	1.455	20	5		EDBDHM
O=C(/C=C\c1cncc([O-])c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000491989661	255157840	/nfs/dbraw/zinc/15/78/40/255157840.db2.gz	HKRGSAADPCJRFJ-BHQIHCQQSA-N	-1	3	341.323	1.998	20	5		EDBDHM
O=C(C=Cc1ccc(F)cc1[N+](=O)[O-])N1CCc2nc[n-]c(=O)c2C1	ZINC000493743524	255220241	/nfs/dbraw/zinc/22/02/41/255220241.db2.gz	WEJHQOXMNXRNJR-DUXPYHPUSA-N	-1	3	344.302	1.828	20	5		EDBDHM
COC(=O)NCc1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc1	ZINC000495565934	255301746	/nfs/dbraw/zinc/30/17/46/255301746.db2.gz	NSHGRVQUHOUSIW-UHFFFAOYSA-N	-1	3	346.299	1.804	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC(=O)N2CCCC2)c1C	ZINC000119482261	221330776	/nfs/dbraw/zinc/33/07/76/221330776.db2.gz	ODBZNDONSJDIDU-UHFFFAOYSA-N	-1	3	341.389	1.112	20	5		EDBDHM
COCc1nc(S[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])n[n-]1	ZINC000268517244	285517054	/nfs/dbraw/zinc/51/70/54/285517054.db2.gz	YQAXNVSZGANYFU-MRVPVSSYSA-N	-1	3	337.361	1.979	20	5		EDBDHM
C[C@H]1C[C@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CCO1	ZINC000271297716	140273047	/nfs/dbraw/zinc/27/30/47/140273047.db2.gz	VEINAGHDXOHGFU-VHSXEESVSA-N	-1	3	332.353	1.827	20	5		EDBDHM
CC(C)(CCCO)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000271718594	140339092	/nfs/dbraw/zinc/33/90/92/140339092.db2.gz	SRSMRGZNHHDHEZ-UHFFFAOYSA-N	-1	3	334.369	1.811	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)[C@@H]1CCCCO1	ZINC000272048301	140392555	/nfs/dbraw/zinc/39/25/55/140392555.db2.gz	MQQGVIUJHIOFGI-PWSUYJOCSA-N	-1	3	344.389	1.839	20	5		EDBDHM
COC(=O)[C@@H](CC1CC1)[N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000416589914	304334644	/nfs/dbraw/zinc/33/46/44/304334644.db2.gz	RUWXIFFMGBMYBX-CYBMUJFWSA-N	-1	3	342.373	1.356	20	5		EDBDHM
CCOC[C@@H](C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC	ZINC000345307301	286135663	/nfs/dbraw/zinc/13/56/63/286135663.db2.gz	MZOUOFRRKOSYGA-SECBINFHSA-N	-1	3	346.361	1.085	20	5		EDBDHM
O=C(Nc1ccc(C[C@@H]2NC(=O)[N-]C2=O)cc1)c1ccc([N+](=O)[O-])o1	ZINC000354950856	150050820	/nfs/dbraw/zinc/05/08/20/150050820.db2.gz	NJIFBKKWZLGZOX-JTQLQIEISA-N	-1	3	344.283	1.191	20	5		EDBDHM
CCCN1CCC[C@@H]1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000352501222	162215528	/nfs/dbraw/zinc/21/55/28/162215528.db2.gz	SUPXIRJPPZLASJ-SNVBAGLBSA-N	-1	3	333.435	1.809	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCCn2ccnc2)cc1[N+](=O)[O-]	ZINC000122677784	222136161	/nfs/dbraw/zinc/13/61/61/222136161.db2.gz	DURJQWLQYXIACM-UHFFFAOYSA-N	-1	3	330.391	1.530	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCN2CCC[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000123177691	222230256	/nfs/dbraw/zinc/23/02/56/222230256.db2.gz	ROFHDIIHVKKFRK-SNVBAGLBSA-N	-1	3	347.462	1.975	20	5		EDBDHM
Cc1cc(C(=O)N2CCc3c(nc[n-]c3=O)C2)c(N)c([N+](=O)[O-])c1	ZINC000273262080	268007241	/nfs/dbraw/zinc/00/72/41/268007241.db2.gz	QEESRZPYQGAZBZ-UHFFFAOYSA-N	-1	3	329.316	1.180	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@@H](C)SC)cc1[N+](=O)[O-]	ZINC000275131911	268285670	/nfs/dbraw/zinc/28/56/70/268285670.db2.gz	BVZQMEWDLYGSSU-SSDOTTSWSA-N	-1	3	338.382	1.772	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC1CCC1	ZINC000276264691	273156367	/nfs/dbraw/zinc/15/63/67/273156367.db2.gz	USSPTZFGACQITF-UHFFFAOYSA-N	-1	3	328.346	1.460	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])NCC1CCCC1	ZINC000280739026	273392435	/nfs/dbraw/zinc/39/24/35/273392435.db2.gz	JGOSVTCJMPNWDB-UHFFFAOYSA-N	-1	3	341.389	1.180	20	5		EDBDHM
O=[N+]([O-])c1ccc(CS(=O)(=O)[N-]Cc2ncccc2F)cc1	ZINC000156674027	287674706	/nfs/dbraw/zinc/67/47/06/287674706.db2.gz	QCDBRMOQTGUWKS-UHFFFAOYSA-N	-1	3	325.321	1.749	20	5		EDBDHM
O=C1CC[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C2(CCC2)N1	ZINC000283285821	273818501	/nfs/dbraw/zinc/81/85/01/273818501.db2.gz	USBQPTUNLQWQGR-LBPRGKRZSA-N	-1	3	339.373	1.074	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2CCOC[C@H]2C)c([N+](=O)[O-])c1	ZINC000285565487	274581317	/nfs/dbraw/zinc/58/13/17/274581317.db2.gz	JWUHNOOTHPVLFR-MNOVXSKESA-N	-1	3	344.389	1.554	20	5		EDBDHM
NS(=O)(=O)c1ccc([N-]c2cc3n(n2)CCCC3)c([N+](=O)[O-])c1	ZINC000286296287	287976004	/nfs/dbraw/zinc/97/60/04/287976004.db2.gz	HCDXQYXTTLDHEP-UHFFFAOYSA-N	-1	3	337.361	1.519	20	5		EDBDHM
CC(C)(C)N1C[C@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1=O	ZINC000080805323	278355524	/nfs/dbraw/zinc/35/55/24/278355524.db2.gz	WMQVBMPKYLXROE-SNVBAGLBSA-N	-1	3	341.389	1.273	20	5		EDBDHM
Cc1ccnc(N2CCN(C(=O)c3ccccc3[O-])CC2)c1[N+](=O)[O-]	ZINC000265293592	278984733	/nfs/dbraw/zinc/98/47/33/278984733.db2.gz	YPCDOUJTTAGCFI-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
COC(=O)[C@@H](CF)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000287374872	288223172	/nfs/dbraw/zinc/22/31/72/288223172.db2.gz	JCOZDWCIYVCYTQ-SECBINFHSA-N	-1	3	334.325	1.001	20	5		EDBDHM
CO[C@H](C[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C1CC1	ZINC000293827945	303025415	/nfs/dbraw/zinc/02/54/15/303025415.db2.gz	PMRVIIOBJYVSEC-CYBMUJFWSA-N	-1	3	328.390	1.915	20	5		EDBDHM
CCN1CC[C@H]2OCCN(C(=O)c3cc([O-])cc([N+](=O)[O-])c3)[C@H]2C1	ZINC000293884511	303033490	/nfs/dbraw/zinc/03/34/90/303033490.db2.gz	LGYACWGLHYGZQZ-LSDHHAIUSA-N	-1	3	335.360	1.236	20	5		EDBDHM
CCCc1n[nH]c(C(=O)[N-]OC(C)(C)C(=O)OCC)c1[N+](=O)[O-]	ZINC000295736554	303259824	/nfs/dbraw/zinc/25/98/24/303259824.db2.gz	SDBGVEOWHKZYBA-UHFFFAOYSA-N	-1	3	328.325	1.274	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H]2CC[C@@H](CO)C2)c1[N+](=O)[O-]	ZINC000295811114	303270580	/nfs/dbraw/zinc/27/05/80/303270580.db2.gz	UCDPQDFCVPGILP-NEPJUHHUSA-N	-1	3	328.390	1.651	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2cccc(F)c2-c2nc[nH]n2)n1	ZINC000428218639	305008493	/nfs/dbraw/zinc/00/84/93/305008493.db2.gz	WIASETIRSRPGCH-UHFFFAOYSA-N	-1	3	345.294	1.988	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CCC2CC(O)C2)cc1[N+](=O)[O-]	ZINC000432324228	305091409	/nfs/dbraw/zinc/09/14/09/305091409.db2.gz	UIAMTJIAAHBKML-UHFFFAOYSA-N	-1	3	348.352	1.182	20	5		EDBDHM
O=C(NCCNC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccc([O-])cc1	ZINC000436682769	305165345	/nfs/dbraw/zinc/16/53/45/305165345.db2.gz	RPAAWSZVJIOOQP-UHFFFAOYSA-N	-1	3	347.302	1.599	20	5		EDBDHM
O=[N+]([O-])c1ncccc1NCC[N-]S(=O)(=O)c1cccs1	ZINC000610958123	450392075	/nfs/dbraw/zinc/39/20/75/450392075.db2.gz	MUODUGSZVQOYKW-UHFFFAOYSA-N	-1	3	328.375	1.442	20	5		EDBDHM
Cc1nnc(C[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])s1	ZINC000541870532	306048684	/nfs/dbraw/zinc/04/86/84/306048684.db2.gz	SSEGBDGKNGOINY-UHFFFAOYSA-N	-1	3	328.375	1.542	20	5		EDBDHM
O=C(C=Cc1cccc([N+](=O)[O-])c1)N1CCc2c(=O)[n-]cnc2C1	ZINC000493835683	447406795	/nfs/dbraw/zinc/40/67/95/447406795.db2.gz	KAYREGNWHXYNOW-SNAWJCMRSA-N	-1	3	326.312	1.689	20	5		EDBDHM
O=C(NCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)C(=O)[N-]C2=O	ZINC000104857269	441216277	/nfs/dbraw/zinc/21/62/77/441216277.db2.gz	YMNWILMUDCWKIE-UHFFFAOYSA-N	-1	3	325.280	1.408	20	5		EDBDHM
Cc1nc(C)c(CC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c(=O)[n-]1	ZINC000088349734	441505203	/nfs/dbraw/zinc/50/52/03/441505203.db2.gz	BZHVVZREWILUFG-UHFFFAOYSA-N	-1	3	342.355	1.422	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H]1CCC[C@H](O)C1	ZINC000121829295	441789492	/nfs/dbraw/zinc/78/94/92/441789492.db2.gz	KXQBGHOXUXZQQX-NEPJUHHUSA-N	-1	3	328.390	1.733	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccco1	ZINC000175355345	442048239	/nfs/dbraw/zinc/04/82/39/442048239.db2.gz	PINOCHXWWMOKQI-ZDUSSCGKSA-N	-1	3	340.357	1.995	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@@H]2CCCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000121333576	442204981	/nfs/dbraw/zinc/20/49/81/442204981.db2.gz	FHPNDNUCGHGEFE-WCQYABFASA-N	-1	3	328.390	1.733	20	5		EDBDHM
CNC(=O)[C@@H]([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(C)C	ZINC000178928552	442528572	/nfs/dbraw/zinc/52/85/72/442528572.db2.gz	FCTQHAMNAVJHBU-ZDUSSCGKSA-N	-1	3	343.405	1.261	20	5		EDBDHM
Cc1nn(C)c(C(=O)[N-]c2n[nH]c(-c3ccccc3F)n2)c1[N+](=O)[O-]	ZINC000181887539	442720497	/nfs/dbraw/zinc/72/04/97/442720497.db2.gz	DQPYFZQSDCPPTJ-UHFFFAOYSA-N	-1	3	345.294	1.813	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCOCC2CC2)c1C	ZINC000268853388	443127335	/nfs/dbraw/zinc/12/73/35/443127335.db2.gz	KXSRTAOVCUAMQK-UHFFFAOYSA-N	-1	3	328.390	1.917	20	5		EDBDHM
COC(=O)c1ccc(-c2nc(-c3c([N+](=O)[O-])nc(C)n3C)no2)[n-]1	ZINC000350524830	319051512	/nfs/dbraw/zinc/05/15/12/319051512.db2.gz	ANHPQBJCFBPMML-UHFFFAOYSA-N	-1	3	332.276	1.468	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H]2CCCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000269766548	443431831	/nfs/dbraw/zinc/43/18/31/443431831.db2.gz	LIFKLGAKYNMQMH-MFKMUULPSA-N	-1	3	344.389	1.433	20	5		EDBDHM
O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCc2nc[n-]c(=O)c2C1	ZINC000269686658	443395773	/nfs/dbraw/zinc/39/57/73/443395773.db2.gz	FCRZMWPTRNCMIU-UHFFFAOYSA-N	-1	3	346.368	1.767	20	5		EDBDHM
C[C@]1([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CCS(=O)(=O)C1	ZINC000272133564	443537069	/nfs/dbraw/zinc/53/70/69/443537069.db2.gz	XLNCNEJJVSWJEL-LBPRGKRZSA-N	-1	3	348.327	1.380	20	5		EDBDHM
COC(=O)[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C1CC1	ZINC000267822458	443588660	/nfs/dbraw/zinc/58/86/60/443588660.db2.gz	YDLKEDPZLFYNFG-LLVKDONJSA-N	-1	3	348.764	1.478	20	5		EDBDHM
COC(=O)C(C)(C)[N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1	ZINC000272417173	443618544	/nfs/dbraw/zinc/61/85/44/443618544.db2.gz	DFDODIMWPFKUEV-UHFFFAOYSA-N	-1	3	330.362	1.008	20	5		EDBDHM
O=C(c1c([O-])cccc1O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000436857786	320025453	/nfs/dbraw/zinc/02/54/53/320025453.db2.gz	XTLGQXJWEVQYDQ-UHFFFAOYSA-N	-1	3	332.316	1.680	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](CO)CC1CCC1	ZINC000280112662	443666213	/nfs/dbraw/zinc/66/62/13/443666213.db2.gz	BZHRUWFCMZGWFK-LLVKDONJSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CC[C@](C)([N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C(=O)OC	ZINC000276842653	443848493	/nfs/dbraw/zinc/84/84/93/443848493.db2.gz	QBCQEAWTZPLIBQ-AWEZNQCLSA-N	-1	3	344.389	1.832	20	5		EDBDHM
CCC[C@]1([N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])CCOC1	ZINC000285344211	443949494	/nfs/dbraw/zinc/94/94/94/443949494.db2.gz	PCFHILYGHWZZAS-AWEZNQCLSA-N	-1	3	344.389	1.841	20	5		EDBDHM
CCOCC(C)(C)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000288511781	443903275	/nfs/dbraw/zinc/90/32/75/443903275.db2.gz	YCEYNTCUZTUTRK-UHFFFAOYSA-N	-1	3	346.405	1.944	20	5		EDBDHM
Cc1cc([N+](=O)[O-])ccc1-c1noc([C@H](C)[N-]S(C)(=O)=O)n1	ZINC000546399862	320810399	/nfs/dbraw/zinc/81/03/99/320810399.db2.gz	ITYRMJFSRPFDLQ-QMMMGPOBSA-N	-1	3	326.334	1.563	20	5		EDBDHM
C[C@@H]1CCCN(C(=O)COC(=O)c2[n-]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000282075862	444079178	/nfs/dbraw/zinc/07/91/78/444079178.db2.gz	XFGQFKXCPNSGPF-SNVBAGLBSA-N	-1	3	346.343	1.886	20	5		EDBDHM
C[C@@H]1CCCN(C(=O)COC(=O)c2n[n-]c3ccc([N+](=O)[O-])cc32)C1	ZINC000282075862	444079182	/nfs/dbraw/zinc/07/91/82/444079182.db2.gz	XFGQFKXCPNSGPF-SNVBAGLBSA-N	-1	3	346.343	1.886	20	5		EDBDHM
Cc1c(CC(=O)Nc2[n-]nnc2C(=O)NC2CC2)cccc1[N+](=O)[O-]	ZINC000297704900	444321066	/nfs/dbraw/zinc/32/10/66/444321066.db2.gz	KEBWRCMEGLLGJP-UHFFFAOYSA-N	-1	3	344.331	1.095	20	5		EDBDHM
Cc1c(CC(=O)Nc2nn[n-]c2C(=O)NC2CC2)cccc1[N+](=O)[O-]	ZINC000297704900	444321068	/nfs/dbraw/zinc/32/10/68/444321068.db2.gz	KEBWRCMEGLLGJP-UHFFFAOYSA-N	-1	3	344.331	1.095	20	5		EDBDHM
Cc1c(CC(=O)Nc2n[n-]nc2C(=O)NC2CC2)cccc1[N+](=O)[O-]	ZINC000297704900	444321070	/nfs/dbraw/zinc/32/10/70/444321070.db2.gz	KEBWRCMEGLLGJP-UHFFFAOYSA-N	-1	3	344.331	1.095	20	5		EDBDHM
C[C@@H]1C[C@@H]([N-]S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CCN1C	ZINC000319615819	444325006	/nfs/dbraw/zinc/32/50/06/444325006.db2.gz	ZUKRNSFGHGGQMN-ZJUUUORDSA-N	-1	3	331.369	1.495	20	5		EDBDHM
COC(=O)c1cc([N-]S(=O)(=O)N2CCC[C@@H]2C)cc([N+](=O)[O-])c1	ZINC000331013548	444358997	/nfs/dbraw/zinc/35/89/97/444358997.db2.gz	TVTFEKPGLUHZJF-VIFPVBQESA-N	-1	3	343.361	1.522	20	5		EDBDHM
COC(=O)CCCCC[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000337774132	444399902	/nfs/dbraw/zinc/39/99/02/444399902.db2.gz	GPQAKOWOMISMHT-UHFFFAOYSA-N	-1	3	344.389	1.915	20	5		EDBDHM
Cc1noc(C(C)(C)[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])n1	ZINC000340775651	444506552	/nfs/dbraw/zinc/50/65/52/444506552.db2.gz	UBIMGXHHJCOEOD-UHFFFAOYSA-N	-1	3	340.361	1.808	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]Cc1ccc[nH]1	ZINC000343770804	444579590	/nfs/dbraw/zinc/57/95/90/444579590.db2.gz	RODJSLYPDDLNCD-UHFFFAOYSA-N	-1	3	339.329	1.188	20	5		EDBDHM
O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCc2nc[n-]c(=O)c2C1	ZINC000339108422	445036020	/nfs/dbraw/zinc/03/60/20/445036020.db2.gz	GYNZFBLBXDDRAV-UHFFFAOYSA-N	-1	3	333.279	1.820	20	5		EDBDHM
CC[C@@H]1CN(Cc2cc([O-])ccc2[N+](=O)[O-])C[C@@H]1N1CCOCC1	ZINC000339024976	444993074	/nfs/dbraw/zinc/99/30/74/444993074.db2.gz	UEYSTZWASFIGNS-DYVFJYSZSA-N	-1	3	335.404	1.843	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCc2nccnc2C)cc1[N+](=O)[O-]	ZINC000339059642	445013372	/nfs/dbraw/zinc/01/33/72/445013372.db2.gz	MULLUQZLBUILHT-UHFFFAOYSA-N	-1	3	342.402	1.584	20	5		EDBDHM
Cc1cc([N-]C(=O)Cn2cc(Br)c([N+](=O)[O-])n2)on1	ZINC000348162024	445295599	/nfs/dbraw/zinc/29/55/99/445295599.db2.gz	SWAPRAQISWNZGK-UHFFFAOYSA-N	-1	3	330.098	1.489	20	5		EDBDHM
O=[N+]([O-])c1cccc2ncnc(NCc3nnc(C(F)(F)F)[n-]3)c21	ZINC000359694235	445378902	/nfs/dbraw/zinc/37/89/02/445378902.db2.gz	IEMHQVZNKANDDY-UHFFFAOYSA-N	-1	3	339.237	2.287	20	5		EDBDHM
O=[N+]([O-])c1cccc2ncnc(NCc3n[n-]c(C(F)(F)F)n3)c21	ZINC000359694235	445378909	/nfs/dbraw/zinc/37/89/09/445378909.db2.gz	IEMHQVZNKANDDY-UHFFFAOYSA-N	-1	3	339.237	2.287	20	5		EDBDHM
O=[N+]([O-])c1cccc2ncnc(NCc3nc(C(F)(F)F)n[n-]3)c21	ZINC000359694235	445378912	/nfs/dbraw/zinc/37/89/12/445378912.db2.gz	IEMHQVZNKANDDY-UHFFFAOYSA-N	-1	3	339.237	2.287	20	5		EDBDHM
CO[C@]1(C[N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])CCOC1	ZINC000359984717	445514804	/nfs/dbraw/zinc/51/48/04/445514804.db2.gz	CLQFHPCFPKHTNM-AWEZNQCLSA-N	-1	3	344.389	1.295	20	5		EDBDHM
CNC(=O)Cn1cc([N-]c2nc3ccccc3cc2[N+](=O)[O-])cn1	ZINC000352356926	445522406	/nfs/dbraw/zinc/52/24/06/445522406.db2.gz	OHVDPKWVLXQZAW-UHFFFAOYSA-N	-1	3	326.316	1.829	20	5		EDBDHM
C[N-]S(=O)(=O)c1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)cn1	ZINC000350068504	445761327	/nfs/dbraw/zinc/76/13/27/445761327.db2.gz	FZCHUAZGKODLMM-UHFFFAOYSA-N	-1	3	336.329	1.150	20	5		EDBDHM
COC(=O)[C@@H]1CN(C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c2ccccc21	ZINC000356536599	445847476	/nfs/dbraw/zinc/84/74/76/445847476.db2.gz	CLLREBWAAKIJDT-LLVKDONJSA-N	-1	3	343.295	1.612	20	5		EDBDHM
CCOc1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc1CO	ZINC000362373876	446338877	/nfs/dbraw/zinc/33/88/77/446338877.db2.gz	QKSWFQBGIJKWSQ-UHFFFAOYSA-N	-1	3	333.300	1.839	20	5		EDBDHM
O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)[N-]C[C@@H]1C[C@H](F)CN1	ZINC000370730381	446407458	/nfs/dbraw/zinc/40/74/58/446407458.db2.gz	NPDNKRJBQVKETO-IUCAKERBSA-N	-1	3	337.760	1.227	20	5		EDBDHM
Cc1cc(C(=O)N2CCC(N3CCCC3=O)CC2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000375094245	446577710	/nfs/dbraw/zinc/57/77/10/446577710.db2.gz	NXTVDELMWGWHDG-UHFFFAOYSA-N	-1	3	348.359	1.231	20	5		EDBDHM
Cc1nn(C)c(C(=O)[N-]c2cc(-c3cncc(C)c3)on2)c1[N+](=O)[O-]	ZINC000377572084	447214430	/nfs/dbraw/zinc/21/44/30/447214430.db2.gz	GCQRKWYHOPOXMA-UHFFFAOYSA-N	-1	3	342.315	2.247	20	5		EDBDHM
CC(C)[C@@H]1C[C@H]1[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000416547516	447642987	/nfs/dbraw/zinc/64/29/87/447642987.db2.gz	LWMFWMIRKVNJNN-VHSXEESVSA-N	-1	3	342.373	1.689	20	5		EDBDHM
CO[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C12CCC2	ZINC000416564864	447649604	/nfs/dbraw/zinc/64/96/04/447649604.db2.gz	SACHXIYDZSOAKT-STQMWFEESA-N	-1	3	344.364	1.970	20	5		EDBDHM
CC(C)(C)N1CCC([N-]S(=O)(=O)c2cccnc2[N+](=O)[O-])CC1	ZINC000525186902	447973639	/nfs/dbraw/zinc/97/36/39/447973639.db2.gz	PMQVKOKIBYKLCB-UHFFFAOYSA-N	-1	3	342.421	1.531	20	5		EDBDHM
C[C@H](CN1CCC(C)CC1)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000515671538	448342646	/nfs/dbraw/zinc/34/26/46/448342646.db2.gz	MQKLEWZIJOCYKG-CYBMUJFWSA-N	-1	3	341.433	1.994	20	5		EDBDHM
CC(C)n1ccc(C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])n1	ZINC000584498661	448546748	/nfs/dbraw/zinc/54/67/48/448546748.db2.gz	AMGWANVEKWZODT-UHFFFAOYSA-N	-1	3	338.389	1.992	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CCCCn2ccnc2)c(F)c1	ZINC000543728318	448745851	/nfs/dbraw/zinc/74/58/51/448745851.db2.gz	LXPMPHYSPMKSPQ-UHFFFAOYSA-N	-1	3	342.352	1.689	20	5		EDBDHM
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CC[C@@]3(C2)CCCN(C)C3)n1	ZINC000574918879	448990053	/nfs/dbraw/zinc/99/00/53/448990053.db2.gz	BDVPAAFKWKNEBF-INIZCTEOSA-N	-1	3	334.376	1.919	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1snnc1C	ZINC000589930724	449084727	/nfs/dbraw/zinc/08/47/27/449084727.db2.gz	OJSXSNRUJSPIBV-UHFFFAOYSA-N	-1	3	344.374	1.242	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H](C)COCC1CC1	ZINC000593654876	449132125	/nfs/dbraw/zinc/13/21/25/449132125.db2.gz	XPQSRYHYLLMFHI-JTQLQIEISA-N	-1	3	344.389	1.697	20	5		EDBDHM
CC(C)C[C@@H]1OCCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593578857	449086764	/nfs/dbraw/zinc/08/67/64/449086764.db2.gz	NSMOREZPNVZATD-OLZOCXBDSA-N	-1	3	343.405	1.862	20	5		EDBDHM
CC(C)OC(=O)CC[C@@H](C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593585289	449091486	/nfs/dbraw/zinc/09/14/86/449091486.db2.gz	DFXDMRLABFWQJQ-SNVBAGLBSA-N	-1	3	345.377	1.388	20	5		EDBDHM
CC(C)(C(=O)[O-])N1CCN(c2ncnc3ccc([N+](=O)[O-])cc32)CC1	ZINC000592980472	449092789	/nfs/dbraw/zinc/09/27/89/449092789.db2.gz	IIHJUIGLBCXYOY-UHFFFAOYSA-N	-1	3	345.359	1.523	20	5		EDBDHM
CC(C)[C@H](CO)[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(C)C	ZINC000593600196	449100206	/nfs/dbraw/zinc/10/02/06/449100206.db2.gz	BOHRESMXPJWPPI-JSGCOSHPSA-N	-1	3	345.421	1.557	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H](CO)C2CCCCC2)nc1	ZINC000593603678	449102491	/nfs/dbraw/zinc/10/24/91/449102491.db2.gz	VGNPCFDKJJSSJS-LBPRGKRZSA-N	-1	3	343.405	1.457	20	5		EDBDHM
CC(C)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)OCC1CC1	ZINC000593606573	449104401	/nfs/dbraw/zinc/10/44/01/449104401.db2.gz	HLDWJPQOMWDEKN-UHFFFAOYSA-N	-1	3	329.378	1.473	20	5		EDBDHM
CO[C@H]1c2ccccc2C[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593608102	449105573	/nfs/dbraw/zinc/10/55/73/449105573.db2.gz	OBGCQFCHARBVCF-HIFRSBDPSA-N	-1	3	349.368	1.581	20	5		EDBDHM
COc1ccc(CC(=O)N2CCc3nc[n-]c(=O)c3C2)cc1[N+](=O)[O-]	ZINC000530295438	449106281	/nfs/dbraw/zinc/10/62/81/449106281.db2.gz	HIBDWFZVWQVIPZ-UHFFFAOYSA-N	-1	3	344.327	1.226	20	5		EDBDHM
O=C(Nc1n[nH]c2[nH]c(=O)ccc12)c1n[n-]c2ccc([N+](=O)[O-])cc21	ZINC000590555103	449189238	/nfs/dbraw/zinc/18/92/38/449189238.db2.gz	LQOTWHTYCAHOIS-UHFFFAOYSA-N	-1	3	339.271	1.700	20	5		EDBDHM
C[C@H]1CCCC[C@@H]1OCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593532232	449328977	/nfs/dbraw/zinc/32/89/77/449328977.db2.gz	ZIFLGXLCAQPWBQ-AAEUAGOBSA-N	-1	3	343.405	1.863	20	5		EDBDHM
C[C@H]1CCCCN1CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593531237	449329005	/nfs/dbraw/zinc/32/90/05/449329005.db2.gz	PNVGFQLJTBBGTG-NSHDSACASA-N	-1	3	328.394	1.143	20	5		EDBDHM
O=C(c1cc([O-])cc([N+](=O)[O-])c1)N1CCCN(C[C@@H]2CCCO2)CC1	ZINC000611553940	449334935	/nfs/dbraw/zinc/33/49/35/449334935.db2.gz	MFAJGQUGKIIYQK-INIZCTEOSA-N	-1	3	349.387	1.627	20	5		EDBDHM
O=c1[n-]ccc(N2CCO[C@@H](COc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000596208690	449415500	/nfs/dbraw/zinc/41/55/00/449415500.db2.gz	VKDIKQGUOWULBL-CYBMUJFWSA-N	-1	3	331.328	1.980	20	5		EDBDHM
CCC1(CC)CN(c2cc[n-]c(=O)c2[N+](=O)[O-])CCS1(=O)=O	ZINC000596208468	449415641	/nfs/dbraw/zinc/41/56/41/449415641.db2.gz	HSFXVFIVMZEWMV-UHFFFAOYSA-N	-1	3	329.378	1.489	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)on1	ZINC000598601814	449486347	/nfs/dbraw/zinc/48/63/47/449486347.db2.gz	WXUUMJSFCHIEJO-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
C[C@H](CCO)[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594761064	449675552	/nfs/dbraw/zinc/67/55/52/449675552.db2.gz	WQBCJMWBUHRFEC-SECBINFHSA-N	-1	3	325.346	1.192	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2COC(C)(C)C2)cc1[N+](=O)[O-]	ZINC000594788439	449698071	/nfs/dbraw/zinc/69/80/71/449698071.db2.gz	CIUCDRPNISVOJU-QMMMGPOBSA-N	-1	3	348.352	1.588	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1C[C@@H](O)C12CCC2	ZINC000594865889	449780401	/nfs/dbraw/zinc/78/04/01/449780401.db2.gz	STXWSVJXQKZCAE-QWHCGFSZSA-N	-1	3	342.373	1.185	20	5		EDBDHM
COc1ccccc1[C@@H]1C[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000594867807	449783932	/nfs/dbraw/zinc/78/39/32/449783932.db2.gz	OVWPBURLBUWWFR-QWHCGFSZSA-N	-1	3	349.368	1.833	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]C[C@]1(C)CC1(F)F	ZINC000594856586	449765175	/nfs/dbraw/zinc/76/51/75/449765175.db2.gz	IMGOKSMDRXJDBK-NSHDSACASA-N	-1	3	336.316	1.927	20	5		EDBDHM
C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000599459787	449991871	/nfs/dbraw/zinc/99/18/71/449991871.db2.gz	NBHSXSLAOURZNP-YDEXJTGXSA-N	-1	3	332.353	1.824	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](C)c2nccn2C)c1[N+](=O)[O-]	ZINC000595384218	450099605	/nfs/dbraw/zinc/09/96/05/450099605.db2.gz	ULCTVYIMJNYBHO-LLVKDONJSA-N	-1	3	338.389	1.985	20	5		EDBDHM
COC(=O)[C@H]1C[C@H]([N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C1	ZINC000595402143	450115806	/nfs/dbraw/zinc/11/58/06/450115806.db2.gz	QURBYHWXWRBQJV-XYPYZODXSA-N	-1	3	342.373	1.442	20	5		EDBDHM
O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-]C1CC=CC1)OCCO2	ZINC000610740020	450318047	/nfs/dbraw/zinc/31/80/47/450318047.db2.gz	DMKVOALRSSVVEN-UHFFFAOYSA-N	-1	3	326.330	1.363	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1ncccc1C	ZINC000619482092	450486299	/nfs/dbraw/zinc/48/62/99/450486299.db2.gz	PGEDFNOFCWHIKF-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1OC(=O)c1ccc(-c2nnn[n-]2)cn1	ZINC000737117493	579048621	/nfs/dbraw/zinc/04/86/21/579048621.db2.gz	XCQXLBIMDYHYJE-UHFFFAOYSA-N	-1	3	342.271	1.398	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1OC(=O)c1ccc(-c2nn[n-]n2)cn1	ZINC000737117493	579048622	/nfs/dbraw/zinc/04/86/22/579048622.db2.gz	XCQXLBIMDYHYJE-UHFFFAOYSA-N	-1	3	342.271	1.398	20	5		EDBDHM
Cc1ccc(CCNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cn1	ZINC000737336799	579074858	/nfs/dbraw/zinc/07/48/58/579074858.db2.gz	GYIFODUYCHCRTF-UHFFFAOYSA-N	-1	3	326.320	1.528	20	5		EDBDHM
Cc1ccc(CCNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)cn1	ZINC000737336799	579074859	/nfs/dbraw/zinc/07/48/59/579074859.db2.gz	GYIFODUYCHCRTF-UHFFFAOYSA-N	-1	3	326.320	1.528	20	5		EDBDHM
O=C(OCc1ccc(F)cc1-c1nnn[n-]1)c1ccc([N+](=O)[O-])o1	ZINC000738236362	579175924	/nfs/dbraw/zinc/17/59/24/579175924.db2.gz	WBTKABWHWDZNHY-UHFFFAOYSA-N	-1	3	333.235	1.864	20	5		EDBDHM
O=C(OCc1ccc(F)cc1-c1nn[n-]n1)c1ccc([N+](=O)[O-])o1	ZINC000738236362	579175926	/nfs/dbraw/zinc/17/59/26/579175926.db2.gz	WBTKABWHWDZNHY-UHFFFAOYSA-N	-1	3	333.235	1.864	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H](CO)CC(F)F)cc([N+](=O)[O-])c1F	ZINC000758253851	579978589	/nfs/dbraw/zinc/97/85/89/579978589.db2.gz	MEPRQGKOHBVUNK-SSDOTTSWSA-N	-1	3	342.295	1.337	20	5		EDBDHM
O=[N+]([O-])c1ccc[n-]c1=NNS(=O)(=O)c1c[nH]c2ncccc12	ZINC000759170075	580000103	/nfs/dbraw/zinc/00/01/03/580000103.db2.gz	YXOSGRVBOLFFBJ-UHFFFAOYSA-N	-1	3	334.317	1.172	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]CCC2CC(O)C2)c1	ZINC000762347468	580072718	/nfs/dbraw/zinc/07/27/18/580072718.db2.gz	SCHLDLWCAIYQHE-UHFFFAOYSA-N	-1	3	348.808	1.996	20	5		EDBDHM
O=C(Nc1cnn(-c2ccccc2)n1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000770681989	580267553	/nfs/dbraw/zinc/26/75/53/580267553.db2.gz	LIJNDXMWUXDTNN-UHFFFAOYSA-N	-1	3	326.272	1.528	20	5		EDBDHM
CC[C@@H](C(=O)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])N(CC)CC	ZINC000778597297	580468313	/nfs/dbraw/zinc/46/83/13/580468313.db2.gz	WRTNOBCAJDASBH-NSHDSACASA-N	-1	3	343.405	1.520	20	5		EDBDHM
O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1cc2n[n-]nc2cc1F	ZINC000781929927	580560560	/nfs/dbraw/zinc/56/05/60/580560560.db2.gz	HXDMFSGGQQKQQX-UHFFFAOYSA-N	-1	3	345.290	1.814	20	5		EDBDHM
C[C@@H](CN1CCCCC1)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000788918252	580732615	/nfs/dbraw/zinc/73/26/15/580732615.db2.gz	GFTNGVVTTQKZFI-JTQLQIEISA-N	-1	3	333.435	1.809	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])OC/C=C/Cl	ZINC000796275036	580949800	/nfs/dbraw/zinc/94/98/00/580949800.db2.gz	FBMUXEQQLQVJRH-ZZXKWVIFSA-N	-1	3	334.737	1.169	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCOC[C@@H]2CCOC2)c(-c2nnn[n-]2)c1	ZINC000738373383	598973649	/nfs/dbraw/zinc/97/36/49/598973649.db2.gz	BLSGYQAJCFDSAU-JTQLQIEISA-N	-1	3	349.351	1.025	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCOC[C@@H]2CCOC2)c(-c2nn[n-]n2)c1	ZINC000738373383	598973651	/nfs/dbraw/zinc/97/36/51/598973651.db2.gz	BLSGYQAJCFDSAU-JTQLQIEISA-N	-1	3	349.351	1.025	20	5		EDBDHM
CC(=O)NC1CCC(Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CC1	ZINC000735473560	592984309	/nfs/dbraw/zinc/98/43/09/592984309.db2.gz	AIZVNTLNACCIMX-UHFFFAOYSA-N	-1	3	346.351	1.029	20	5		EDBDHM
CC(=O)NC1CCC(Nc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1	ZINC000735473560	592984310	/nfs/dbraw/zinc/98/43/10/592984310.db2.gz	AIZVNTLNACCIMX-UHFFFAOYSA-N	-1	3	346.351	1.029	20	5		EDBDHM
COC1CCN(CCNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1	ZINC000821679567	593908899	/nfs/dbraw/zinc/90/88/99/593908899.db2.gz	CQGKXWZGCLURTH-UHFFFAOYSA-N	-1	3	347.379	1.298	20	5		EDBDHM
COCCOC[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C1	ZINC000821691695	593916455	/nfs/dbraw/zinc/91/64/55/593916455.db2.gz	AQVSLWJSRQOPIG-LLVKDONJSA-N	-1	3	348.363	1.264	20	5		EDBDHM
COCCOC[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C1	ZINC000821691695	593916457	/nfs/dbraw/zinc/91/64/57/593916457.db2.gz	AQVSLWJSRQOPIG-LLVKDONJSA-N	-1	3	348.363	1.264	20	5		EDBDHM
Cc1nc(NCCOc2ccc(-c3nnn[n-]3)cc2)ccc1[N+](=O)[O-]	ZINC000822452817	594050995	/nfs/dbraw/zinc/05/09/95/594050995.db2.gz	AJZSKKRTZLXROG-UHFFFAOYSA-N	-1	3	341.331	1.969	20	5		EDBDHM
Cc1nc(NCCOc2ccc(-c3nn[n-]n3)cc2)ccc1[N+](=O)[O-]	ZINC000822452817	594050997	/nfs/dbraw/zinc/05/09/97/594050997.db2.gz	AJZSKKRTZLXROG-UHFFFAOYSA-N	-1	3	341.331	1.969	20	5		EDBDHM
C[C@H](Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])c1nnc2n1CCC2	ZINC000824649515	594051035	/nfs/dbraw/zinc/05/10/35/594051035.db2.gz	NDAAVNULMPJXRR-QMMMGPOBSA-N	-1	3	341.335	1.486	20	5		EDBDHM
C[C@H](Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])c1nnc2n1CCC2	ZINC000824649515	594051036	/nfs/dbraw/zinc/05/10/36/594051036.db2.gz	NDAAVNULMPJXRR-QMMMGPOBSA-N	-1	3	341.335	1.486	20	5		EDBDHM
C[C@@H]1C[C@@H](CCNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)CCO1	ZINC000824883543	594090132	/nfs/dbraw/zinc/09/01/32/594090132.db2.gz	HZQOYTYJRNPMJH-ZJUUUORDSA-N	-1	3	333.352	1.787	20	5		EDBDHM
C[C@@H]1C[C@@H](CCNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)CCO1	ZINC000824883543	594090134	/nfs/dbraw/zinc/09/01/34/594090134.db2.gz	HZQOYTYJRNPMJH-ZJUUUORDSA-N	-1	3	333.352	1.787	20	5		EDBDHM
CCCN(CC(=O)OCC)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000825308174	594164122	/nfs/dbraw/zinc/16/41/22/594164122.db2.gz	XBINCNDUYXEEGQ-UHFFFAOYSA-N	-1	3	334.336	1.554	20	5		EDBDHM
CCCN(CC(=O)OCC)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000825308174	594164123	/nfs/dbraw/zinc/16/41/23/594164123.db2.gz	XBINCNDUYXEEGQ-UHFFFAOYSA-N	-1	3	334.336	1.554	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@H](CO)c2ccccc2)c(-c2nnn[n-]2)c1	ZINC000823640041	594223979	/nfs/dbraw/zinc/22/39/79/594223979.db2.gz	QEJVGTJGRDAKKI-GFCCVEGCSA-N	-1	3	340.343	1.963	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@H](CO)c2ccccc2)c(-c2nn[n-]n2)c1	ZINC000823640041	594223980	/nfs/dbraw/zinc/22/39/80/594223980.db2.gz	QEJVGTJGRDAKKI-GFCCVEGCSA-N	-1	3	340.343	1.963	20	5		EDBDHM
CN(CCc1nccs1)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000825950747	594289489	/nfs/dbraw/zinc/28/94/89/594289489.db2.gz	UCBXWECMKPBPNQ-UHFFFAOYSA-N	-1	3	331.361	1.910	20	5		EDBDHM
CN(CCc1nccs1)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000825950747	594289490	/nfs/dbraw/zinc/28/94/90/594289490.db2.gz	UCBXWECMKPBPNQ-UHFFFAOYSA-N	-1	3	331.361	1.910	20	5		EDBDHM
C[C@H]1C[C@H](NC(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CN1C1CC1	ZINC000828177377	594359333	/nfs/dbraw/zinc/35/93/33/594359333.db2.gz	PGTSFOCQLYNZSZ-CABZTGNLSA-N	-1	3	333.344	1.648	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N[C@H]1CCO[C@]2(CCOC2)C1	ZINC000826497869	594503007	/nfs/dbraw/zinc/50/30/07/594503007.db2.gz	XEEOELCNTXANGW-XHDPSFHLSA-N	-1	3	346.347	1.525	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N[C@H]1CCO[C@]2(CCOC2)C1	ZINC000826497869	594503008	/nfs/dbraw/zinc/50/30/08/594503008.db2.gz	XEEOELCNTXANGW-XHDPSFHLSA-N	-1	3	346.347	1.525	20	5		EDBDHM
Cc1cc(CNCCn2cc([N+](=O)[O-])cn2)cc(C)c1OCC(=O)[O-]	ZINC000832885781	594782915	/nfs/dbraw/zinc/78/29/15/594782915.db2.gz	SBVSFRAPBDMBAW-UHFFFAOYSA-N	-1	3	348.359	1.661	20	5		EDBDHM
Nc1ccc(C(=O)OCc2cc(=O)[n-]c(C3CC3)n2)cc1[N+](=O)[O-]	ZINC000837339425	595087824	/nfs/dbraw/zinc/08/78/24/595087824.db2.gz	WKXWWAJCJBMYTD-UHFFFAOYSA-N	-1	3	330.300	1.907	20	5		EDBDHM
COCC[C@@H](COC)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848588844	595411147	/nfs/dbraw/zinc/41/11/47/595411147.db2.gz	ASJXUEFRVDTWNS-JTQLQIEISA-N	-1	3	348.302	1.734	20	5		EDBDHM
CCN(C)C(=O)[C@@H](C)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848593126	595412558	/nfs/dbraw/zinc/41/25/58/595412558.db2.gz	YNXPPFVMLADXMY-SECBINFHSA-N	-1	3	345.302	1.549	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCOC(=O)N(C)C)c1C	ZINC000849446052	595527835	/nfs/dbraw/zinc/52/78/35/595527835.db2.gz	LRUUCIXXDDGYRD-UHFFFAOYSA-N	-1	3	345.377	1.188	20	5		EDBDHM
COc1ccc(OC)c([C@H](O)CNc2cc[n-]c(=O)c2[N+](=O)[O-])c1	ZINC000853153676	595683809	/nfs/dbraw/zinc/68/38/09/595683809.db2.gz	ADYXRQUCGQQFHW-GFCCVEGCSA-N	-1	3	335.316	1.858	20	5		EDBDHM
COC(=O)[C@@]1(C(F)(F)F)CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1	ZINC000853617441	595833569	/nfs/dbraw/zinc/83/35/69/595833569.db2.gz	ZIBLLKVYPRVYGM-LLVKDONJSA-N	-1	3	335.238	1.627	20	5		EDBDHM
CC(C)(CNc1cc[n-]c(=O)c1[N+](=O)[O-])[C@@H]1COCC12OCCO2	ZINC000853681560	595853712	/nfs/dbraw/zinc/85/37/12/595853712.db2.gz	FOBRWPXRPSBNKK-NSHDSACASA-N	-1	3	339.348	1.523	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N[C@H](CO)c1ccccc1	ZINC000738358682	599170274	/nfs/dbraw/zinc/17/02/74/599170274.db2.gz	OCCGXSDXGPTPQS-CYBMUJFWSA-N	-1	3	326.316	1.920	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N[C@H](CO)c1ccccc1	ZINC000738358682	599170277	/nfs/dbraw/zinc/17/02/77/599170277.db2.gz	OCCGXSDXGPTPQS-CYBMUJFWSA-N	-1	3	326.316	1.920	20	5		EDBDHM
CCN(CC[N-]S(=O)(=O)c1cc(F)c(C)cc1[N+](=O)[O-])C1CC1	ZINC000866708267	596303202	/nfs/dbraw/zinc/30/32/02/596303202.db2.gz	QKVCTTIAMLTYHZ-UHFFFAOYSA-N	-1	3	345.396	1.805	20	5		EDBDHM
CCOC1CC2(C[C@H]2[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000872656746	597013339	/nfs/dbraw/zinc/01/33/39/597013339.db2.gz	XJZRLNOTSHDYFX-KRBLXSNTSA-N	-1	3	332.403	1.892	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOC[C@H]2CCOC2)c(-c2nnn[n-]2)c1	ZINC000738371619	598594463	/nfs/dbraw/zinc/59/44/63/598594463.db2.gz	UQSJAEGVQKQZTJ-JTQLQIEISA-N	-1	3	334.336	1.240	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCCOC[C@H]2CCOC2)c(-c2nn[n-]n2)c1	ZINC000738371619	598594465	/nfs/dbraw/zinc/59/44/65/598594465.db2.gz	UQSJAEGVQKQZTJ-JTQLQIEISA-N	-1	3	334.336	1.240	20	5		EDBDHM
COCc1nc(Sc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)n[nH]1	ZINC000821696423	606792447	/nfs/dbraw/zinc/79/24/47/606792447.db2.gz	CLFJYPMGGWXWSO-UHFFFAOYSA-N	-1	3	334.321	1.191	20	5		EDBDHM
COCc1nc(Sc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)n[nH]1	ZINC000821696423	606792448	/nfs/dbraw/zinc/79/24/48/606792448.db2.gz	CLFJYPMGGWXWSO-UHFFFAOYSA-N	-1	3	334.321	1.191	20	5		EDBDHM
CCN(CC)[C@H](C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000055220375	214291165	/nfs/dbraw/zinc/29/11/65/214291165.db2.gz	BZXZXDKHRXYEAB-SNVBAGLBSA-N	-1	3	333.385	1.743	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]CC(F)(F)CO)c2ncccc12	ZINC000184297173	235359604	/nfs/dbraw/zinc/35/96/04/235359604.db2.gz	FEKVCNSFSBLJEC-UHFFFAOYSA-N	-1	3	347.299	1.049	20	5		EDBDHM
NC(=O)c1nn[n-]c1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1	ZINC000362405741	283395880	/nfs/dbraw/zinc/39/58/80/283395880.db2.gz	YJLQQGAGELYFTG-UHFFFAOYSA-N	-1	3	332.301	1.279	20	5		EDBDHM
NC(=O)c1[n-]nnc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1	ZINC000362405741	283395882	/nfs/dbraw/zinc/39/58/82/283395882.db2.gz	YJLQQGAGELYFTG-UHFFFAOYSA-N	-1	3	332.301	1.279	20	5		EDBDHM
NC(=O)c1n[n-]nc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1	ZINC000362405741	283395884	/nfs/dbraw/zinc/39/58/84/283395884.db2.gz	YJLQQGAGELYFTG-UHFFFAOYSA-N	-1	3	332.301	1.279	20	5		EDBDHM
O=C([O-])c1cc(N2CCN(C[C@@H]3CCOC3)CC2)ccc1[N+](=O)[O-]	ZINC000566071920	306398024	/nfs/dbraw/zinc/39/80/24/306398024.db2.gz	RFQCVUUNTWOEFA-LBPRGKRZSA-N	-1	3	335.360	1.452	20	5		EDBDHM
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccc(-c2nnn[n-]2)c1	ZINC000020497574	212140815	/nfs/dbraw/zinc/14/08/15/212140815.db2.gz	QULARVARKDFQOU-UHFFFAOYSA-N	-1	3	340.299	1.792	20	5		EDBDHM
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccc(-c2nn[n-]n2)c1	ZINC000020497574	212140816	/nfs/dbraw/zinc/14/08/16/212140816.db2.gz	QULARVARKDFQOU-UHFFFAOYSA-N	-1	3	340.299	1.792	20	5		EDBDHM
CCn1cnnc1C[N-]S(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C	ZINC000267130451	139584329	/nfs/dbraw/zinc/58/43/29/139584329.db2.gz	CJRZRMPJBAYHJN-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
COC(=O)C(C)(C)[N-]S(=O)(=O)CCc1ccccc1[N+](=O)[O-]	ZINC000270950413	140205831	/nfs/dbraw/zinc/20/58/31/140205831.db2.gz	VHEGFHFUCGBTME-UHFFFAOYSA-N	-1	3	330.362	1.008	20	5		EDBDHM
CS(=O)(=O)c1cc([N+](=O)[O-])c([N-][C@@H]2CCCCNC2=O)s1	ZINC000271139819	140244759	/nfs/dbraw/zinc/24/47/59/140244759.db2.gz	CEFSLKMQHYFMRE-SSDOTTSWSA-N	-1	3	333.391	1.140	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CCO[C@H](C)C1	ZINC000271303818	140274520	/nfs/dbraw/zinc/27/45/20/140274520.db2.gz	WXRJAYLGTUBSFZ-GHMZBOCLSA-N	-1	3	344.389	1.697	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)[C@@H]1CCCCO1	ZINC000272048300	140392589	/nfs/dbraw/zinc/39/25/89/140392589.db2.gz	MQQGVIUJHIOFGI-JQWIXIFHSA-N	-1	3	344.389	1.839	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C(C)(C)C(C)(C)O	ZINC000272070592	140395877	/nfs/dbraw/zinc/39/58/77/140395877.db2.gz	QVOQWAVTZWKFTK-UHFFFAOYSA-N	-1	3	332.378	1.431	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC2([C@H](O)C(C)C)CC2)c([N+](=O)[O-])c1	ZINC000332122063	141126892	/nfs/dbraw/zinc/12/68/92/141126892.db2.gz	HSYJPCKDHBPVML-CQSZACIVSA-N	-1	3	342.417	1.979	20	5		EDBDHM
C[C@@H]1CN(Cc2cc([O-])ccc2[N+](=O)[O-])CC[C@@H]1N1CCN(C)CC1	ZINC000332403328	141176241	/nfs/dbraw/zinc/17/62/41/141176241.db2.gz	VLWBSEWFFXEBHL-PBHICJAKSA-N	-1	3	348.447	1.758	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCC(=O)OC(C)C)c1[N+](=O)[O-]	ZINC000358058954	292087589	/nfs/dbraw/zinc/08/75/89/292087589.db2.gz	QIWPDXNBCZMGLL-UHFFFAOYSA-N	-1	3	344.389	1.832	20	5		EDBDHM
O=C(Nc1cccc(OCC(F)F)n1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000345436002	143090926	/nfs/dbraw/zinc/09/09/26/143090926.db2.gz	BXZJZZPCBCSFKJ-UHFFFAOYSA-N	-1	3	340.242	1.987	20	5		EDBDHM
CCOc1ccc(C(=O)Nc2nc(CC(=O)OC)n[n-]2)cc1[N+](=O)[O-]	ZINC000345540424	143103475	/nfs/dbraw/zinc/10/34/75/143103475.db2.gz	IAMFUNKZCMGJSK-UHFFFAOYSA-N	-1	3	349.303	1.079	20	5		EDBDHM
CCOc1ccc(C(=O)Nc2nnc(CC(=O)OC)[n-]2)cc1[N+](=O)[O-]	ZINC000345540424	143103476	/nfs/dbraw/zinc/10/34/76/143103476.db2.gz	IAMFUNKZCMGJSK-UHFFFAOYSA-N	-1	3	349.303	1.079	20	5		EDBDHM
CCOc1ccc(C(=O)Nc2n[n-]c(CC(=O)OC)n2)cc1[N+](=O)[O-]	ZINC000345540424	143103477	/nfs/dbraw/zinc/10/34/77/143103477.db2.gz	IAMFUNKZCMGJSK-UHFFFAOYSA-N	-1	3	349.303	1.079	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H](CCO)c2ccco2)cc1[N+](=O)[O-]	ZINC000345629972	143114148	/nfs/dbraw/zinc/11/41/48/143114148.db2.gz	SKPYIJJIJWMHOU-VIFPVBQESA-N	-1	3	346.386	1.960	20	5		EDBDHM
COC(=O)Cc1n[n-]c(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)n1	ZINC000346249930	143183580	/nfs/dbraw/zinc/18/35/80/143183580.db2.gz	JDRKBUQKUDJELK-UHFFFAOYSA-N	-1	3	339.695	1.334	20	5		EDBDHM
COC(=O)Cc1nnc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)[n-]1	ZINC000346249930	143183581	/nfs/dbraw/zinc/18/35/81/143183581.db2.gz	JDRKBUQKUDJELK-UHFFFAOYSA-N	-1	3	339.695	1.334	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)[C@H](O)C(C)C	ZINC000416610574	304337827	/nfs/dbraw/zinc/33/78/27/304337827.db2.gz	BGCUKYVNHQDGQN-SMDDNHRTSA-N	-1	3	346.405	1.677	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)N1CCC(C)CC1	ZINC000361131588	152316154	/nfs/dbraw/zinc/31/61/54/152316154.db2.gz	KHALEEOPAHOBDT-UHFFFAOYSA-N	-1	3	329.378	1.992	20	5		EDBDHM
O=C(c1ccc(O)cc1[O-])N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000364999155	153394680	/nfs/dbraw/zinc/39/46/80/153394680.db2.gz	DKXSFOPJXFBEJT-UHFFFAOYSA-N	-1	3	330.296	1.909	20	5		EDBDHM
Cc1cnn([C@@H]2CCCN(C(=O)c3cc(C)[n-]c(=O)c3[N+](=O)[O-])C2)c1	ZINC000367395905	154104542	/nfs/dbraw/zinc/10/45/42/154104542.db2.gz	ZVJADPGIGNLCII-GFCCVEGCSA-N	-1	3	345.359	1.986	20	5		EDBDHM
O=C(Nc1ccc2c(c1)N[C@H](CO)CO2)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000367638885	154208150	/nfs/dbraw/zinc/20/81/50/154208150.db2.gz	RMPZDVNSPKTYSZ-SNVBAGLBSA-N	-1	3	346.299	1.113	20	5		EDBDHM
COCC[C@@H](COC)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000352528538	162231710	/nfs/dbraw/zinc/23/17/10/162231710.db2.gz	CHANBNOGZDLFNG-VIFPVBQESA-N	-1	3	336.341	1.064	20	5		EDBDHM
COCCNC(=O)Cn1cc([N-]c2nccc(C)c2[N+](=O)[O-])cn1	ZINC000266196639	273019850	/nfs/dbraw/zinc/01/98/50/273019850.db2.gz	CQOIREFNGWDYPW-UHFFFAOYSA-N	-1	3	334.336	1.001	20	5		EDBDHM
CCCCCS(=O)(=O)[N-][C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000273590138	268060412	/nfs/dbraw/zinc/06/04/12/268060412.db2.gz	ISPKBWWGUIMTCX-ZIAGYGMSSA-N	-1	3	346.405	1.099	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)[C@H](C)OC	ZINC000276057335	273144830	/nfs/dbraw/zinc/14/48/30/273144830.db2.gz	IHKCAQKDNGBYPX-IUCAKERBSA-N	-1	3	346.361	1.083	20	5		EDBDHM
CC(C)N1CCC[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000280681332	273385122	/nfs/dbraw/zinc/38/51/22/273385122.db2.gz	ZJISRAQIGSQATH-LLVKDONJSA-N	-1	3	345.396	1.885	20	5		EDBDHM
CCCN(CCC)C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000280725321	273390813	/nfs/dbraw/zinc/39/08/13/273390813.db2.gz	HVAKGAHIMIFHFL-UHFFFAOYSA-N	-1	3	343.405	1.522	20	5		EDBDHM
COCC[C@H](COC)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000352523704	292693485	/nfs/dbraw/zinc/69/34/85/292693485.db2.gz	UAPRRJRJVHWAPH-LLVKDONJSA-N	-1	3	332.378	1.233	20	5		EDBDHM
Cc1nc([C@@H]2CCCCN2C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)n[nH]1	ZINC000367297592	293365090	/nfs/dbraw/zinc/36/50/90/293365090.db2.gz	CUYWFWUVSGXBHW-JTQLQIEISA-N	-1	3	332.320	1.489	20	5		EDBDHM
O=[N+]([O-])c1cccc(CS(=O)(=O)[N-][C@@H]2CNCCC2(F)F)c1	ZINC000420448096	304759731	/nfs/dbraw/zinc/75/97/31/304759731.db2.gz	QSWRZUAOGLASEY-LLVKDONJSA-N	-1	3	335.332	1.011	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CCC(=O)NC1(C)C	ZINC000338426964	302049739	/nfs/dbraw/zinc/04/97/39/302049739.db2.gz	RHNOWXGGJOVUMI-NSHDSACASA-N	-1	3	341.389	1.239	20	5		EDBDHM
Cc1nc([N-]C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)nn1C	ZINC000293768187	303015745	/nfs/dbraw/zinc/01/57/45/303015745.db2.gz	VAWBUGZFUPWSSE-UHFFFAOYSA-N	-1	3	334.292	1.809	20	5		EDBDHM
O=C(c1ccc(O)cc1[O-])N1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000296860581	303342588	/nfs/dbraw/zinc/34/25/88/303342588.db2.gz	GNEXEEYIYBVXBY-UHFFFAOYSA-N	-1	3	344.327	1.363	20	5		EDBDHM
CCc1[nH]nc(C(=O)Nc2c(C)ccc(C(=O)OC)c2[O-])c1[N+](=O)[O-]	ZINC000436510758	305159154	/nfs/dbraw/zinc/15/91/54/305159154.db2.gz	OECAQTVFUIAFHS-UHFFFAOYSA-N	-1	3	348.315	1.933	20	5		EDBDHM
CCc1nc(C(C)(C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)no1	ZINC000443153498	305236015	/nfs/dbraw/zinc/23/60/15/305236015.db2.gz	LTQZOLPTBJHKKC-UHFFFAOYSA-N	-1	3	340.361	1.754	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)[C@H](OC)C1CC1	ZINC000451981559	305376032	/nfs/dbraw/zinc/37/60/32/305376032.db2.gz	FADKCHRJLKOJBG-OTYXRUKQSA-N	-1	3	344.389	1.695	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCCOCC2)cc1[N+](=O)[O-]	ZINC000493739544	305625145	/nfs/dbraw/zinc/62/51/45/305625145.db2.gz	SAOAJWZADSONLR-SECBINFHSA-N	-1	3	348.352	1.590	20	5		EDBDHM
CCOC(=O)c1sc([N-]C(=O)c2c[nH]nc2[N+](=O)[O-])nc1C	ZINC000549157810	306145032	/nfs/dbraw/zinc/14/50/32/306145032.db2.gz	PBOLCIHLAWLJBV-UHFFFAOYSA-N	-1	3	325.306	1.512	20	5		EDBDHM
Cc1c(CC(=O)N2CCC[C@@H]2c2nc(=N)n(C)[n-]2)cccc1[N+](=O)[O-]	ZINC000550117137	306150929	/nfs/dbraw/zinc/15/09/29/306150929.db2.gz	UULVKPXYPDYWQO-CYBMUJFWSA-N	-1	3	344.375	1.350	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]c2cn(C)c(=O)cc2C)c([N+](=O)[O-])c1	ZINC000080310354	441160884	/nfs/dbraw/zinc/16/08/84/441160884.db2.gz	VULUZFJVRTXWDD-UHFFFAOYSA-N	-1	3	337.357	1.711	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C[C@@H]1CCN(C2CC2)C1	ZINC000073842146	441359618	/nfs/dbraw/zinc/35/96/18/441359618.db2.gz	ZERPHXSZEJOJDE-NSHDSACASA-N	-1	3	325.390	1.357	20	5		EDBDHM
CN(C)c1ncccc1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000032437910	441557233	/nfs/dbraw/zinc/55/72/33/441557233.db2.gz	FRXQBWPNNQQWEA-UHFFFAOYSA-N	-1	3	336.373	1.534	20	5		EDBDHM
CC[C@H](CCO)C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000121464467	441709845	/nfs/dbraw/zinc/70/98/45/441709845.db2.gz	XFDYMWSJXJTRHN-GFCCVEGCSA-N	-1	3	330.406	1.899	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H]2CC[C@@H](CO)CC2)cc1[N+](=O)[O-]	ZINC000125768320	442045794	/nfs/dbraw/zinc/04/57/94/442045794.db2.gz	HACHBDYHVFBXFF-MGCOHNPYSA-N	-1	3	334.419	1.794	20	5		EDBDHM
O=C(Nc1cnn(Cc2ccncc2)c1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000193501704	442748443	/nfs/dbraw/zinc/74/84/43/442748443.db2.gz	LXMYKCLKTYGCIW-UHFFFAOYSA-N	-1	3	340.299	1.588	20	5		EDBDHM
C[C@H]1CCCCN1CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000193880641	442804514	/nfs/dbraw/zinc/80/45/14/442804514.db2.gz	BJZHEJYFLKZQQR-NSHDSACASA-N	-1	3	345.396	1.887	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000266242280	443071327	/nfs/dbraw/zinc/07/13/27/443071327.db2.gz	WIFPKEWXLYWYJR-UWVGGRQHSA-N	-1	3	330.362	1.307	20	5		EDBDHM
COc1cc(CNc2nnc(-c3nccn3C)o2)c([N+](=O)[O-])cc1[O-]	ZINC000191133655	443246342	/nfs/dbraw/zinc/24/63/42/443246342.db2.gz	BJSCALWKWLUPPH-UHFFFAOYSA-N	-1	3	346.303	1.705	20	5		EDBDHM
Cc1cc(-c2noc([C@@H](C)[N-]S(C)(=O)=O)n2)cc([N+](=O)[O-])c1	ZINC000351148711	319094516	/nfs/dbraw/zinc/09/45/16/319094516.db2.gz	QITXXDWXSPRLSB-MRVPVSSYSA-N	-1	3	326.334	1.563	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CCC[C@H]1O	ZINC000269295967	443271114	/nfs/dbraw/zinc/27/11/14/443271114.db2.gz	NQUKOULHPUZJLK-GXSJLCMTSA-N	-1	3	330.362	1.043	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCCC[C@H]1CO	ZINC000269293933	443270128	/nfs/dbraw/zinc/27/01/28/443270128.db2.gz	MTRKRQBISOGDKV-CMPLNLGQSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC[C@@H]1CCCCO1	ZINC000272439255	443316643	/nfs/dbraw/zinc/31/66/43/443316643.db2.gz	QRAKDXKOIMJOLP-LBPRGKRZSA-N	-1	3	344.389	1.841	20	5		EDBDHM
CCN1CCN([C@@H]2CCN(C(=O)c3cc([O-])cc([N+](=O)[O-])c3)C2)CC1	ZINC000272537705	443355278	/nfs/dbraw/zinc/35/52/78/443355278.db2.gz	NMMPDLQVNLPWJM-CQSZACIVSA-N	-1	3	348.403	1.152	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]Cc2nncn2C)c1	ZINC000272580237	443371178	/nfs/dbraw/zinc/37/11/78/443371178.db2.gz	YAQKPYZFCMKVHH-UHFFFAOYSA-N	-1	3	345.768	1.164	20	5		EDBDHM
CCOc1cc(CN2CCC[C@@]3(C2)NC(=O)[N-]C3=O)ccc1[N+](=O)[O-]	ZINC000279103222	443514628	/nfs/dbraw/zinc/51/46/28/443514628.db2.gz	REVCZMNOEAZVNX-INIZCTEOSA-N	-1	3	348.359	1.168	20	5		EDBDHM
CCc1nc([C@H](C)[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)n[nH]1	ZINC000273994926	443591005	/nfs/dbraw/zinc/59/10/05/443591005.db2.gz	SCFSKJZTVPYXKO-QMMMGPOBSA-N	-1	3	325.350	1.315	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1(C)CCOCC1	ZINC000267820302	443587988	/nfs/dbraw/zinc/58/79/88/443587988.db2.gz	RFOXTCRROKZOGM-UHFFFAOYSA-N	-1	3	344.389	1.698	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H](C)c2ncn(C)n2)c([N+](=O)[O-])c1	ZINC000444230695	320121739	/nfs/dbraw/zinc/12/17/39/320121739.db2.gz	ZXKRYHRDRUJGRP-VIFPVBQESA-N	-1	3	325.350	1.071	20	5		EDBDHM
Cc1nnc(C[N-]S(=O)(=O)Cc2ccccc2[N+](=O)[O-])s1	ZINC000546074595	320808684	/nfs/dbraw/zinc/80/86/84/320808684.db2.gz	CPFDZHREYUDHCM-UHFFFAOYSA-N	-1	3	328.375	1.374	20	5		EDBDHM
O=C([O-])C[C@H]1CSCCN1CCOc1ccc([N+](=O)[O-])cc1	ZINC000565105331	321169461	/nfs/dbraw/zinc/16/94/61/321169461.db2.gz	VJLGBECLVQGHKY-LBPRGKRZSA-N	-1	3	326.374	1.866	20	5		EDBDHM
O=c1nc([C@H]2CCCN(CCOc3ccccc3[N+](=O)[O-])C2)[nH][n-]1	ZINC000289393183	444128477	/nfs/dbraw/zinc/12/84/77/444128477.db2.gz	KGRFAHKMTVGYRV-NSHDSACASA-N	-1	3	333.348	1.265	20	5		EDBDHM
COc1cc(C(=O)[N-]c2nncn2C2CC2)c([N+](=O)[O-])cc1OC	ZINC000286021787	444178665	/nfs/dbraw/zinc/17/86/65/444178665.db2.gz	ZPBVXGYHIQPIFB-UHFFFAOYSA-N	-1	3	333.304	1.791	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])[C@@H](O)CC	ZINC000313102903	444295560	/nfs/dbraw/zinc/29/55/60/444295560.db2.gz	GMLYQXNPSXHHLX-PWSUYJOCSA-N	-1	3	332.378	1.431	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1CCC[C@@H](O)C1	ZINC000323724087	444345706	/nfs/dbraw/zinc/34/57/06/444345706.db2.gz	OKAUKTUUBTZZHP-ZYHUDNBSSA-N	-1	3	344.389	1.433	20	5		EDBDHM
CC1CCC(O)(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000321395160	444335743	/nfs/dbraw/zinc/33/57/43/444335743.db2.gz	XDJWEPMBOMBNLR-UHFFFAOYSA-N	-1	3	346.380	1.953	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@@H](C)Cn2cccn2)c([N+](=O)[O-])c1	ZINC000337805921	444415906	/nfs/dbraw/zinc/41/59/06/444415906.db2.gz	KTZBBCIPYRFQKK-GFCCVEGCSA-N	-1	3	338.389	1.714	20	5		EDBDHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2ccnc(-c3cncs3)n2)n1	ZINC000344081594	444771002	/nfs/dbraw/zinc/77/10/02/444771002.db2.gz	CKNWUTIFVCMZOO-UHFFFAOYSA-N	-1	3	345.344	1.977	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CCO[C@@H](C)C1	ZINC000330614152	445061659	/nfs/dbraw/zinc/06/16/59/445061659.db2.gz	ZULCJKGUNMHUAB-UWVGGRQHSA-N	-1	3	330.362	1.449	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCC[N-]S(=O)(=O)c2cncc(F)c2)cc1	ZINC000339173777	445072922	/nfs/dbraw/zinc/07/29/22/445072922.db2.gz	ROIPSSYIGFFCFW-UHFFFAOYSA-N	-1	3	340.336	1.519	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])Nc1ccsc1	ZINC000343459133	445226727	/nfs/dbraw/zinc/22/67/27/445226727.db2.gz	YUKGUAQHEDTASX-UHFFFAOYSA-N	-1	3	341.370	1.573	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1)[C@H](O)C(F)(F)F	ZINC000354628154	445320065	/nfs/dbraw/zinc/32/00/65/445320065.db2.gz	SHEDPXSHUFMGLD-ZJUUUORDSA-N	-1	3	342.295	1.575	20	5		EDBDHM
CCCC[C@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C(=O)OC	ZINC000354660772	445330636	/nfs/dbraw/zinc/33/06/36/445330636.db2.gz	HYDQFDRQHOQFDT-NSHDSACASA-N	-1	3	344.389	1.913	20	5		EDBDHM
O=C([N-]c1nc2ccccn2n1)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000353365739	445590504	/nfs/dbraw/zinc/59/05/04/445590504.db2.gz	JHGGUIYUAWTWHO-UHFFFAOYSA-N	-1	3	327.256	1.619	20	5		EDBDHM
COCCOCCCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000355960037	445546202	/nfs/dbraw/zinc/54/62/02/445546202.db2.gz	ZLFNJWKHHHKWOA-UHFFFAOYSA-N	-1	3	332.378	1.316	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@]2(C)CCOC2)c1[N+](=O)[O-]	ZINC000360228679	445642246	/nfs/dbraw/zinc/64/22/46/445642246.db2.gz	UZELTVNFTZQDRK-AWEZNQCLSA-N	-1	3	328.390	1.917	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1[C@@H]2CCC[C@@H]21	ZINC000362974075	445634621	/nfs/dbraw/zinc/63/46/21/445634621.db2.gz	YNLQAGQLZCCPOF-IWIIMEHWSA-N	-1	3	340.357	1.458	20	5		EDBDHM
CN(C)CCOC1CCN(C(=O)c2cc([O-])cc([N+](=O)[O-])c2)CC1	ZINC000356224595	445684405	/nfs/dbraw/zinc/68/44/05/445684405.db2.gz	OVOCJJDUVWBZRJ-UHFFFAOYSA-N	-1	3	337.376	1.483	20	5		EDBDHM
O=C(Nc1ccn(-c2ccccc2)n1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000361914348	446063318	/nfs/dbraw/zinc/06/33/18/446063318.db2.gz	BGPJDNMHJBTBHC-UHFFFAOYSA-N	-1	3	325.284	2.133	20	5		EDBDHM
Cc1nnc([C@@H]2CCCCN2C(=O)c2cc(C)[n-]c(=O)c2[N+](=O)[O-])[nH]1	ZINC000368303948	446770931	/nfs/dbraw/zinc/77/09/31/446770931.db2.gz	JERKHKXVQBFNNL-NSHDSACASA-N	-1	3	346.347	1.798	20	5		EDBDHM
Cc1nc([C@@H]2CCCCN2C(=O)c2cc(C)[n-]c(=O)c2[N+](=O)[O-])n[nH]1	ZINC000368303948	446770936	/nfs/dbraw/zinc/77/09/36/446770936.db2.gz	JERKHKXVQBFNNL-NSHDSACASA-N	-1	3	346.347	1.798	20	5		EDBDHM
Cn1ncc([N+](=O)[O-])c1C(=O)[N-]c1ccc(-c2nc[nH]n2)cc1F	ZINC000619252845	450435406	/nfs/dbraw/zinc/43/54/06/450435406.db2.gz	OTJIDFHMMAOFGO-UHFFFAOYSA-N	-1	3	331.267	1.505	20	5		EDBDHM
CC[C@H](C)[C@@](C)(O)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000443303000	447028228	/nfs/dbraw/zinc/02/82/28/447028228.db2.gz	QOIQUVDMQAMOPJ-HZMBPMFUSA-N	-1	3	346.405	1.679	20	5		EDBDHM
CCN(CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(C)C	ZINC000444164116	447083415	/nfs/dbraw/zinc/08/34/15/447083415.db2.gz	CUDDMXWZPDUIPZ-UHFFFAOYSA-N	-1	3	333.385	1.743	20	5		EDBDHM
Cc1cc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)nn1[C@@H](C)C1CC1	ZINC000445164736	447176320	/nfs/dbraw/zinc/17/63/20/447176320.db2.gz	WFNJBBYDTILRRZ-VIFPVBQESA-N	-1	3	331.332	2.424	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C2(C(=O)N(C)C)CC2)cc1C	ZINC000416587460	447654887	/nfs/dbraw/zinc/65/48/87/447654887.db2.gz	LAYATAJRECZKRR-UHFFFAOYSA-N	-1	3	341.389	1.111	20	5		EDBDHM
COC(=O)[C@H](C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])CC1CC1	ZINC000576996403	448188481	/nfs/dbraw/zinc/18/84/81/448188481.db2.gz	GJJOZODBOZTMQO-NSHDSACASA-N	-1	3	342.373	1.462	20	5		EDBDHM
O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cc(=O)[n-]c(C2CC2)n1	ZINC000566436053	448469251	/nfs/dbraw/zinc/46/92/51/448469251.db2.gz	XRGATJKIZQSZFN-UHFFFAOYSA-N	-1	3	328.328	1.940	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@H](CO)CC1CC1	ZINC000611109807	449171349	/nfs/dbraw/zinc/17/13/49/449171349.db2.gz	HPELUIKTNNXKJR-JTQLQIEISA-N	-1	3	334.781	1.688	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCCN(C)C2)cc1C	ZINC000604278235	449200373	/nfs/dbraw/zinc/20/03/73/449200373.db2.gz	XATPVZOQHLFKBV-LBPRGKRZSA-N	-1	3	327.406	1.584	20	5		EDBDHM
CCOC(=O)CCC[N-]S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F	ZINC000590588079	449204280	/nfs/dbraw/zinc/20/42/80/449204280.db2.gz	AJSDYHGYUPJWRS-UHFFFAOYSA-N	-1	3	348.352	1.664	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]Cc2cccnc2)c(F)cc1[N+](=O)[O-]	ZINC000590590251	449205535	/nfs/dbraw/zinc/20/55/35/449205535.db2.gz	WWIOBPJSEXBUJE-UHFFFAOYSA-N	-1	3	325.321	1.916	20	5		EDBDHM
O=C([N-]c1nn2cnnc2s1)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000611521746	449319318	/nfs/dbraw/zinc/31/93/18/449319318.db2.gz	ZGDDCCYOFQYQFU-UHFFFAOYSA-N	-1	3	334.273	1.075	20	5		EDBDHM
O=C(C1CCCCC1)N1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596092442	449359710	/nfs/dbraw/zinc/35/97/10/449359710.db2.gz	AYQAXRXUSKDVBK-UHFFFAOYSA-N	-1	3	334.376	1.924	20	5		EDBDHM
C[C@@H]1CCCC[C@H]1OCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593532233	449329128	/nfs/dbraw/zinc/32/91/28/449329128.db2.gz	ZIFLGXLCAQPWBQ-DGCLKSJQSA-N	-1	3	343.405	1.863	20	5		EDBDHM
O=C(NCC(F)(F)F)[C@H]1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1	ZINC000596200922	449410330	/nfs/dbraw/zinc/41/03/30/449410330.db2.gz	QOLBICINEGVKSR-ZETCQYMHSA-N	-1	3	334.254	1.200	20	5		EDBDHM
O=c1[n-]ccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000596248870	449438210	/nfs/dbraw/zinc/43/82/10/449438210.db2.gz	MJTREZORXVMITA-WBMJQRKESA-N	-1	3	333.319	2.000	20	5		EDBDHM
COCC1(C[N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])CC1	ZINC000594476815	449543152	/nfs/dbraw/zinc/54/31/52/449543152.db2.gz	UXOLFYYTWBTLBL-UHFFFAOYSA-N	-1	3	328.390	1.917	20	5		EDBDHM
C[C@H]1CCC[C@H](C)N1CC[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594754536	449669156	/nfs/dbraw/zinc/66/91/56/449669156.db2.gz	LWXMIRASELAORI-RYUDHWBXSA-N	-1	3	342.421	1.531	20	5		EDBDHM
CC(C)N1CCC[C@@H]([N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])C1	ZINC000594767109	449680804	/nfs/dbraw/zinc/68/08/04/449680804.db2.gz	LRJSKQYRUSMHQM-LLVKDONJSA-N	-1	3	328.394	1.141	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-])[C@@H](C)O	ZINC000594778999	449690560	/nfs/dbraw/zinc/69/05/60/449690560.db2.gz	HAPDUJIVFCODKJ-KOLCDFICSA-N	-1	3	339.373	1.581	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-])N(C)C	ZINC000594779682	449691755	/nfs/dbraw/zinc/69/17/55/449691755.db2.gz	YPAFEDOOWLEVRG-JTQLQIEISA-N	-1	3	338.389	1.371	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])NC1CCCC1	ZINC000612674465	449828170	/nfs/dbraw/zinc/82/81/70/449828170.db2.gz	MUOYXZOQCMQJPJ-UHFFFAOYSA-N	-1	3	341.389	1.073	20	5		EDBDHM
CC1(C)OC[C@@H]2C[C@@]21[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000599397984	449944301	/nfs/dbraw/zinc/94/43/01/449944301.db2.gz	WQBHMNMNPNENNA-ISVAXAHUSA-N	-1	3	330.337	1.580	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CC2(N(C)C)CCC2)c([N+](=O)[O-])s1	ZINC000601399015	449914900	/nfs/dbraw/zinc/91/49/00/449914900.db2.gz	KEKCLYQEVATUHV-UHFFFAOYSA-N	-1	3	333.435	1.727	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1C[C@H]1C(F)(F)F	ZINC000601522717	450045259	/nfs/dbraw/zinc/04/52/59/450045259.db2.gz	RKDRBKQBXZXMTF-HTQZYQBOSA-N	-1	3	340.279	1.833	20	5		EDBDHM
Cc1noc(CN2CCN(C(=O)c3cccc([O-])c3)CC2)c1[N+](=O)[O-]	ZINC000595375314	450088458	/nfs/dbraw/zinc/08/84/58/450088458.db2.gz	BNKOHVSJJDYIQM-UHFFFAOYSA-N	-1	3	346.343	1.555	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)C[C@H]1CCOC1	ZINC000610739746	450317918	/nfs/dbraw/zinc/31/79/18/450317918.db2.gz	NOCAHLRNDIVODE-WDEREUQCSA-N	-1	3	344.389	1.697	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)c2cccc([N+](=O)[O-])c2OC)[n-]1	ZINC000619448036	450476626	/nfs/dbraw/zinc/47/66/26/450476626.db2.gz	ZQMRGOKZVXNBJM-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)c2cccc([N+](=O)[O-])c2OC)c[n-]1	ZINC000619448036	450476629	/nfs/dbraw/zinc/47/66/29/450476629.db2.gz	ZQMRGOKZVXNBJM-UHFFFAOYSA-N	-1	3	334.288	1.756	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H]1CCC[C@@H]1CCO	ZINC000619498146	450492491	/nfs/dbraw/zinc/49/24/91/450492491.db2.gz	DFZJGRINSPLMEK-MNOVXSKESA-N	-1	3	344.389	1.433	20	5		EDBDHM
O=C(c1ccccc1[O-])N1CCN(c2ncc([N+](=O)[O-])s2)CC1	ZINC000190315601	534749313	/nfs/dbraw/zinc/74/93/13/534749313.db2.gz	PMNLUVJKNFLSNF-UHFFFAOYSA-N	-1	3	334.357	1.719	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1C[N-]S(=O)(=O)Cc1ccon1	ZINC000266264268	536956082	/nfs/dbraw/zinc/95/60/82/536956082.db2.gz	ZRYKRGPSCCIVLW-UHFFFAOYSA-N	-1	3	327.318	1.211	20	5		EDBDHM
COC(=O)c1ccc(CNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)o1	ZINC000736947250	579034379	/nfs/dbraw/zinc/03/43/79/579034379.db2.gz	HNSQFJGHKMOIAM-UHFFFAOYSA-N	-1	3	344.287	1.767	20	5		EDBDHM
COC(=O)c1ccc(CNc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)o1	ZINC000736947250	579034380	/nfs/dbraw/zinc/03/43/80/579034380.db2.gz	HNSQFJGHKMOIAM-UHFFFAOYSA-N	-1	3	344.287	1.767	20	5		EDBDHM
Cc1cnn(C2CN(c3ccc([N+](=O)[O-])cc3-c3nnn[n-]3)C2)c1	ZINC000737441857	579091555	/nfs/dbraw/zinc/09/15/55/579091555.db2.gz	CQNAMCOQNXBGRM-UHFFFAOYSA-N	-1	3	326.320	1.341	20	5		EDBDHM
Cc1cnn(C2CN(c3ccc([N+](=O)[O-])cc3-c3nn[n-]n3)C2)c1	ZINC000737441857	579091556	/nfs/dbraw/zinc/09/15/56/579091556.db2.gz	CQNAMCOQNXBGRM-UHFFFAOYSA-N	-1	3	326.320	1.341	20	5		EDBDHM
Cc1c(CO)cc([N+](=O)[O-])c([N-][C@H](C)c2ncn(C)n2)c1[N+](=O)[O-]	ZINC000780616095	580528944	/nfs/dbraw/zinc/52/89/44/580528944.db2.gz	JDOFVBUVNCEQDU-MRVPVSSYSA-N	-1	3	336.308	1.605	20	5		EDBDHM
Cc1c(NC(=O)[N-]OCCO)cc(Br)cc1[N+](=O)[O-]	ZINC000797683223	580979068	/nfs/dbraw/zinc/97/90/68/580979068.db2.gz	HPLGWZBIXFYRCC-UHFFFAOYSA-N	-1	3	334.126	1.711	20	5		EDBDHM
Cc1c(NC([O-])=NOCCO)cc(Br)cc1[N+](=O)[O-]	ZINC000797683223	580979067	/nfs/dbraw/zinc/97/90/67/580979067.db2.gz	HPLGWZBIXFYRCC-UHFFFAOYSA-N	-1	3	334.126	1.711	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2COC[C@@H]2C2CC2)c(F)cc1[N+](=O)[O-]	ZINC000908411609	592485380	/nfs/dbraw/zinc/48/53/80/592485380.db2.gz	SUYVDAYQARGHOF-PWSUYJOCSA-N	-1	3	344.364	1.746	20	5		EDBDHM
CC(C)[C@H]1OCC[C@H]1CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820047392	593786352	/nfs/dbraw/zinc/78/63/52/593786352.db2.gz	YKCKNUNUWWTJAG-JOYOIKCWSA-N	-1	3	333.352	1.643	20	5		EDBDHM
CC(C)[C@H]1OCC[C@H]1CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820047392	593786353	/nfs/dbraw/zinc/78/63/53/593786353.db2.gz	YKCKNUNUWWTJAG-JOYOIKCWSA-N	-1	3	333.352	1.643	20	5		EDBDHM
Cc1n[nH]c(C(=O)N[C@H](C)c2cccc(-c3nnn[n-]3)c2)c1[N+](=O)[O-]	ZINC000822010023	593981795	/nfs/dbraw/zinc/98/17/95/593981795.db2.gz	KMSNKLNKQATLLL-SSDOTTSWSA-N	-1	3	342.319	1.297	20	5		EDBDHM
Cc1n[nH]c(C(=O)N[C@H](C)c2cccc(-c3nn[n-]n3)c2)c1[N+](=O)[O-]	ZINC000822010023	593981797	/nfs/dbraw/zinc/98/17/97/593981797.db2.gz	KMSNKLNKQATLLL-SSDOTTSWSA-N	-1	3	342.319	1.297	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1OC(=O)c1cc(-c2nnn[n-]2)cn1C	ZINC000822271292	594022022	/nfs/dbraw/zinc/02/20/22/594022022.db2.gz	VOFFKXKUXHBWAV-UHFFFAOYSA-N	-1	3	328.288	1.641	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1OC(=O)c1cc(-c2nn[n-]n2)cn1C	ZINC000822271292	594022027	/nfs/dbraw/zinc/02/20/27/594022027.db2.gz	VOFFKXKUXHBWAV-UHFFFAOYSA-N	-1	3	328.288	1.641	20	5		EDBDHM
Cc1ncc(CCNc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)s1	ZINC000822467732	594053148	/nfs/dbraw/zinc/05/31/48/594053148.db2.gz	SEPVOWFNFPLMSB-UHFFFAOYSA-N	-1	3	332.349	1.589	20	5		EDBDHM
Cc1ncc(CCNc2ncc([N+](=O)[O-])cc2-c2nn[n-]n2)s1	ZINC000822467732	594053150	/nfs/dbraw/zinc/05/31/50/594053150.db2.gz	SEPVOWFNFPLMSB-UHFFFAOYSA-N	-1	3	332.349	1.589	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCOC[C@H]1c1ccco1	ZINC000823629808	594222996	/nfs/dbraw/zinc/22/29/96/594222996.db2.gz	HUOWXILJOLJLEW-ZDUSSCGKSA-N	-1	3	342.315	1.946	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCOC[C@H]1c1ccco1	ZINC000823629808	594222997	/nfs/dbraw/zinc/22/29/97/594222997.db2.gz	HUOWXILJOLJLEW-ZDUSSCGKSA-N	-1	3	342.315	1.946	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CC[C@]3(O)CCCC[C@@H]3C2)c(-c2nnn[n-]2)c1	ZINC000823639739	594223797	/nfs/dbraw/zinc/22/37/97/594223797.db2.gz	GSVKYYCAWAPJBS-BDJLRTHQSA-N	-1	3	344.375	1.906	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CC[C@]3(O)CCCC[C@@H]3C2)c(-c2nn[n-]n2)c1	ZINC000823639739	594223798	/nfs/dbraw/zinc/22/37/98/594223798.db2.gz	GSVKYYCAWAPJBS-BDJLRTHQSA-N	-1	3	344.375	1.906	20	5		EDBDHM
C[C@@H]1CN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C(=O)[O-]	ZINC000828462728	594427179	/nfs/dbraw/zinc/42/71/79/594427179.db2.gz	MGHBNOLDAUXJEO-ZWNOBZJWSA-N	-1	3	331.332	1.463	20	5		EDBDHM
Nc1ncc([N+](=O)[O-])cc1C(=O)OCc1cccc(-c2nnn[n-]2)c1	ZINC000826396327	594459330	/nfs/dbraw/zinc/45/93/30/594459330.db2.gz	SDYFNTAMKARDQW-UHFFFAOYSA-N	-1	3	341.287	1.109	20	5		EDBDHM
Nc1ncc([N+](=O)[O-])cc1C(=O)OCc1cccc(-c2nn[n-]n2)c1	ZINC000826396327	594459333	/nfs/dbraw/zinc/45/93/33/594459333.db2.gz	SDYFNTAMKARDQW-UHFFFAOYSA-N	-1	3	341.287	1.109	20	5		EDBDHM
O=C(c1ccc([N+](=O)[O-])o1)N1CCc2ccc(-c3nnn[n-]3)cc21	ZINC000826474049	594491292	/nfs/dbraw/zinc/49/12/92/594491292.db2.gz	YQCUBRNQFWBJSA-UHFFFAOYSA-N	-1	3	326.272	1.571	20	5		EDBDHM
O=C(c1ccc([N+](=O)[O-])o1)N1CCc2ccc(-c3nn[n-]n3)cc21	ZINC000826474049	594491293	/nfs/dbraw/zinc/49/12/93/594491293.db2.gz	YQCUBRNQFWBJSA-UHFFFAOYSA-N	-1	3	326.272	1.571	20	5		EDBDHM
O=C(c1ccccc1[N+](=O)[O-])N1CCc2ccc(-c3nnn[n-]3)cc21	ZINC000826474115	594491454	/nfs/dbraw/zinc/49/14/54/594491454.db2.gz	AQCYDAAYJPSEAB-UHFFFAOYSA-N	-1	3	336.311	1.978	20	5		EDBDHM
O=C(c1ccccc1[N+](=O)[O-])N1CCc2ccc(-c3nn[n-]n3)cc21	ZINC000826474115	594491456	/nfs/dbraw/zinc/49/14/56/594491456.db2.gz	AQCYDAAYJPSEAB-UHFFFAOYSA-N	-1	3	336.311	1.978	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCc2noc(C3CC3)n2)c(-c2nnn[n-]2)c1	ZINC000826498674	594502520	/nfs/dbraw/zinc/50/25/20/594502520.db2.gz	FCYUDDJRYGKVBH-UHFFFAOYSA-N	-1	3	328.292	1.647	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCc2noc(C3CC3)n2)c(-c2nn[n-]n2)c1	ZINC000826498674	594502522	/nfs/dbraw/zinc/50/25/22/594502522.db2.gz	FCYUDDJRYGKVBH-UHFFFAOYSA-N	-1	3	328.292	1.647	20	5		EDBDHM
C[C@@H](Cc1cnn(C)c1)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000832463372	594752212	/nfs/dbraw/zinc/75/22/12/594752212.db2.gz	YDQLRLPSLHYQKZ-QMMMGPOBSA-N	-1	3	330.391	1.299	20	5		EDBDHM
C[C@@H]1CN(CCC(=O)[O-])CCN1Cc1c(F)cccc1[N+](=O)[O-]	ZINC000833628278	594891059	/nfs/dbraw/zinc/89/10/59/594891059.db2.gz	FKTIABUAHNHCLY-LLVKDONJSA-N	-1	3	325.340	1.715	20	5		EDBDHM
CN1CCC[C@H](CC[N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1	ZINC000841548053	594920432	/nfs/dbraw/zinc/92/04/32/594920432.db2.gz	DRQGFTNRALFRQE-LLVKDONJSA-N	-1	3	345.396	1.744	20	5		EDBDHM
CC(C)(CO)O[N-]C(=O)Cc1ccc([N+](=O)[O-])cc1Br	ZINC000836804824	594999485	/nfs/dbraw/zinc/99/94/85/594999485.db2.gz	JROJRKRQXGZLPY-UHFFFAOYSA-N	-1	3	347.165	1.719	20	5		EDBDHM
O=C([O-])NC[C@@H]1CCCN1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000834220568	595059716	/nfs/dbraw/zinc/05/97/16/595059716.db2.gz	LYZWWSFTWHIYGT-RYUDHWBXSA-N	-1	3	339.348	1.067	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1CN1C[C@H]2COCC[C@@]2(C(=O)[O-])C1	ZINC000846287249	595198967	/nfs/dbraw/zinc/19/89/67/595198967.db2.gz	MXACRGBTPHTZKT-BLLLJJGKSA-N	-1	3	336.344	1.527	20	5		EDBDHM
Cc1c(Cc2noc([C@H]3CCS(=O)(=O)[N-]3)n2)cccc1[N+](=O)[O-]	ZINC000844859435	595403701	/nfs/dbraw/zinc/40/37/01/595403701.db2.gz	QPLIRNAYHRKFHV-SNVBAGLBSA-N	-1	3	338.345	1.241	20	5		EDBDHM
C[C@H](Cn1cncn1)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848582444	595409074	/nfs/dbraw/zinc/40/90/74/595409074.db2.gz	LIAOWFJLBZDASX-SECBINFHSA-N	-1	3	341.274	1.363	20	5		EDBDHM
Cc1nn(C)cc1C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848586754	595410115	/nfs/dbraw/zinc/41/01/15/595410115.db2.gz	OARCKWDLJBJDIW-UHFFFAOYSA-N	-1	3	340.286	1.925	20	5		EDBDHM
CNC(=O)C[C@@H](C)[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848592183	595412014	/nfs/dbraw/zinc/41/20/14/595412014.db2.gz	RMEQWHNFCUXSOR-MRVPVSSYSA-N	-1	3	331.275	1.207	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H]2NCCc3ccccc32)nc1	ZINC000850587643	595539201	/nfs/dbraw/zinc/53/92/01/595539201.db2.gz	FONISTCBPZKWES-AWEZNQCLSA-N	-1	3	348.384	1.155	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCCN(C)C2)cc1F	ZINC000866577042	596255988	/nfs/dbraw/zinc/25/59/88/596255988.db2.gz	MSNAURCJZWQQAK-JTQLQIEISA-N	-1	3	331.369	1.415	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@@H](O)Cc2ccccc2)c(-c2nnn[n-]2)c1	ZINC000738370885	598798093	/nfs/dbraw/zinc/79/80/93/598798093.db2.gz	RLXADMQDXFPTSY-ZDUSSCGKSA-N	-1	3	340.343	1.790	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@@H](O)Cc2ccccc2)c(-c2nn[n-]n2)c1	ZINC000738370885	598798094	/nfs/dbraw/zinc/79/80/94/598798094.db2.gz	RLXADMQDXFPTSY-ZDUSSCGKSA-N	-1	3	340.343	1.790	20	5		EDBDHM
CCOC(=O)C[C@@H](C)CNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000825499423	608018327	/nfs/dbraw/zinc/01/83/27/608018327.db2.gz	MVIFIWOJXCNSIA-SECBINFHSA-N	-1	3	334.336	1.776	20	5		EDBDHM
CCOC(=O)C[C@@H](C)CNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000825499423	608018328	/nfs/dbraw/zinc/01/83/28/608018328.db2.gz	MVIFIWOJXCNSIA-SECBINFHSA-N	-1	3	334.336	1.776	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@H](C(N)=O)C(C)C)c1	ZINC000183654478	235184232	/nfs/dbraw/zinc/18/42/32/235184232.db2.gz	WGWHXBBXXWCJRP-LLVKDONJSA-N	-1	3	349.796	1.345	20	5		EDBDHM
CC[C@H](C)N(C)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000067118850	138184171	/nfs/dbraw/zinc/18/41/71/138184171.db2.gz	UMYRKSJPBHAOED-JTQLQIEISA-N	-1	3	333.385	1.743	20	5		EDBDHM
O=C([N-]N1CCCCC1=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	ZINC000120240109	284014545	/nfs/dbraw/zinc/01/45/45/284014545.db2.gz	YPIIJBLBMWDSSR-UHFFFAOYSA-N	-1	3	329.316	1.438	20	5		EDBDHM
COC[C@@H](C)[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000416447728	251070619	/nfs/dbraw/zinc/07/06/19/251070619.db2.gz	DNLCFMLPWFISNC-SSDOTTSWSA-N	-1	3	342.295	1.927	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCN(CC(F)F)C1	ZINC000416661932	251103104	/nfs/dbraw/zinc/10/31/04/251103104.db2.gz	NNGULWNOXDRQAK-SNVBAGLBSA-N	-1	3	349.359	1.521	20	5		EDBDHM
COc1cc(CN[C@@H]2CCN(CC(F)F)C2)c([N+](=O)[O-])cc1[O-]	ZINC000418130665	251338682	/nfs/dbraw/zinc/33/86/82/251338682.db2.gz	GUTYYSCETMQKLX-SNVBAGLBSA-N	-1	3	331.319	1.738	20	5		EDBDHM
CCN1CCN(CCCNC(=O)c2cc([O-])cc([N+](=O)[O-])c2)CC1	ZINC000427912752	285316065	/nfs/dbraw/zinc/31/60/65/285316065.db2.gz	MMKIWVKBIWVLBA-UHFFFAOYSA-N	-1	3	336.392	1.058	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCCn2ccnc2)c([N+](=O)[O-])c1	ZINC000119175139	221259743	/nfs/dbraw/zinc/25/97/43/221259743.db2.gz	AWTAGMPOYBMPTC-UHFFFAOYSA-N	-1	3	340.361	1.169	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]CCc2cnn(C)c2)c1[N+](=O)[O-]	ZINC000346555203	143216259	/nfs/dbraw/zinc/21/62/59/143216259.db2.gz	KWSQMJZNNICNRP-UHFFFAOYSA-N	-1	3	338.389	1.466	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC2(C)CCOCC2)c([N+](=O)[O-])c1	ZINC000347303282	143305835	/nfs/dbraw/zinc/30/58/35/143305835.db2.gz	RAHOJNOYHUNBQO-UHFFFAOYSA-N	-1	3	328.390	1.998	20	5		EDBDHM
CCn1cc(S(=O)(=O)[N-][C@H](CC(C)C)CN(C)C)c([N+](=O)[O-])n1	ZINC000353094811	149283795	/nfs/dbraw/zinc/28/37/95/149283795.db2.gz	DWAKHEZOWLVXJV-LLVKDONJSA-N	-1	3	347.441	1.066	20	5		EDBDHM
COc1nnc(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)[n-]1	ZINC000355612989	150336637	/nfs/dbraw/zinc/33/66/37/150336637.db2.gz	WCSCWMUYSAUETH-UHFFFAOYSA-N	-1	3	330.260	1.228	20	5		EDBDHM
COc1nc(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)n[n-]1	ZINC000355612989	150336638	/nfs/dbraw/zinc/33/66/38/150336638.db2.gz	WCSCWMUYSAUETH-UHFFFAOYSA-N	-1	3	330.260	1.228	20	5		EDBDHM
COc1n[n-]c(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)n1	ZINC000355612989	150336641	/nfs/dbraw/zinc/33/66/41/150336641.db2.gz	WCSCWMUYSAUETH-UHFFFAOYSA-N	-1	3	330.260	1.228	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@]1(C)CCCOC1	ZINC000357419640	151026661	/nfs/dbraw/zinc/02/66/61/151026661.db2.gz	KXFUTAXOUMSFEM-ZDUSSCGKSA-N	-1	3	330.362	1.451	20	5		EDBDHM
Cn1cc([N+](=O)[O-])c(C(=O)[N-]c2ccncc2Br)n1	ZINC000357939037	151203527	/nfs/dbraw/zinc/20/35/27/151203527.db2.gz	FSWQSBRFKZEDQT-UHFFFAOYSA-N	-1	3	326.110	1.160	20	5		EDBDHM
CN1CCC[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1=O	ZINC000360451279	152050143	/nfs/dbraw/zinc/05/01/43/152050143.db2.gz	DJFIMJDDXMYBFA-JTQLQIEISA-N	-1	3	347.780	1.147	20	5		EDBDHM
Cc1nc([C@@H](C)[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])n[nH]1	ZINC000352507055	162218757	/nfs/dbraw/zinc/21/87/57/162218757.db2.gz	AMSDEDTZPGCDAN-ZCFIWIBFSA-N	-1	3	345.768	1.714	20	5		EDBDHM
Cc1nnc([C@@H](C)[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])[nH]1	ZINC000352507055	162218759	/nfs/dbraw/zinc/21/87/59/162218759.db2.gz	AMSDEDTZPGCDAN-ZCFIWIBFSA-N	-1	3	345.768	1.714	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC1(CCO)CCC1	ZINC000127372267	287437997	/nfs/dbraw/zinc/43/79/97/287437997.db2.gz	XDUAELHHPMALJV-UHFFFAOYSA-N	-1	3	328.390	1.734	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2CCO)c([N+](=O)[O-])c1	ZINC000275029336	268268241	/nfs/dbraw/zinc/26/82/41/268268241.db2.gz	ADVMSGSSVWHGIL-ZYHUDNBSSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COCC[C@H](C)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC	ZINC000276207015	273152654	/nfs/dbraw/zinc/15/26/54/273152654.db2.gz	KRALULZPSRHTCD-VIFPVBQESA-N	-1	3	346.361	1.085	20	5		EDBDHM
Cc1cnc(C[N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)s1	ZINC000154918121	287651968	/nfs/dbraw/zinc/65/19/68/287651968.db2.gz	LYWMAMJLUOTSTE-UHFFFAOYSA-N	-1	3	327.387	1.979	20	5		EDBDHM
CCc1nc(C)c(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)o1	ZINC000291848504	289195986	/nfs/dbraw/zinc/19/59/86/289195986.db2.gz	DDMKTXPNUFUSKL-UHFFFAOYSA-N	-1	3	325.346	1.932	20	5		EDBDHM
O=C1[N-]C(=O)[C@]2(CCCN(c3c4ccccc4ncc3[N+](=O)[O-])C2)N1	ZINC000291985782	289232096	/nfs/dbraw/zinc/23/20/96/289232096.db2.gz	QEOJTKRMXZAXLO-MRXNPFEDSA-N	-1	3	341.327	1.321	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCCC[C@@H]1C(N)=O	ZINC000175297749	302048156	/nfs/dbraw/zinc/04/81/56/302048156.db2.gz	RWEQONSPQMJHAD-WDEREUQCSA-N	-1	3	341.389	1.226	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CC2(N(C)C)CCC2)cc1[N+](=O)[O-]	ZINC000445730723	302880776	/nfs/dbraw/zinc/88/07/76/302880776.db2.gz	DDHVFWJGEBTTSV-UHFFFAOYSA-N	-1	3	333.435	1.727	20	5		EDBDHM
CC(C)c1nc(C[N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)n[nH]1	ZINC000295210252	303189088	/nfs/dbraw/zinc/18/90/88/303189088.db2.gz	GIRHIWRXEWBKAZ-UHFFFAOYSA-N	-1	3	325.350	1.315	20	5		EDBDHM
C[N-]S(=O)(=O)c1ccc(CNc2ncc([N+](=O)[O-])c(C)n2)s1	ZINC000296566773	303324735	/nfs/dbraw/zinc/32/47/35/303324735.db2.gz	QCELTEMLRHPVED-UHFFFAOYSA-N	-1	3	343.390	1.275	20	5		EDBDHM
CC(C)(CO)O[N-]C(=O)c1ccc(Br)cc1[N+](=O)[O-]	ZINC000297315603	303384915	/nfs/dbraw/zinc/38/49/15/303384915.db2.gz	VUSWRQBTSHLTJX-UHFFFAOYSA-N	-1	3	333.138	1.790	20	5		EDBDHM
O=C(Nc1ccc2c(c1)C(=O)CCO2)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000377754440	447337591	/nfs/dbraw/zinc/33/75/91/447337591.db2.gz	SLVJEQWJLCQXHS-UHFFFAOYSA-N	-1	3	329.268	1.913	20	5		EDBDHM
O=C(Nc1cccc(CN2CC[C@H](O)C2)c1)c1ccc([N+](=O)[O-])[n-]1	ZINC000428534326	305011000	/nfs/dbraw/zinc/01/10/00/305011000.db2.gz	OPSXZUZFPBOZLC-ZDUSSCGKSA-N	-1	3	330.344	1.742	20	5		EDBDHM
O=C(c1ccc(O)cc1[O-])N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000436665066	305164215	/nfs/dbraw/zinc/16/42/15/305164215.db2.gz	NAUXUFDCOVDSPH-SNVBAGLBSA-N	-1	3	344.327	1.728	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2C[C@H]3OCCC[C@@H]23)cc1[N+](=O)[O-]	ZINC000439091609	305193749	/nfs/dbraw/zinc/19/37/49/305193749.db2.gz	NHSSLUIGLKRPJK-IQJOONFLSA-N	-1	3	332.403	1.811	20	5		EDBDHM
CO[C@@H]1C[C@@H]([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C1(C)C	ZINC000440384335	305205077	/nfs/dbraw/zinc/20/50/77/305205077.db2.gz	VRMKMOSCDZMEKA-VXGBXAGGSA-N	-1	3	328.390	1.995	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2C[C@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000452048584	305380230	/nfs/dbraw/zinc/38/02/30/305380230.db2.gz	PZQBSEGCSQUZMF-JQWIXIFHSA-N	-1	3	326.374	1.928	20	5		EDBDHM
CCO[C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000452060826	305381193	/nfs/dbraw/zinc/38/11/93/305381193.db2.gz	NNNRMFIAEUKXFQ-VXGBXAGGSA-N	-1	3	332.353	1.970	20	5		EDBDHM
O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1ccc2n[n-]nc2c1	ZINC000030015018	441483460	/nfs/dbraw/zinc/48/34/60/441483460.db2.gz	MSRBAHCONWRYPD-UHFFFAOYSA-N	-1	3	326.316	1.708	20	5		EDBDHM
CCOC(=O)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000041684579	441668301	/nfs/dbraw/zinc/66/83/01/441668301.db2.gz	VOVWYVNQFCCUOF-UHFFFAOYSA-N	-1	3	336.753	1.480	20	5		EDBDHM
CCn1cc(-c2nc3cc4ccccc4cc3c(=O)[n-]2)c(=O)[nH]c1=O	ZINC000119775604	441950994	/nfs/dbraw/zinc/95/09/94/441950994.db2.gz	YUQSMCDWXGJKET-UHFFFAOYSA-N	-1	3	334.335	1.613	20	5		EDBDHM
CC(C)(C)CCN1CCN(C(=O)c2cc([N+](=O)[O-])c[n-]c2=O)CC1	ZINC000126018188	442069706	/nfs/dbraw/zinc/06/97/06/442069706.db2.gz	QNSLKXCHMHXVON-UHFFFAOYSA-N	-1	3	336.392	1.889	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]c2c(C)ccn(C)c2=O)c([N+](=O)[O-])c1	ZINC000126358922	442104549	/nfs/dbraw/zinc/10/45/49/442104549.db2.gz	AMQKFKNSZXPDAJ-UHFFFAOYSA-N	-1	3	337.357	1.711	20	5		EDBDHM
CC(C)C[C@@H](CN(C)C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000188220832	442726119	/nfs/dbraw/zinc/72/61/19/442726119.db2.gz	YNVVMOHVGCFASN-JTQLQIEISA-N	-1	3	335.451	1.911	20	5		EDBDHM
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000184064638	442988006	/nfs/dbraw/zinc/98/80/06/442988006.db2.gz	ZQPQMVMEXSJMCA-LBPRGKRZSA-N	-1	3	336.392	1.056	20	5		EDBDHM
CO[C@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000266132718	443028921	/nfs/dbraw/zinc/02/89/21/443028921.db2.gz	BFXXUICHZWQJGU-NEPJUHHUSA-N	-1	3	332.353	1.970	20	5		EDBDHM
C[N-]S(=O)(=O)c1ccc(CNc2ncc(C)cc2[N+](=O)[O-])s1	ZINC000266175024	443046040	/nfs/dbraw/zinc/04/60/40/443046040.db2.gz	ABDSLFOEVIGOFJ-UHFFFAOYSA-N	-1	3	342.402	1.880	20	5		EDBDHM
Cc1cnc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)o1	ZINC000185812152	443261947	/nfs/dbraw/zinc/26/19/47/443261947.db2.gz	COBGNMRQZLWVJO-UHFFFAOYSA-N	-1	3	348.340	1.918	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1CCCSC1	ZINC000267155352	443360820	/nfs/dbraw/zinc/36/08/20/443360820.db2.gz	DEZGJJLTSPERJI-SECBINFHSA-N	-1	3	332.403	1.777	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H](C)C[C@@H](C)O	ZINC000269814256	443452628	/nfs/dbraw/zinc/45/26/28/443452628.db2.gz	UZXYBRXWAQEXJW-VHSXEESVSA-N	-1	3	332.378	1.289	20	5		EDBDHM
Cc1ccc([C@@H](C)NC(=O)c2cn(C)c(=O)[n-]c2=O)cc1[N+](=O)[O-]	ZINC000267730712	443557846	/nfs/dbraw/zinc/55/78/46/443557846.db2.gz	LXUVCGHVAHCXDX-SECBINFHSA-N	-1	3	332.316	1.194	20	5		EDBDHM
CO[C@H]1C[C@@H](CN2CCCC2)N(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C1	ZINC000286214703	443669605	/nfs/dbraw/zinc/66/96/05/443669605.db2.gz	CGRZQMDMSNDJJF-KBPBESRZSA-N	-1	3	349.387	1.626	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)Cn1ccnc1	ZINC000298523766	443791427	/nfs/dbraw/zinc/79/14/27/443791427.db2.gz	WPLIASACCNORPJ-SNVBAGLBSA-N	-1	3	340.361	1.167	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](C)[C@@H]2CCOC2)c1[N+](=O)[O-]	ZINC000276799545	443831470	/nfs/dbraw/zinc/83/14/70/443831470.db2.gz	KNJLBFDRZUOUMV-VXGBXAGGSA-N	-1	3	328.390	1.915	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1(C)OCCCO1	ZINC000277015115	443889965	/nfs/dbraw/zinc/88/99/65/443889965.db2.gz	WEJRLDYMUZTYLF-UHFFFAOYSA-N	-1	3	346.361	1.035	20	5		EDBDHM
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)[N-][C@@H]1CCN2CCCC[C@@H]12	ZINC000299409139	444038635	/nfs/dbraw/zinc/03/86/35/444038635.db2.gz	OGQARSUEHCVZEI-NEPJUHHUSA-N	-1	3	343.380	1.639	20	5		EDBDHM
COC(=O)CCCON=C([O-])Nc1cc([N+](=O)[O-])ccc1OC	ZINC000288923563	444014703	/nfs/dbraw/zinc/01/47/03/444014703.db2.gz	VHUJGRDVGGGKRU-UHFFFAOYSA-N	-1	3	327.293	1.610	20	5		EDBDHM
COC(=O)CCCO[N-]C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000288923563	444014707	/nfs/dbraw/zinc/01/47/07/444014707.db2.gz	VHUJGRDVGGGKRU-UHFFFAOYSA-N	-1	3	327.293	1.610	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C1CCC(O)CC1	ZINC000314194980	444299006	/nfs/dbraw/zinc/29/90/06/444299006.db2.gz	HDHKNTLTHPWKKP-UHFFFAOYSA-N	-1	3	330.362	1.185	20	5		EDBDHM
CCOc1ccc([N+](=O)[O-])c(C(=O)[N-]OCCCC(=O)OC)c1	ZINC000290819948	444326778	/nfs/dbraw/zinc/32/67/78/444326778.db2.gz	ZQGZPMOMABHMNV-UHFFFAOYSA-N	-1	3	326.305	1.608	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]C[C@@](C)(O)C(F)(F)F)c([N+](=O)[O-])c1	ZINC000340597931	444455808	/nfs/dbraw/zinc/45/58/08/444455808.db2.gz	VTINRCIHVIKGKX-SNVBAGLBSA-N	-1	3	342.295	1.495	20	5		EDBDHM
C[C@@H]1CN(S(=O)(=O)[N-]c2cc(F)cc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000340960322	444598784	/nfs/dbraw/zinc/59/87/84/444598784.db2.gz	DPQXZEZGNBRWSI-DTWKUNHWSA-N	-1	3	333.341	1.500	20	5		EDBDHM
Cc1ncc(CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)c(=O)[n-]1	ZINC000343833437	444617479	/nfs/dbraw/zinc/61/74/79/444617479.db2.gz	OLFVUKQVFMLSEX-UHFFFAOYSA-N	-1	3	331.332	1.441	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]CCC1(O)CCC1	ZINC000341079066	444662506	/nfs/dbraw/zinc/66/25/06/444662506.db2.gz	NVCRWPYXBSRGTH-UHFFFAOYSA-N	-1	3	334.781	1.832	20	5		EDBDHM
Cc1ncc(CNC(=O)NCCc2cccc([N+](=O)[O-])c2)c(=O)[n-]1	ZINC000343915587	444666024	/nfs/dbraw/zinc/66/60/24/444666024.db2.gz	WPPGKCNEDIGZNQ-UHFFFAOYSA-N	-1	3	331.332	1.441	20	5		EDBDHM
CNC(=O)[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C(C)C	ZINC000342497170	444717297	/nfs/dbraw/zinc/71/72/97/444717297.db2.gz	NLGLQNUQJAUZEU-SNVBAGLBSA-N	-1	3	335.407	1.014	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@@H]1CCC[C@@H]1OC	ZINC000341206750	444729218	/nfs/dbraw/zinc/72/92/18/444729218.db2.gz	XNNZKSAWVMZPEQ-JQWIXIFHSA-N	-1	3	344.389	1.697	20	5		EDBDHM
COc1cc(CNCc2cnc(C)[n-]c2=O)c([N+](=O)[O-])cc1OC	ZINC000344309308	444893492	/nfs/dbraw/zinc/89/34/92/444893492.db2.gz	SWIHOEKMIXLSAD-UHFFFAOYSA-N	-1	3	334.332	1.706	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CC(=O)N(C(C)C)C2)cc1[N+](=O)[O-]	ZINC000343465664	445227749	/nfs/dbraw/zinc/22/77/49/445227749.db2.gz	JACZSMOHMKTYJJ-SECBINFHSA-N	-1	3	347.418	1.252	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NCc2ncccc2[O-])c1C	ZINC000360028196	445534772	/nfs/dbraw/zinc/53/47/72/445534772.db2.gz	CVDGDNAXUILIFG-UHFFFAOYSA-N	-1	3	337.357	1.791	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]Cc2ccc(C(N)=O)o2)c([N+](=O)[O-])c1	ZINC000353556365	445655416	/nfs/dbraw/zinc/65/54/16/445655416.db2.gz	BGPPFWWGJXSGFZ-UHFFFAOYSA-N	-1	3	339.329	1.074	20	5		EDBDHM
CO[C@](C)(C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C1CC1	ZINC000360250241	445656780	/nfs/dbraw/zinc/65/67/80/445656780.db2.gz	HHMPIPWONDSJTF-CQSZACIVSA-N	-1	3	328.390	1.997	20	5		EDBDHM
CCN1CC[C@H]([N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C1	ZINC000360256028	445659976	/nfs/dbraw/zinc/65/99/76/445659976.db2.gz	DPNHFYHWLCSDHU-LBPRGKRZSA-N	-1	3	327.406	1.584	20	5		EDBDHM
CCN1CC[C@@H]([N-]S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C1	ZINC000360256027	445659987	/nfs/dbraw/zinc/65/99/87/445659987.db2.gz	DPNHFYHWLCSDHU-GFCCVEGCSA-N	-1	3	327.406	1.584	20	5		EDBDHM
Cc1nnc2n1CCC[C@H]2[N-]S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000365863519	446376838	/nfs/dbraw/zinc/37/68/38/446376838.db2.gz	RZUMJACKKWOHHY-MRVPVSSYSA-N	-1	3	343.390	1.370	20	5		EDBDHM
CN1CCC[C@H](N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3[O-])CC2)C1	ZINC000368518068	446915561	/nfs/dbraw/zinc/91/55/61/446915561.db2.gz	GUIOBLPKGDYMJN-AWEZNQCLSA-N	-1	3	348.403	1.152	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cn1C	ZINC000445011069	447155238	/nfs/dbraw/zinc/15/52/38/447155238.db2.gz	VSUIJMVFYPRIGC-UHFFFAOYSA-N	-1	3	334.288	1.463	20	5		EDBDHM
C[C@@H]1C[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)c2nccn21	ZINC000451934513	447790162	/nfs/dbraw/zinc/79/01/62/447790162.db2.gz	CUASCBZPTJJSIU-HTQZYQBOSA-N	-1	3	328.375	1.837	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCCCC(N)=O)c1C	ZINC000539372310	448611704	/nfs/dbraw/zinc/61/17/04/448611704.db2.gz	YVJQSSDRPSFEMO-UHFFFAOYSA-N	-1	3	329.378	1.146	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCS[C@@H]2C)c([N+](=O)[O-])c1	ZINC000592109727	448689450	/nfs/dbraw/zinc/68/94/50/448689450.db2.gz	CHXNTEUAVUCUFD-PSASIEDQSA-N	-1	3	332.403	1.776	20	5		EDBDHM
CCCc1[nH]nc(C(=O)[N-]c2ncc(CCO)s2)c1[N+](=O)[O-]	ZINC000588875368	448944545	/nfs/dbraw/zinc/94/45/45/448944545.db2.gz	GVRFZJNFLVDEPK-UHFFFAOYSA-N	-1	3	325.350	1.514	20	5		EDBDHM
CC(C)(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)c1ccncc1	ZINC000593569419	449078703	/nfs/dbraw/zinc/07/87/03/449078703.db2.gz	NXFPCRXJOFATTE-UHFFFAOYSA-N	-1	3	336.373	1.641	20	5		EDBDHM
O=C([O-])c1ccnc(N2CCN(c3ccncc3)CC2)c1[N+](=O)[O-]	ZINC000592967059	449089538	/nfs/dbraw/zinc/08/95/38/449089538.db2.gz	FXALUCORRWNPMV-UHFFFAOYSA-N	-1	3	329.316	1.410	20	5		EDBDHM
COC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCCCC1	ZINC000593582884	449089744	/nfs/dbraw/zinc/08/97/44/449089744.db2.gz	DHONXJJPAAUCQL-UHFFFAOYSA-N	-1	3	329.378	1.617	20	5		EDBDHM
CC[C@@H](C)C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(=O)OC	ZINC000593612304	449108361	/nfs/dbraw/zinc/10/83/61/449108361.db2.gz	JWAMHIZWJHKKJP-MWLCHTKSSA-N	-1	3	345.377	1.246	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CO)CC2CC2)cc1C	ZINC000611110163	449171726	/nfs/dbraw/zinc/17/17/26/449171726.db2.gz	VSJXLZAYBTWIMQ-GFCCVEGCSA-N	-1	3	328.390	1.651	20	5		EDBDHM
CCO[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C12CCC2	ZINC000593554172	449344499	/nfs/dbraw/zinc/34/44/99/449344499.db2.gz	YODSQCWIYHEKEA-NWDGAFQWSA-N	-1	3	341.389	1.616	20	5		EDBDHM
COC1CCC(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CC1	ZINC000593558729	449349097	/nfs/dbraw/zinc/34/90/97/449349097.db2.gz	JUBHLVIUUYDUSV-UHFFFAOYSA-N	-1	3	329.378	1.473	20	5		EDBDHM
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)c2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000600628693	449465923	/nfs/dbraw/zinc/46/59/23/449465923.db2.gz	JWGDBYTURLSUGZ-AEGPPILISA-N	-1	3	349.387	1.672	20	5		EDBDHM
O=[N+]([O-])c1c(NCc2ccc([O-])c(F)c2)ncnc1N1CCOCC1	ZINC000598597669	449483699	/nfs/dbraw/zinc/48/36/99/449483699.db2.gz	SSNLZUGHEDKNIE-UHFFFAOYSA-N	-1	3	349.322	1.678	20	5		EDBDHM
CN(C)c1cnn(C2CCN(c3cc[n-]c(=O)c3[N+](=O)[O-])CC2)c1	ZINC000596244938	449437183	/nfs/dbraw/zinc/43/71/83/449437183.db2.gz	UZCSUXDCUDUVLE-UHFFFAOYSA-N	-1	3	332.364	1.799	20	5		EDBDHM
O=[N+]([O-])c1c(NCc2nc([C@@H]3CCCO3)n[n-]2)nc2sccn21	ZINC000594590540	449585929	/nfs/dbraw/zinc/58/59/29/449585929.db2.gz	YBZXYHVAJCGPQV-ZETCQYMHSA-N	-1	3	335.349	1.886	20	5		EDBDHM
C[C@@H]1CCCN(CC[N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])C1	ZINC000594749778	449665530	/nfs/dbraw/zinc/66/55/30/449665530.db2.gz	YVZZRYNNWKKRHV-LLVKDONJSA-N	-1	3	328.394	1.000	20	5		EDBDHM
CO[C@H](C)CC[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594754271	449669765	/nfs/dbraw/zinc/66/97/65/449669765.db2.gz	ZLHRJCJJYGMLBK-SNVBAGLBSA-N	-1	3	339.373	1.846	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CC(C)(C)CO)cc1[N+](=O)[O-]	ZINC000614550869	449681860	/nfs/dbraw/zinc/68/18/60/449681860.db2.gz	FDIMOHIUPPSWAB-UHFFFAOYSA-N	-1	3	336.341	1.039	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H](CO)CC2CC2)c1C	ZINC000594866215	449780811	/nfs/dbraw/zinc/78/08/11/449780811.db2.gz	TYRKZOVGNIDUGX-CYBMUJFWSA-N	-1	3	342.417	1.899	20	5		EDBDHM
CC(C)(F)CC[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000594844698	449752463	/nfs/dbraw/zinc/75/24/63/449752463.db2.gz	KZIJVXYXDFJAER-UHFFFAOYSA-N	-1	3	348.352	1.783	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1C[C@@H](O)C12CCC2	ZINC000594863593	449774965	/nfs/dbraw/zinc/77/49/65/449774965.db2.gz	HYEUBWWIVQGSBJ-QWHCGFSZSA-N	-1	3	342.373	1.185	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]C[C@]2(C)CCCO2)c(F)cc1[N+](=O)[O-]	ZINC000601368124	449882324	/nfs/dbraw/zinc/88/23/24/449882324.db2.gz	KXRXAAHNFAHTPQ-ZDUSSCGKSA-N	-1	3	332.353	1.890	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]Cc1oc(C)nc1C	ZINC000599316768	449886463	/nfs/dbraw/zinc/88/64/63/449886463.db2.gz	LXMDHOMFOAIKNX-UHFFFAOYSA-N	-1	3	341.345	1.687	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CCOC[C@@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000601403163	449919317	/nfs/dbraw/zinc/91/93/17/449919317.db2.gz	BONGTIIHPMPKBF-ONGXEEELSA-N	-1	3	332.353	1.746	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC[C@@H]1CCCOC1	ZINC000599364961	449920781	/nfs/dbraw/zinc/92/07/81/449920781.db2.gz	PUSJOHCULGMMBT-NSHDSACASA-N	-1	3	344.389	1.698	20	5		EDBDHM
CCN1CC[C@@H]([N-]S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C1=O	ZINC000619797834	450336436	/nfs/dbraw/zinc/33/64/36/450336436.db2.gz	SAMFKCNVPRRVGR-LLVKDONJSA-N	-1	3	341.389	1.111	20	5		EDBDHM
COc1cc(CNc2ccc(-n3cncn3)cn2)c([N+](=O)[O-])cc1[O-]	ZINC000616206027	450355202	/nfs/dbraw/zinc/35/52/02/450355202.db2.gz	IEIOOEIVTWQFFB-UHFFFAOYSA-N	-1	3	342.315	1.897	20	5		EDBDHM
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)Nc1ccccc1[O-]	ZINC000198139117	486703569	/nfs/dbraw/zinc/70/35/69/486703569.db2.gz	MXSLZEQHDZHONB-UHFFFAOYSA-N	-1	3	343.295	1.665	20	5		EDBDHM
CC1(Cn2cc(C(=O)[N-]c3cc([N+](=O)[O-])ccc3F)nn2)COC1	ZINC000183823600	528010918	/nfs/dbraw/zinc/01/09/18/528010918.db2.gz	UXFKVFSXQXEYFC-UHFFFAOYSA-N	-1	3	335.295	1.614	20	5		EDBDHM
C[C@H](CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1)Cn1cccn1	ZINC000736025107	578947262	/nfs/dbraw/zinc/94/72/62/578947262.db2.gz	DHOPGCHXSHTTRT-SECBINFHSA-N	-1	3	329.324	1.115	20	5		EDBDHM
C[C@H](CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1)Cn1cccn1	ZINC000736025107	578947263	/nfs/dbraw/zinc/94/72/63/578947263.db2.gz	DHOPGCHXSHTTRT-SECBINFHSA-N	-1	3	329.324	1.115	20	5		EDBDHM
C[C@H](CNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])CC1(C)OCCO1	ZINC000736025555	578947346	/nfs/dbraw/zinc/94/73/46/578947346.db2.gz	IHCKEEWGALUSOS-JTQLQIEISA-N	-1	3	348.363	1.976	20	5		EDBDHM
C[C@H](CNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])CC1(C)OCCO1	ZINC000736025555	578947347	/nfs/dbraw/zinc/94/73/47/578947347.db2.gz	IHCKEEWGALUSOS-JTQLQIEISA-N	-1	3	348.363	1.976	20	5		EDBDHM
CC(C)N(CCC(=O)[O-])Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000736468834	578991465	/nfs/dbraw/zinc/99/14/65/578991465.db2.gz	YFPHXLKBAJSXIN-UHFFFAOYSA-N	-1	3	333.348	1.996	20	5		EDBDHM
O=[N+]([O-])c1cccc(CS(=O)(=O)[N-]C[C@@H](O)c2ccccn2)c1	ZINC000758517556	579984755	/nfs/dbraw/zinc/98/47/55/579984755.db2.gz	POUWOSDTGVHAMR-CQSZACIVSA-N	-1	3	337.357	1.143	20	5		EDBDHM
Cc1c(F)cccc1S(=O)(=O)NN=c1[n-]cccc1[N+](=O)[O-]	ZINC000759167007	580000065	/nfs/dbraw/zinc/00/00/65/580000065.db2.gz	BFPYILGVDJOYPW-UHFFFAOYSA-N	-1	3	326.309	1.743	20	5		EDBDHM
C[C@@H](COCC(F)(F)F)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768828236	580221436	/nfs/dbraw/zinc/22/14/36/580221436.db2.gz	WIKQVVWFIYHHFX-LURJTMIESA-N	-1	3	348.324	1.902	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H](O)c1ccccn1	ZINC000775593090	580394595	/nfs/dbraw/zinc/39/45/95/580394595.db2.gz	IXQQLSTXJHQRTB-CYBMUJFWSA-N	-1	3	337.357	1.310	20	5		EDBDHM
CC[S@@](=O)CC[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000790844588	580779846	/nfs/dbraw/zinc/77/98/46/580779846.db2.gz	VKVORGVLEPOJGG-HXUWFJFHSA-N	-1	3	334.419	1.259	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@H](O)CC(C)C)c1[N+](=O)[O-]	ZINC000790851539	580780029	/nfs/dbraw/zinc/78/00/29/580780029.db2.gz	GBZTYVXTABDHEX-GFCCVEGCSA-N	-1	3	330.406	1.897	20	5		EDBDHM
COc1c([O-])ccc(CN2CCOC[C@@H]2[C@H]2CCCO2)c1[N+](=O)[O-]	ZINC000894409322	591303677	/nfs/dbraw/zinc/30/36/77/591303677.db2.gz	NYVQSPQQSAXWQF-TZMCWYRMSA-N	-1	3	338.360	1.689	20	5		EDBDHM
CC1(C)CCN(CC[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000908082781	592291488	/nfs/dbraw/zinc/29/14/88/592291488.db2.gz	JCBFQALCBHPSLA-UHFFFAOYSA-N	-1	3	333.435	1.667	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2COC[C@H]2C2CC2)cc1C	ZINC000908411511	592485491	/nfs/dbraw/zinc/48/54/91/592485491.db2.gz	NPKBTCODHRKKQL-QWHCGFSZSA-N	-1	3	340.401	1.915	20	5		EDBDHM
CN1CCN(C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)CC12CCCCC2	ZINC000908571013	592543271	/nfs/dbraw/zinc/54/32/71/592543271.db2.gz	QMCCZGORKFGRAE-UHFFFAOYSA-N	-1	3	334.376	1.786	20	5		EDBDHM
CCN1CCN(CCNc2cc(C)c([N+](=O)[O-])c(C(=O)[O-])c2)CC1	ZINC000910346281	592838987	/nfs/dbraw/zinc/83/89/87/592838987.db2.gz	PVIADEILYMJCRU-UHFFFAOYSA-N	-1	3	336.392	1.651	20	5		EDBDHM
O=C1[C@@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C[C@H]2CCCCN12	ZINC000841532471	593206807	/nfs/dbraw/zinc/20/68/07/593206807.db2.gz	TUQUKBCIHTVKEG-SCZZXKLOSA-N	-1	3	345.402	1.088	20	5		EDBDHM
O=C([O-])C[C@@H]1CCCN(C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000821517145	593851996	/nfs/dbraw/zinc/85/19/96/593851996.db2.gz	XNUDJPGFHNRWHG-STQMWFEESA-N	-1	3	338.360	1.521	20	5		EDBDHM
CN(C(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1-c1nnn[n-]1	ZINC000821572224	593865928	/nfs/dbraw/zinc/86/59/28/593865928.db2.gz	WPRCUMOEQVGJOV-UHFFFAOYSA-N	-1	3	338.327	1.980	20	5		EDBDHM
CN(C(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1-c1nn[n-]n1	ZINC000821572224	593865929	/nfs/dbraw/zinc/86/59/29/593865929.db2.gz	WPRCUMOEQVGJOV-UHFFFAOYSA-N	-1	3	338.327	1.980	20	5		EDBDHM
CC1(C)C[C@](C)([N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C(=O)O1	ZINC000820731867	593874805	/nfs/dbraw/zinc/87/48/05/593874805.db2.gz	VSUVMZWMOHTHGF-AWEZNQCLSA-N	-1	3	342.373	1.498	20	5		EDBDHM
CC(=O)N1CC[C@@H](CN(C)c2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1	ZINC000823973468	593898079	/nfs/dbraw/zinc/89/80/79/593898079.db2.gz	KCSMDYFCBRHCEX-NSHDSACASA-N	-1	3	345.363	1.080	20	5		EDBDHM
CC(=O)N1CC[C@@H](CN(C)c2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1	ZINC000823973468	593898081	/nfs/dbraw/zinc/89/80/81/593898081.db2.gz	KCSMDYFCBRHCEX-NSHDSACASA-N	-1	3	345.363	1.080	20	5		EDBDHM
COc1ccc(-c2nnn[n-]2)cc1NC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000821765551	593933683	/nfs/dbraw/zinc/93/36/83/593933683.db2.gz	FPZRYKVPYMUIGJ-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
COc1ccc(-c2nn[n-]n2)cc1NC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000821765551	593933684	/nfs/dbraw/zinc/93/36/84/593933684.db2.gz	FPZRYKVPYMUIGJ-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
CCN1CCCC[C@H]1CNc1nccc(-c2nnn[n-]2)c1[N+](=O)[O-]	ZINC000821268130	594003381	/nfs/dbraw/zinc/00/33/81/594003381.db2.gz	UEFDYSBHFVJMQO-JTQLQIEISA-N	-1	3	332.368	1.456	20	5		EDBDHM
Cn1cc(-c2nnn[n-]2)cc1C(=O)Oc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000822665382	594081923	/nfs/dbraw/zinc/08/19/23/594081923.db2.gz	PNIZPGLQCUUARS-UHFFFAOYSA-N	-1	3	348.706	1.986	20	5		EDBDHM
Cn1cc(-c2nn[n-]n2)cc1C(=O)Oc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000822665382	594081925	/nfs/dbraw/zinc/08/19/25/594081925.db2.gz	PNIZPGLQCUUARS-UHFFFAOYSA-N	-1	3	348.706	1.986	20	5		EDBDHM
C[C@@](CNC(=O)[O-])(NCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1	ZINC000824952962	594104077	/nfs/dbraw/zinc/10/40/77/594104077.db2.gz	SBGYHEFDDJUALJ-HNNXBMFYSA-N	-1	3	336.348	1.559	20	5		EDBDHM
O=C(CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)NCc1ccco1	ZINC000823014661	594136992	/nfs/dbraw/zinc/13/69/92/594136992.db2.gz	SJTAZTFZDVHJLU-UHFFFAOYSA-N	-1	3	343.303	1.096	20	5		EDBDHM
O=C(CNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)NCc1ccco1	ZINC000823014661	594136993	/nfs/dbraw/zinc/13/69/93/594136993.db2.gz	SJTAZTFZDVHJLU-UHFFFAOYSA-N	-1	3	343.303	1.096	20	5		EDBDHM
CCc1cnccc1CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825740644	594235039	/nfs/dbraw/zinc/23/50/39/594235039.db2.gz	XCVTXBQOCWTTAG-UHFFFAOYSA-N	-1	3	326.320	1.739	20	5		EDBDHM
CCc1cnccc1CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825740644	594235041	/nfs/dbraw/zinc/23/50/41/594235041.db2.gz	XCVTXBQOCWTTAG-UHFFFAOYSA-N	-1	3	326.320	1.739	20	5		EDBDHM
CCOc1cc(N2CCN(CCCC(=O)[O-])CC2)ccc1[N+](=O)[O-]	ZINC000830049458	594325100	/nfs/dbraw/zinc/32/51/00/594325100.db2.gz	CICSXCVADOOSLV-UHFFFAOYSA-N	-1	3	337.376	1.980	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1	ZINC000826212163	594380938	/nfs/dbraw/zinc/38/09/38/594380938.db2.gz	IHDRGVXMQYTZOK-UHFFFAOYSA-N	-1	3	343.303	1.042	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1	ZINC000826212163	594380939	/nfs/dbraw/zinc/38/09/39/594380939.db2.gz	IHDRGVXMQYTZOK-UHFFFAOYSA-N	-1	3	343.303	1.042	20	5		EDBDHM
O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1c[nH]c(-c2nnn[n-]2)c1	ZINC000826459687	594484195	/nfs/dbraw/zinc/48/41/95/594484195.db2.gz	URZRZJTYGBWWRO-UHFFFAOYSA-N	-1	3	339.275	1.232	20	5		EDBDHM
O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1c[nH]c(-c2nn[n-]n2)c1	ZINC000826459687	594484196	/nfs/dbraw/zinc/48/41/96/594484196.db2.gz	URZRZJTYGBWWRO-UHFFFAOYSA-N	-1	3	339.275	1.232	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@H](O)c2ccncc2)c(-c2nnn[n-]2)c1	ZINC000826498797	594502597	/nfs/dbraw/zinc/50/25/97/594502597.db2.gz	KCKXDVUGWXSDJD-ZDUSSCGKSA-N	-1	3	327.304	1.315	20	5		EDBDHM
O=[N+]([O-])c1ccc(NC[C@H](O)c2ccncc2)c(-c2nn[n-]n2)c1	ZINC000826498797	594502599	/nfs/dbraw/zinc/50/25/99/594502599.db2.gz	KCKXDVUGWXSDJD-ZDUSSCGKSA-N	-1	3	327.304	1.315	20	5		EDBDHM
Cc1cccnc1CC[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000832179660	594733004	/nfs/dbraw/zinc/73/30/04/594733004.db2.gz	BVIWIYIKNWWNAJ-UHFFFAOYSA-N	-1	3	327.387	1.881	20	5		EDBDHM
COC(=O)[C@@H]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])[C@H](C(=O)[O-])C1	ZINC000833708215	594912264	/nfs/dbraw/zinc/91/22/64/594912264.db2.gz	OLQYQNYUAYXSDY-HNLSUCLVSA-N	-1	3	348.355	1.946	20	5		EDBDHM
COC(=O)[C@H](C)C[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848581941	595408643	/nfs/dbraw/zinc/40/86/43/595408643.db2.gz	SUAZVQQAFGZRBX-MRVPVSSYSA-N	-1	3	332.259	1.492	20	5		EDBDHM
O=C([N-][C@H](CO)CC1CC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000848585088	595409783	/nfs/dbraw/zinc/40/97/83/595409783.db2.gz	GGYRLPNNMFVUCE-JTQLQIEISA-N	-1	3	330.287	1.844	20	5		EDBDHM
O=C([N-][C@H]1CC[C@H](O)CC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848584877	595409800	/nfs/dbraw/zinc/40/98/00/595409800.db2.gz	CPBGDPKKLNULQT-HOMQSWHASA-N	-1	3	330.287	1.986	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2NCCc3ccccc32)nc1	ZINC000850587644	595539228	/nfs/dbraw/zinc/53/92/28/595539228.db2.gz	FONISTCBPZKWES-CQSZACIVSA-N	-1	3	348.384	1.155	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-]C[C@H](C)CCO)cc1[N+](=O)[O-]	ZINC000123540509	596509499	/nfs/dbraw/zinc/50/94/99/596509499.db2.gz	PANORWCLJAXJGE-MRVPVSSYSA-N	-1	3	336.797	1.853	20	5		EDBDHM
Cc1cc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])ccc1F	ZINC000125573594	596977087	/nfs/dbraw/zinc/97/70/87/596977087.db2.gz	QTRVCSADPCOAGX-UHFFFAOYSA-N	-1	3	326.309	1.743	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCc2ccc(O)cc2)c(-c2nnn[n-]2)c1	ZINC000738373476	599306810	/nfs/dbraw/zinc/30/68/10/599306810.db2.gz	DMSZWKNXGZFEAX-UHFFFAOYSA-N	-1	3	341.331	1.920	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCc2ccc(O)cc2)c(-c2nn[n-]n2)c1	ZINC000738373476	599306812	/nfs/dbraw/zinc/30/68/12/599306812.db2.gz	DMSZWKNXGZFEAX-UHFFFAOYSA-N	-1	3	341.331	1.920	20	5		EDBDHM
CC[C@@H](C)NC(=O)CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000917656164	697056397	/nfs/dbraw/zinc/05/63/97/697056397.db2.gz	XEDATLDXTJYJLB-SECBINFHSA-N	-1	3	347.368	1.317	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)N(C)C	ZINC000056060003	214355892	/nfs/dbraw/zinc/35/58/92/214355892.db2.gz	YCZLFQUIFDWIRR-ZETCQYMHSA-N	-1	3	335.769	1.003	20	5		EDBDHM
Cc1noc(CC[N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])n1	ZINC000101575522	219140833	/nfs/dbraw/zinc/14/08/33/219140833.db2.gz	JNTVMBVWSZCKRY-UHFFFAOYSA-N	-1	3	326.334	1.116	20	5		EDBDHM
CCC(CC)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(N)=O	ZINC000101923278	219173803	/nfs/dbraw/zinc/17/38/03/219173803.db2.gz	WJGVHCYKJMBQHJ-UHFFFAOYSA-N	-1	3	349.796	1.571	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CCCC[C@@H]1CO	ZINC000178916559	232603694	/nfs/dbraw/zinc/60/36/94/232603694.db2.gz	SVXRNJICOKUBPT-VXGBXAGGSA-N	-1	3	328.390	1.733	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CC(=O)N(C3CC3)C2)cc1[N+](=O)[O-]	ZINC000125029292	138331535	/nfs/dbraw/zinc/33/15/35/138331535.db2.gz	BULRIOLLCBZRGO-MRVPVSSYSA-N	-1	3	345.402	1.006	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])C(=O)N1CCCC1	ZINC000353196507	296137097	/nfs/dbraw/zinc/13/70/97/296137097.db2.gz	XETBIQIDQLSERH-LLVKDONJSA-N	-1	3	341.389	1.025	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1NC(=O)CCc1c(C)nc(C)[n-]c1=O	ZINC000012455379	211386372	/nfs/dbraw/zinc/38/63/72/211386372.db2.gz	GRONFPNTZGJWFM-UHFFFAOYSA-N	-1	3	346.343	1.875	20	5		EDBDHM
O=C(/C=C/c1cncc([O-])c1)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000492443751	255176728	/nfs/dbraw/zinc/17/67/28/255176728.db2.gz	QKCZQSCAXUCONM-LZCJLJQNSA-N	-1	3	329.312	1.904	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCC[S@](C)=O)cc1C	ZINC000116901715	221009630	/nfs/dbraw/zinc/00/96/30/221009630.db2.gz	FBRCTOBFLMVGSN-HXUWFJFHSA-N	-1	3	334.419	1.259	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H](CO)C(C)C	ZINC000344826484	143016788	/nfs/dbraw/zinc/01/67/88/143016788.db2.gz	KEYFMDQWELHVNV-JTQLQIEISA-N	-1	3	332.378	1.146	20	5		EDBDHM
C[C@@H]1C[C@@H]1N1CCN(C(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)C[C@@H](C)C1	ZINC000346205710	143178838	/nfs/dbraw/zinc/17/88/38/143178838.db2.gz	VHNWLWXIKLGVCZ-LOWVWBTDSA-N	-1	3	334.376	1.498	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)c1csnn1	ZINC000416641942	304340721	/nfs/dbraw/zinc/34/07/21/304340721.db2.gz	ZMPDIXCYIXZHRS-SSDOTTSWSA-N	-1	3	344.374	1.494	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@H](CO)c1ccc(F)cc1	ZINC000352886293	149203923	/nfs/dbraw/zinc/20/39/23/149203923.db2.gz	UUUFVEUYWBSVII-GFCCVEGCSA-N	-1	3	340.332	1.746	20	5		EDBDHM
Cn1nc([N+](=O)[O-])cc1C(=O)[N-]c1sccc1S(C)(=O)=O	ZINC000360753653	152188161	/nfs/dbraw/zinc/18/81/61/152188161.db2.gz	JGNKFRHUVNADSD-UHFFFAOYSA-N	-1	3	330.347	1.046	20	5		EDBDHM
O=C(COc1ccc([N+](=O)[O-])cc1)NCc1nnc(C(F)(F)F)[n-]1	ZINC000360814425	152216295	/nfs/dbraw/zinc/21/62/95/152216295.db2.gz	RTMYEVJGVYWWIC-UHFFFAOYSA-N	-1	3	345.237	1.427	20	5		EDBDHM
O=C(COc1ccc([N+](=O)[O-])cc1)NCc1n[n-]c(C(F)(F)F)n1	ZINC000360814425	152216297	/nfs/dbraw/zinc/21/62/97/152216297.db2.gz	RTMYEVJGVYWWIC-UHFFFAOYSA-N	-1	3	345.237	1.427	20	5		EDBDHM
O=C(COc1ccc([N+](=O)[O-])cc1)NCc1nc(C(F)(F)F)n[n-]1	ZINC000360814425	152216298	/nfs/dbraw/zinc/21/62/98/152216298.db2.gz	RTMYEVJGVYWWIC-UHFFFAOYSA-N	-1	3	345.237	1.427	20	5		EDBDHM
CNc1c(C(=O)N2CCc3nc[n-]c(=O)c3C2)cccc1[N+](=O)[O-]	ZINC000360945401	152259705	/nfs/dbraw/zinc/25/97/05/152259705.db2.gz	RNWIFCPSOMUDGI-UHFFFAOYSA-N	-1	3	329.316	1.331	20	5		EDBDHM
Cc1cc(=O)[n-]c([C@H](C)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)n1	ZINC000363966283	153109388	/nfs/dbraw/zinc/10/93/88/153109388.db2.gz	FZAZUHFGQHJPPD-NSHDSACASA-N	-1	3	332.364	1.993	20	5		EDBDHM
CC(C)[C@@H](CCO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000122529909	222106954	/nfs/dbraw/zinc/10/69/54/222106954.db2.gz	STUQSORUWUBIBE-LLVKDONJSA-N	-1	3	336.797	1.934	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@H](C)C(=O)NC(C)(C)C)cc1[N+](=O)[O-]	ZINC000123312233	222254753	/nfs/dbraw/zinc/25/47/53/222254753.db2.gz	OWUSOXSGOIRWCR-SSDOTTSWSA-N	-1	3	349.434	1.546	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC[C@H](C)OC	ZINC000273617370	268065848	/nfs/dbraw/zinc/06/58/48/268065848.db2.gz	VHZJBJORMMTDTC-VIFPVBQESA-N	-1	3	346.361	1.085	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H]2CCOC[C@H]2C)cc1[N+](=O)[O-]	ZINC000278044089	273243077	/nfs/dbraw/zinc/24/30/77/273243077.db2.gz	XSTHIZSVSVBFEH-LDYMZIIASA-N	-1	3	348.352	1.446	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H]2CCOC[C@H]2C)c([N+](=O)[O-])c1	ZINC000285565485	274581267	/nfs/dbraw/zinc/58/12/67/274581267.db2.gz	JWUHNOOTHPVLFR-GHMZBOCLSA-N	-1	3	344.389	1.554	20	5		EDBDHM
Cc1cc(N2CCC[C@H]2C[C@]2(C)NC(=O)[N-]C2=O)ncc1[N+](=O)[O-]	ZINC000286239511	287965195	/nfs/dbraw/zinc/96/51/95/287965195.db2.gz	DDGHZBQJRIELGY-BONVTDFDSA-N	-1	3	333.348	1.255	20	5		EDBDHM
Cc1nnc(CC[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])s1	ZINC000290243495	288864555	/nfs/dbraw/zinc/86/45/55/288864555.db2.gz	QRFSGUVGKRBTSR-UHFFFAOYSA-N	-1	3	342.402	1.584	20	5		EDBDHM
CN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)[C@@H]1c1ccccc1	ZINC000179222208	290213269	/nfs/dbraw/zinc/21/32/69/290213269.db2.gz	YCQKUUWEULTMGZ-GJZGRUSLSA-N	-1	3	342.355	1.871	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCO[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000330594702	303771534	/nfs/dbraw/zinc/77/15/34/303771534.db2.gz	BBALCAZTLYMNCE-UWVGGRQHSA-N	-1	3	330.362	1.449	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCCO1	ZINC000433453453	305109353	/nfs/dbraw/zinc/10/93/53/305109353.db2.gz	ZITFYKRVZAKNMA-KGLIPLIRSA-N	-1	3	344.389	1.208	20	5		EDBDHM
O=C(Nc1cccc([C@@H]2CNC(=O)C2)c1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000435900938	305149032	/nfs/dbraw/zinc/14/90/32/305149032.db2.gz	GTQUSPUZPGJGJD-JTQLQIEISA-N	-1	3	342.311	1.551	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1C[C@H](OC)C1(C)C	ZINC000440411961	305206062	/nfs/dbraw/zinc/20/60/62/305206062.db2.gz	FVAUYZVWMGSTRB-STQMWFEESA-N	-1	3	344.389	1.695	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H]1C[C@@H](OC)C1(C)C	ZINC000440411958	305206076	/nfs/dbraw/zinc/20/60/76/305206076.db2.gz	FVAUYZVWMGSTRB-CHWSQXEVSA-N	-1	3	344.389	1.695	20	5		EDBDHM
CNC(=O)Nc1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1	ZINC000444858751	305254095	/nfs/dbraw/zinc/25/40/95/305254095.db2.gz	MHJVKSKVCWLICN-UHFFFAOYSA-N	-1	3	331.288	1.699	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1cnc(C)[n-]c1=O	ZINC000444910327	305254835	/nfs/dbraw/zinc/25/48/35/305254835.db2.gz	VYGAFSMLPYPXMM-UHFFFAOYSA-N	-1	3	333.304	1.729	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CO)[C@H]2CCCO2)c1C	ZINC000447945091	305289487	/nfs/dbraw/zinc/28/94/87/305289487.db2.gz	PAIFBVMHTKKORG-WCQYABFASA-N	-1	3	344.389	1.030	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC1=CCOCC1	ZINC000451679587	305361863	/nfs/dbraw/zinc/36/18/63/305361863.db2.gz	ZKVFMOXGDZTDAQ-UHFFFAOYSA-N	-1	3	328.346	1.228	20	5		EDBDHM
NC(=O)[C@@H]1CC[C@H]([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000452064465	305381564	/nfs/dbraw/zinc/38/15/64/305381564.db2.gz	GHGVRSDTZUDPQH-APPZFPTMSA-N	-1	3	347.780	1.181	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CCCn2cccn2)c([N+](=O)[O-])c1	ZINC000030518607	441494686	/nfs/dbraw/zinc/49/46/86/441494686.db2.gz	NCANWYMSFCVTPR-UHFFFAOYSA-N	-1	3	340.361	1.169	20	5		EDBDHM
CCCCS(=O)(=O)[N-]CC(=O)N1CCc2c1cccc2[N+](=O)[O-]	ZINC000090052346	441617739	/nfs/dbraw/zinc/61/77/39/441617739.db2.gz	YJIHFVXNJUARPM-UHFFFAOYSA-N	-1	3	341.389	1.203	20	5		EDBDHM
C[C@H](Cn1cccn1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000056052968	441684493	/nfs/dbraw/zinc/68/44/93/441684493.db2.gz	HEONETNDZJOBSZ-SECBINFHSA-N	-1	3	344.780	1.812	20	5		EDBDHM
O=C(NCc1ccc([O-])c(Br)c1)c1[nH]ncc1[N+](=O)[O-]	ZINC000158274806	441715939	/nfs/dbraw/zinc/71/59/39/441715939.db2.gz	KJEFHOXNZFJAGL-UHFFFAOYSA-N	-1	3	341.121	1.716	20	5		EDBDHM
O=C(NCc1ccc([O-])c(Br)c1)c1n[nH]cc1[N+](=O)[O-]	ZINC000158274806	441715942	/nfs/dbraw/zinc/71/59/42/441715942.db2.gz	KJEFHOXNZFJAGL-UHFFFAOYSA-N	-1	3	341.121	1.716	20	5		EDBDHM
CC1CCN(C[C@H](O)CNC(=O)c2cccc([N+](=O)[O-])c2[O-])CC1	ZINC000151047345	441995817	/nfs/dbraw/zinc/99/58/17/441995817.db2.gz	LYBXPIRTODKGJK-GFCCVEGCSA-N	-1	3	337.376	1.123	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c([N-]c2cnn(CC(=O)N3CCOCC3)c2)n1	ZINC000127187365	442179342	/nfs/dbraw/zinc/17/93/42/442179342.db2.gz	JNDVWIFPLRMMEF-UHFFFAOYSA-N	-1	3	346.347	1.097	20	5		EDBDHM
O=C(Nc1cc(-c2ccncc2)[nH]n1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000170829792	442270763	/nfs/dbraw/zinc/27/07/63/442270763.db2.gz	DUIFMWRTHNQAFE-UHFFFAOYSA-N	-1	3	326.272	1.733	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC(C)(C)C[C@H](C)O	ZINC000182476932	442773083	/nfs/dbraw/zinc/77/30/83/442773083.db2.gz	RQBMKBSROCGQFF-NSHDSACASA-N	-1	3	330.406	1.979	20	5		EDBDHM
C[C@H](NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccoc1	ZINC000180941792	318476526	/nfs/dbraw/zinc/47/65/26/318476526.db2.gz	JTJMANVZBKSFNL-NSHDSACASA-N	-1	3	339.373	1.817	20	5		EDBDHM
C[N-]S(=O)(=O)c1cc(NC(=O)CCC(C)(C)[N+](=O)[O-])ccc1F	ZINC000295949541	318653601	/nfs/dbraw/zinc/65/36/01/318653601.db2.gz	HACWZMYYKYFDSF-UHFFFAOYSA-N	-1	3	347.368	1.508	20	5		EDBDHM
O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1cc(=O)[n-]c(C2CC2)n1	ZINC000412991171	319257292	/nfs/dbraw/zinc/25/72/92/319257292.db2.gz	QPFIPUZIEKQFDA-UHFFFAOYSA-N	-1	3	328.284	1.924	20	5		EDBDHM
CN(C)[C@@]1(CNC(=O)c2ccc([N+](=O)[O-])c([O-])c2)CCSC1	ZINC000267118379	443348147	/nfs/dbraw/zinc/34/81/47/443348147.db2.gz	OZWZPCHOHYSNHH-CQSZACIVSA-N	-1	3	325.390	1.468	20	5		EDBDHM
CC(C)N1CC[C@H]([N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000272146106	443540249	/nfs/dbraw/zinc/54/02/49/443540249.db2.gz	BNIFLOXIUQRIQE-LBPRGKRZSA-N	-1	3	341.314	1.812	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC1CCCC1	ZINC000267735831	443559318	/nfs/dbraw/zinc/55/93/18/443559318.db2.gz	KRDAXGMZSZREOH-JTQLQIEISA-N	-1	3	342.373	1.747	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCC1CC1	ZINC000273604573	443582450	/nfs/dbraw/zinc/58/24/50/443582450.db2.gz	SBPFFSODHSKRRN-UHFFFAOYSA-N	-1	3	328.346	1.460	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-][C@@H]1Cc2cccc(O)c2C1	ZINC000428384640	319909297	/nfs/dbraw/zinc/90/92/97/319909297.db2.gz	OLFMPOGWILWPNT-LLVKDONJSA-N	-1	3	334.353	1.746	20	5		EDBDHM
Cc1cc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)ccc1OCCO	ZINC000440303655	320070405	/nfs/dbraw/zinc/07/04/05/320070405.db2.gz	KQPWCDSTMOMPSL-UHFFFAOYSA-N	-1	3	333.300	1.627	20	5		EDBDHM
CCN(C)C(=O)[C@H](C)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000276561316	443747053	/nfs/dbraw/zinc/74/70/53/443747053.db2.gz	HNDLZALBYOIQER-VIFPVBQESA-N	-1	3	329.303	1.670	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C[C@@H](O)C(C)(C)C)c1[N+](=O)[O-]	ZINC000276892336	443867933	/nfs/dbraw/zinc/86/79/33/443867933.db2.gz	UMMSWSREMBKVJY-LLVKDONJSA-N	-1	3	330.406	1.897	20	5		EDBDHM
COCCOCC[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000299095647	443953164	/nfs/dbraw/zinc/95/31/64/443953164.db2.gz	VOSFRUHPCLSAGQ-UHFFFAOYSA-N	-1	3	332.378	1.153	20	5		EDBDHM
O=C([N-]c1nncn1C1CC1)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	ZINC000285873418	444136571	/nfs/dbraw/zinc/13/65/71/444136571.db2.gz	QLCGXZOHBLHTCD-ZDUSSCGKSA-N	-1	3	342.315	1.653	20	5		EDBDHM
CC[C@H](C)[C@@H]([N-]c1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C(N)=O	ZINC000302103220	444204351	/nfs/dbraw/zinc/20/43/51/444204351.db2.gz	VZSORHBKEYVYQS-IMTBSYHQSA-N	-1	3	335.407	1.372	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H]2CCC[C@]2(C)CO)c([N+](=O)[O-])c1	ZINC000331170585	444428867	/nfs/dbraw/zinc/42/88/67/444428867.db2.gz	JKGHXSHQWXIYPF-UONOGXRCSA-N	-1	3	344.389	1.433	20	5		EDBDHM
Cc1noc(C(C)(C)[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)n1	ZINC000340765476	444503677	/nfs/dbraw/zinc/50/36/77/444503677.db2.gz	GKCIFBGLDSSWPF-UHFFFAOYSA-N	-1	3	340.361	1.808	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CCCS1	ZINC000340889415	444560706	/nfs/dbraw/zinc/56/07/06/444560706.db2.gz	SVZZCSCBKHSISD-JTQLQIEISA-N	-1	3	332.403	1.777	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCc2cnccn2)cc1C	ZINC000341184047	444715630	/nfs/dbraw/zinc/71/56/30/444715630.db2.gz	JIPHTCVTMSGFFV-UHFFFAOYSA-N	-1	3	336.373	1.523	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1C[N-]S(=O)(=O)Cc1cc(C)no1	ZINC000343994490	444716357	/nfs/dbraw/zinc/71/63/57/444716357.db2.gz	SKBWGYZNSHMPOH-UHFFFAOYSA-N	-1	3	341.345	1.519	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CCC[C@@H]1OC	ZINC000341185310	444716524	/nfs/dbraw/zinc/71/65/24/444716524.db2.gz	APHVNVQVNYKAAN-PWSUYJOCSA-N	-1	3	344.389	1.697	20	5		EDBDHM
CCC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C(=O)OC	ZINC000342531253	444734042	/nfs/dbraw/zinc/73/40/42/444734042.db2.gz	QWZJORYVSSZSTL-QMMMGPOBSA-N	-1	3	336.391	1.585	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CC[C@H]1CCOC1	ZINC000343960689	444696159	/nfs/dbraw/zinc/69/61/59/444696159.db2.gz	IFRZFFYBCJFWHN-JTQLQIEISA-N	-1	3	330.362	1.308	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCSCCCO)cc1[N+](=O)[O-]	ZINC000342534150	444735173	/nfs/dbraw/zinc/73/51/73/444735173.db2.gz	VDUFRARAUCXXNI-UHFFFAOYSA-N	-1	3	340.448	1.359	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@]2(C)CCO[C@@H]2C)c([N+](=O)[O-])c1	ZINC000344137443	444801846	/nfs/dbraw/zinc/80/18/46/444801846.db2.gz	YKVNBKPCRJYBON-RNCFNFMXSA-N	-1	3	330.362	1.449	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000336870716	444814776	/nfs/dbraw/zinc/81/47/76/444814776.db2.gz	KCVACWZOXVFNAR-SNVBAGLBSA-N	-1	3	344.389	1.744	20	5		EDBDHM
Cc1nn(C)cc1C[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000341431266	444826478	/nfs/dbraw/zinc/82/64/78/444826478.db2.gz	WCRSDEYMZSUGON-UHFFFAOYSA-N	-1	3	338.389	1.732	20	5		EDBDHM
COc1ccc(CNC(=O)c2cc(=O)[n-]c(N(C)C)n2)cc1[N+](=O)[O-]	ZINC000338751331	444836142	/nfs/dbraw/zinc/83/61/42/444836142.db2.gz	VDVUAKZEFFQLRK-UHFFFAOYSA-N	-1	3	347.331	1.095	20	5		EDBDHM
COc1ccc(C(=O)NCC(=O)Nc2ncccc2[O-])cc1[N+](=O)[O-]	ZINC000344205197	444838456	/nfs/dbraw/zinc/83/84/56/444838456.db2.gz	XLOAUHZQGPLDDN-UHFFFAOYSA-N	-1	3	346.299	1.073	20	5		EDBDHM
CS(=O)(=O)[N-]c1cc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)ccc1F	ZINC000344417220	444954078	/nfs/dbraw/zinc/95/40/78/444954078.db2.gz	KBXJXXKZTGCTRW-UHFFFAOYSA-N	-1	3	342.308	1.686	20	5		EDBDHM
CCC1([N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])CCOCC1	ZINC000330554314	445032100	/nfs/dbraw/zinc/03/21/00/445032100.db2.gz	YSWPOYRLMGRNIC-UHFFFAOYSA-N	-1	3	344.389	1.841	20	5		EDBDHM
COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CCC[C@@H]1F	ZINC000339117638	445039628	/nfs/dbraw/zinc/03/96/28/445039628.db2.gz	BHNXZMBHQUQKPS-QWRGUYRKSA-N	-1	3	346.336	1.550	20	5		EDBDHM
C[C@@]1(C[N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCOC1	ZINC000354503216	445267086	/nfs/dbraw/zinc/26/70/86/445267086.db2.gz	VRNAHZHTWKFGAG-LBPRGKRZSA-N	-1	3	334.781	1.953	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@]1(C)CCOC1	ZINC000354506298	445268899	/nfs/dbraw/zinc/26/88/99/445268899.db2.gz	ZABPSFOTCGTULN-ZDUSSCGKSA-N	-1	3	330.362	1.308	20	5		EDBDHM
CN(C(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000348344003	445262764	/nfs/dbraw/zinc/26/27/64/445262764.db2.gz	MDILYZSRKJOWTD-UHFFFAOYSA-N	-1	3	349.368	1.536	20	5		EDBDHM
Cc1ccsc1[C@@H](CO)[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000354623242	445318472	/nfs/dbraw/zinc/31/84/72/445318472.db2.gz	LHYZBNFNWMBNHG-GFCCVEGCSA-N	-1	3	342.398	1.977	20	5		EDBDHM
CC[C@@](C)([N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(=O)OC	ZINC000354631857	445321860	/nfs/dbraw/zinc/32/18/60/445321860.db2.gz	ZUISHMWIVZDITF-CQSZACIVSA-N	-1	3	344.389	1.832	20	5		EDBDHM
O=C([N-]c1n[nH]c2ccc([N+](=O)[O-])cc21)c1ncoc1[C@H]1CCCO1	ZINC000354522437	445278152	/nfs/dbraw/zinc/27/81/52/445278152.db2.gz	SSYXWMDKTZAYHN-LLVKDONJSA-N	-1	3	343.299	2.563	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1ncccc1[O-]	ZINC000360022019	445533093	/nfs/dbraw/zinc/53/30/93/445533093.db2.gz	HDKVEKPZCHZXFA-UHFFFAOYSA-N	-1	3	339.329	1.183	20	5		EDBDHM
CCC[C@H]([N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C(=O)OC	ZINC000358600242	445669274	/nfs/dbraw/zinc/66/92/74/445669274.db2.gz	NZMPAWGCDXYLTK-LBPRGKRZSA-N	-1	3	330.362	1.356	20	5		EDBDHM
Cc1cc(C(=O)N2CC[C@@H](C(=O)N3CCCC3)C2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000366212249	446084883	/nfs/dbraw/zinc/08/48/83/446084883.db2.gz	FSCROQODFASVPH-LLVKDONJSA-N	-1	3	348.359	1.088	20	5		EDBDHM
C/C=C\C[C@H](CO)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000351597653	446194551	/nfs/dbraw/zinc/19/45/51/446194551.db2.gz	RCGMKESSVWTNAA-MXQLGCADSA-N	-1	3	334.781	1.854	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H]2CC[C@H]2O)c(C(F)(F)F)c1	ZINC000425209104	447064453	/nfs/dbraw/zinc/06/44/53/447064453.db2.gz	QLSNZKSSOGBRRA-RKDXNWHRSA-N	-1	3	340.279	1.415	20	5		EDBDHM
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1[n-]nnc1C(=O)NC1CC1	ZINC000421555335	447185551	/nfs/dbraw/zinc/18/55/51/447185551.db2.gz	OKSQGKXCPCVXHD-UHFFFAOYSA-N	-1	3	344.331	1.474	20	5		EDBDHM
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1nn[n-]c1C(=O)NC1CC1	ZINC000421555335	447185559	/nfs/dbraw/zinc/18/55/59/447185559.db2.gz	OKSQGKXCPCVXHD-UHFFFAOYSA-N	-1	3	344.331	1.474	20	5		EDBDHM
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1n[n-]nc1C(=O)NC1CC1	ZINC000421555335	447185565	/nfs/dbraw/zinc/18/55/65/447185565.db2.gz	OKSQGKXCPCVXHD-UHFFFAOYSA-N	-1	3	344.331	1.474	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CCc2cn(C)cn2)c1C	ZINC000416531684	447637225	/nfs/dbraw/zinc/63/72/25/447637225.db2.gz	HEZQQUHRJMYHQR-UHFFFAOYSA-N	-1	3	338.389	1.466	20	5		EDBDHM
CC[C@@H]1C[C@@H]([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2OC)CCO1	ZINC000591468231	448373833	/nfs/dbraw/zinc/37/38/33/448373833.db2.gz	XEOONSXJHMLAOL-WDEREUQCSA-N	-1	3	344.389	1.839	20	5		EDBDHM
CC(C)(C(=O)[O-])N1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1	ZINC000584721637	448609115	/nfs/dbraw/zinc/60/91/15/448609115.db2.gz	DNZPZDVOVXFHIM-UHFFFAOYSA-N	-1	3	334.376	1.548	20	5		EDBDHM
CCOc1cc(CN2CC[C@@](COC)(C(=O)[O-])C2)ccc1[N+](=O)[O-]	ZINC000573498507	448642607	/nfs/dbraw/zinc/64/26/07/448642607.db2.gz	GYTKSWIKYHLTFP-MRXNPFEDSA-N	-1	3	338.360	1.917	20	5		EDBDHM
CO[C@@H]1[C@@H](C)[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1(C)C	ZINC000593572274	449081013	/nfs/dbraw/zinc/08/10/13/449081013.db2.gz	HGHVKTZHORDMFA-XXILOJSOSA-N	-1	3	329.378	1.328	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)COCC1CC1	ZINC000593653972	449132467	/nfs/dbraw/zinc/13/24/67/449132467.db2.gz	MPTZIEYNEBNBGX-JTQLQIEISA-N	-1	3	344.389	1.697	20	5		EDBDHM
CC1(C)CCCN1CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593605042	449103455	/nfs/dbraw/zinc/10/34/55/449103455.db2.gz	DWYWVBFZBXNLJA-UHFFFAOYSA-N	-1	3	328.394	1.143	20	5		EDBDHM
COC(=O)[C@H](CCF)[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000593633747	449119570	/nfs/dbraw/zinc/11/95/70/449119570.db2.gz	PVRZSVSTBOMZQC-JTQLQIEISA-N	-1	3	348.352	1.391	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCCN(C)C2)cc1C	ZINC000604278234	449200809	/nfs/dbraw/zinc/20/08/09/449200809.db2.gz	XATPVZOQHLFKBV-GFCCVEGCSA-N	-1	3	327.406	1.584	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H](C)c2nncn2C)c(F)cc1[N+](=O)[O-]	ZINC000590591450	449206575	/nfs/dbraw/zinc/20/65/75/449206575.db2.gz	OQUKSLKKSKMEFH-QMMMGPOBSA-N	-1	3	343.340	1.210	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H](CO)C(C)(C)C)c(F)cc1[N+](=O)[O-]	ZINC000590590878	449206620	/nfs/dbraw/zinc/20/66/20/449206620.db2.gz	KZCBCUKRUZVENH-GFCCVEGCSA-N	-1	3	334.369	1.728	20	5		EDBDHM
O=[N+]([O-])c1ccc([O-])cc1CN1CCCN(C[C@@H]2CCCO2)CC1	ZINC000611254008	449239541	/nfs/dbraw/zinc/23/95/41/449239541.db2.gz	DNWLZSMXHGEQQB-INIZCTEOSA-N	-1	3	335.404	1.987	20	5		EDBDHM
CC(C)n1ccc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)n1	ZINC000593549977	449341045	/nfs/dbraw/zinc/34/10/45/449341045.db2.gz	YNXSSZJAPKDHAE-UHFFFAOYSA-N	-1	3	325.350	1.246	20	5		EDBDHM
COc1cc(CN2CCN(C(C)(C)C(=O)[O-])CC2)ccc1[N+](=O)[O-]	ZINC000600672890	449486037	/nfs/dbraw/zinc/48/60/37/449486037.db2.gz	VQGSXPMPPWTQRU-UHFFFAOYSA-N	-1	3	337.376	1.584	20	5		EDBDHM
CO[C@@H](C[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000594790731	449700563	/nfs/dbraw/zinc/70/05/63/449700563.db2.gz	GYTHCODGJXEMLV-YPMHNXCESA-N	-1	3	344.389	1.233	20	5		EDBDHM
CC(C)(C)N1CC[C@@H]1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000594792448	449701902	/nfs/dbraw/zinc/70/19/02/449701902.db2.gz	QVXIKLLMYRKCQT-LLVKDONJSA-N	-1	3	327.406	1.746	20	5		EDBDHM
COC[C@H](CC[N-]S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])OC	ZINC000594795591	449706948	/nfs/dbraw/zinc/70/69/48/449706948.db2.gz	OVRCNAWIHAJAEX-LBPRGKRZSA-N	-1	3	346.405	1.541	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](CO)C1CCC1	ZINC000594803901	449716339	/nfs/dbraw/zinc/71/63/39/449716339.db2.gz	HXRNOBUUHAPCBF-SNVBAGLBSA-N	-1	3	330.362	1.043	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C1(CO)CC1	ZINC000594826645	449733516	/nfs/dbraw/zinc/73/35/16/449733516.db2.gz	HONQOARIUZVOMG-QMMMGPOBSA-N	-1	3	334.781	1.688	20	5		EDBDHM
O=C(c1ccc([N+](=O)[O-])cc1[O-])N1CCN(c2ccncc2)CC1	ZINC000612422899	449694648	/nfs/dbraw/zinc/69/46/48/449694648.db2.gz	JNJNHGHGURQONC-UHFFFAOYSA-N	-1	3	328.328	1.658	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1C[C@H](O)C12CCC2	ZINC000594865888	449780875	/nfs/dbraw/zinc/78/08/75/449780875.db2.gz	STXWSVJXQKZCAE-OLZOCXBDSA-N	-1	3	342.373	1.185	20	5		EDBDHM
COc1cc(CN[C@@H]2CC[C@H](C)S(=O)(=O)C2)c([N+](=O)[O-])cc1[O-]	ZINC000594978065	449825978	/nfs/dbraw/zinc/82/59/78/449825978.db2.gz	WTUOUCHCRLIISJ-GXSJLCMTSA-N	-1	3	344.389	1.364	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2CN(C3CC3)C[C@H]2C)c([N+](=O)[O-])s1	ZINC000601370371	449884919	/nfs/dbraw/zinc/88/49/19/449884919.db2.gz	XTZDJXDBCIOFGG-LDYMZIIASA-N	-1	3	345.446	1.726	20	5		EDBDHM
CCCN1CC[C@@H]([N-]S(=O)(=O)c2cc(C)sc2[N+](=O)[O-])C1	ZINC000601467910	449992256	/nfs/dbraw/zinc/99/22/56/449992256.db2.gz	ADZQVJDUYRMQIB-SNVBAGLBSA-N	-1	3	333.435	1.727	20	5		EDBDHM
COC(=O)[C@@](C)([N-]S(=O)(=O)C1(C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000599483765	450012231	/nfs/dbraw/zinc/01/22/31/450012231.db2.gz	HIGUAPFKWPAEKU-AWEZNQCLSA-N	-1	3	342.373	1.455	20	5		EDBDHM
COc1nnc([N-]C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)s1	ZINC000616030202	450304704	/nfs/dbraw/zinc/30/47/04/450304704.db2.gz	XFXPRPSBUCIZPF-UHFFFAOYSA-N	-1	3	347.316	1.288	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1cncc(C)c1	ZINC000619494085	450490172	/nfs/dbraw/zinc/49/01/72/450490172.db2.gz	XWODZGSHXUIZHJ-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccc(Cc2nnn[n-]2)cc1	ZINC000533185945	491003810	/nfs/dbraw/zinc/00/38/10/491003810.db2.gz	XLPZJKXDVZCWGR-UHFFFAOYSA-N	-1	3	327.304	1.290	20	5		EDBDHM
Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccc(Cc2nn[n-]n2)cc1	ZINC000533185945	491003811	/nfs/dbraw/zinc/00/38/11/491003811.db2.gz	XLPZJKXDVZCWGR-UHFFFAOYSA-N	-1	3	327.304	1.290	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-])[C@@H]1CCCO1	ZINC000339451841	535807441	/nfs/dbraw/zinc/80/74/41/535807441.db2.gz	HMFPNUZFNVBQLO-YPMHNXCESA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cn1c(Cl)cnc1C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000728934079	578554639	/nfs/dbraw/zinc/55/46/39/578554639.db2.gz	YUHREFMWKQITJB-UHFFFAOYSA-N	-1	3	348.743	1.599	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)OCC(=O)[N-]C(=O)c1cccs1	ZINC000730012515	578606505	/nfs/dbraw/zinc/60/65/05/578606505.db2.gz	IXWWNLHJMLVZII-UHFFFAOYSA-N	-1	3	349.324	1.473	20	5		EDBDHM
CCCC(O)(CCC)CNc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000736434673	578988695	/nfs/dbraw/zinc/98/86/95/578988695.db2.gz	HGBNQIVGGAHVKC-UHFFFAOYSA-N	-1	3	335.368	1.913	20	5		EDBDHM
CCCC(O)(CCC)CNc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000736434673	578988696	/nfs/dbraw/zinc/98/86/96/578988696.db2.gz	HGBNQIVGGAHVKC-UHFFFAOYSA-N	-1	3	335.368	1.913	20	5		EDBDHM
CCn1c(C)nnc1Sc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000736720622	579015092	/nfs/dbraw/zinc/01/50/92/579015092.db2.gz	UXENISINUVUMAA-UHFFFAOYSA-N	-1	3	332.349	1.846	20	5		EDBDHM
CCn1c(C)nnc1Sc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000736720622	579015093	/nfs/dbraw/zinc/01/50/93/579015093.db2.gz	UXENISINUVUMAA-UHFFFAOYSA-N	-1	3	332.349	1.846	20	5		EDBDHM
COC(=O)CSCCNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000736931584	579033078	/nfs/dbraw/zinc/03/30/78/579033078.db2.gz	ZIHLCIFNNAAMFQ-UHFFFAOYSA-N	-1	3	338.349	1.093	20	5		EDBDHM
COC(=O)CSCCNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000736931584	579033079	/nfs/dbraw/zinc/03/30/79/579033079.db2.gz	ZIHLCIFNNAAMFQ-UHFFFAOYSA-N	-1	3	338.349	1.093	20	5		EDBDHM
CO[C@H](CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)C(F)(F)F	ZINC000736964540	579036432	/nfs/dbraw/zinc/03/64/32/579036432.db2.gz	YGUXHRCNWLYBCV-SECBINFHSA-N	-1	3	332.242	1.764	20	5		EDBDHM
CO[C@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)C(F)(F)F	ZINC000736964540	579036433	/nfs/dbraw/zinc/03/64/33/579036433.db2.gz	YGUXHRCNWLYBCV-SECBINFHSA-N	-1	3	332.242	1.764	20	5		EDBDHM
Cc1ccc([C@@H](O)CNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)o1	ZINC000737319373	579071490	/nfs/dbraw/zinc/07/14/90/579071490.db2.gz	HGCLPCOKYZDDPH-LBPRGKRZSA-N	-1	3	330.304	1.822	20	5		EDBDHM
Cc1ccc([C@@H](O)CNc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)o1	ZINC000737319373	579071491	/nfs/dbraw/zinc/07/14/91/579071491.db2.gz	HGCLPCOKYZDDPH-LBPRGKRZSA-N	-1	3	330.304	1.822	20	5		EDBDHM
COC1(C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)CCOCC1	ZINC000768864033	580222922	/nfs/dbraw/zinc/22/29/22/580222922.db2.gz	IJIVEYDVWJWHEH-UHFFFAOYSA-N	-1	3	336.391	1.130	20	5		EDBDHM
CS[C@@H](CO)[C@H](C)[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000768864407	580222940	/nfs/dbraw/zinc/22/29/40/580222940.db2.gz	BZLSKMQDCASTLH-XPUUQOCRSA-N	-1	3	326.421	1.047	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CCS(=O)(=O)[N-]c1ccnc2ncnn21	ZINC000790635337	580774345	/nfs/dbraw/zinc/77/43/45/580774345.db2.gz	GJMBZPMDGPNEEG-UHFFFAOYSA-N	-1	3	348.344	1.017	20	5		EDBDHM
Cc1n[n-]nc1C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000791047995	580783546	/nfs/dbraw/zinc/78/35/46/580783546.db2.gz	LHRVACBJBLYSTD-QMMMGPOBSA-N	-1	3	344.287	1.989	20	5		EDBDHM
O=C(NCc1ncccc1[O-])[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	ZINC000792611715	580823867	/nfs/dbraw/zinc/82/38/67/580823867.db2.gz	JEYVLATXLMMKSY-OAHLLOKOSA-N	-1	3	342.311	1.505	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H](O)c2ccsc2)c(-c2nnn[n-]2)c1	ZINC000738373763	598854930	/nfs/dbraw/zinc/85/49/30/598854930.db2.gz	GVHRETVQESVAHG-JTQLQIEISA-N	-1	3	333.333	1.377	20	5		EDBDHM
O=[N+]([O-])c1cnc(NC[C@H](O)c2ccsc2)c(-c2nn[n-]n2)c1	ZINC000738373763	598854931	/nfs/dbraw/zinc/85/49/31/598854931.db2.gz	GVHRETVQESVAHG-JTQLQIEISA-N	-1	3	333.333	1.377	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCc2nccs2)c(-c2nnn[n-]2)c1	ZINC000738373836	598914894	/nfs/dbraw/zinc/91/48/94/598914894.db2.gz	HUEXEBCUNFUIFH-UHFFFAOYSA-N	-1	3	332.349	1.671	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCCc2nccs2)c(-c2nn[n-]n2)c1	ZINC000738373836	598914896	/nfs/dbraw/zinc/91/48/96/598914896.db2.gz	HUEXEBCUNFUIFH-UHFFFAOYSA-N	-1	3	332.349	1.671	20	5		EDBDHM
COc1c([O-])ccc(CN2CCN(C[C@H](C)O)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000894158944	591211453	/nfs/dbraw/zinc/21/14/53/591211453.db2.gz	RCCISRCJBLDDBM-RYUDHWBXSA-N	-1	3	339.392	1.196	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@H]2COC[C@H]2C2CC2)c(F)cc1[N+](=O)[O-]	ZINC000908411607	592485537	/nfs/dbraw/zinc/48/55/37/592485537.db2.gz	SUYVDAYQARGHOF-CMPLNLGQSA-N	-1	3	344.364	1.746	20	5		EDBDHM
CN1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@@H](C(=O)[O-])C1	ZINC000910320353	592831442	/nfs/dbraw/zinc/83/14/42/592831442.db2.gz	OAJILPDTHLWYHP-VIFPVBQESA-N	-1	3	345.302	1.649	20	5		EDBDHM
Cc1cc(NCCCN2CCN(C)CC2)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000910339701	592837751	/nfs/dbraw/zinc/83/77/51/592837751.db2.gz	JLRRPNYCEXAWFN-UHFFFAOYSA-N	-1	3	336.392	1.651	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2C[C@H](C)OC2=O)c1C	ZINC000809383430	593335577	/nfs/dbraw/zinc/33/55/77/593335577.db2.gz	XTWQJZPVYZSEQI-WPRPVWTQSA-N	-1	3	328.346	1.194	20	5		EDBDHM
CC(C)n1nnnc1Sc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000820220403	593800124	/nfs/dbraw/zinc/80/01/24/593800124.db2.gz	UCLMTELYZPIRGH-UHFFFAOYSA-N	-1	3	333.337	1.494	20	5		EDBDHM
CC(C)n1nnnc1Sc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000820220403	593800125	/nfs/dbraw/zinc/80/01/25/593800125.db2.gz	UCLMTELYZPIRGH-UHFFFAOYSA-N	-1	3	333.337	1.494	20	5		EDBDHM
CC[C@](C)(O)CNc1cc(-c2nnn[n-]2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820862760	593909507	/nfs/dbraw/zinc/90/95/07/593909507.db2.gz	RJSMSTKLYKHBJN-HNNXBMFYSA-N	-1	3	343.347	1.896	20	5		EDBDHM
CC[C@](C)(O)CNc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1	ZINC000820862760	593909509	/nfs/dbraw/zinc/90/95/09/593909509.db2.gz	RJSMSTKLYKHBJN-HNNXBMFYSA-N	-1	3	343.347	1.896	20	5		EDBDHM
CC(C)(NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1ccc([N+](=O)[O-])cc1	ZINC000824167285	593943926	/nfs/dbraw/zinc/94/39/26/593943926.db2.gz	QGVXESRUPJWAFT-UHFFFAOYSA-N	-1	3	341.331	1.768	20	5		EDBDHM
CC(C)(NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1ccc([N+](=O)[O-])cc1	ZINC000824167285	593943929	/nfs/dbraw/zinc/94/39/29/593943929.db2.gz	QGVXESRUPJWAFT-UHFFFAOYSA-N	-1	3	341.331	1.768	20	5		EDBDHM
O=C(NCCNc1ccc(-c2nnn[n-]2)c([N+](=O)[O-])c1)c1ccco1	ZINC000823202584	594169262	/nfs/dbraw/zinc/16/92/62/594169262.db2.gz	XOQVTZPTKPQOJC-UHFFFAOYSA-N	-1	3	343.303	1.210	20	5		EDBDHM
CCOC(=O)CN(CC(C)C)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825511757	594195073	/nfs/dbraw/zinc/19/50/73/594195073.db2.gz	DKBBLIAWPCKVJY-UHFFFAOYSA-N	-1	3	348.363	1.800	20	5		EDBDHM
CCOC(=O)CN(CC(C)C)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825511757	594195075	/nfs/dbraw/zinc/19/50/75/594195075.db2.gz	DKBBLIAWPCKVJY-UHFFFAOYSA-N	-1	3	348.363	1.800	20	5		EDBDHM
O=C(OCCc1ccc([N+](=O)[O-])cc1)c1cc(-c2nnn[n-]2)c[nH]1	ZINC000823410194	594198812	/nfs/dbraw/zinc/19/88/12/594198812.db2.gz	QUYMNAZKWWTXMV-UHFFFAOYSA-N	-1	3	328.288	1.503	20	5		EDBDHM
O=C(OCCc1ccc([N+](=O)[O-])cc1)c1cc(-c2nn[n-]n2)c[nH]1	ZINC000823410194	594198814	/nfs/dbraw/zinc/19/88/14/594198814.db2.gz	QUYMNAZKWWTXMV-UHFFFAOYSA-N	-1	3	328.288	1.503	20	5		EDBDHM
O=C(Oc1ccc(-c2nnn[n-]2)cc1F)c1ccc([N+](=O)[O-])cn1	ZINC000823451074	594203354	/nfs/dbraw/zinc/20/33/54/594203354.db2.gz	UMEWMYZRMFORNZ-UHFFFAOYSA-N	-1	3	330.235	1.528	20	5		EDBDHM
O=C(Oc1ccc(-c2nn[n-]n2)cc1F)c1ccc([N+](=O)[O-])cn1	ZINC000823451074	594203355	/nfs/dbraw/zinc/20/33/55/594203355.db2.gz	UMEWMYZRMFORNZ-UHFFFAOYSA-N	-1	3	330.235	1.528	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCOC2(CCCC2)C1	ZINC000823630078	594222922	/nfs/dbraw/zinc/22/29/22/594222922.db2.gz	QSHGRQZJUHAJKZ-UHFFFAOYSA-N	-1	3	330.348	1.924	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCOC2(CCCC2)C1	ZINC000823630078	594222923	/nfs/dbraw/zinc/22/29/23/594222923.db2.gz	QSHGRQZJUHAJKZ-UHFFFAOYSA-N	-1	3	330.348	1.924	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@@H]2c3ccccc3C[C@H]2O)c(-c2nnn[n-]2)c1	ZINC000823651073	594224615	/nfs/dbraw/zinc/22/46/15/594224615.db2.gz	DOFDXHCKGPINER-CHWSQXEVSA-N	-1	3	339.315	1.240	20	5		EDBDHM
O=[N+]([O-])c1cnc(N[C@@H]2c3ccccc3C[C@H]2O)c(-c2nn[n-]n2)c1	ZINC000823651073	594224616	/nfs/dbraw/zinc/22/46/16/594224616.db2.gz	DOFDXHCKGPINER-CHWSQXEVSA-N	-1	3	339.315	1.240	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCc3ccc(F)cc3C2)c(-c2nnn[n-]2)c1	ZINC000823650820	594224625	/nfs/dbraw/zinc/22/46/25/594224625.db2.gz	BLWUIMRMNKWIRM-UHFFFAOYSA-N	-1	3	341.306	1.872	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCc3ccc(F)cc3C2)c(-c2nn[n-]n2)c1	ZINC000823650820	594224626	/nfs/dbraw/zinc/22/46/26/594224626.db2.gz	BLWUIMRMNKWIRM-UHFFFAOYSA-N	-1	3	341.306	1.872	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCC[C@H]2CCCC[C@@H]2O)c(-c2nnn[n-]2)c1	ZINC000823651421	594224771	/nfs/dbraw/zinc/22/47/71/594224771.db2.gz	JBGWUGFASISWPA-MFKMUULPSA-N	-1	3	347.379	1.913	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCCC[C@H]2CCCC[C@@H]2O)c(-c2nn[n-]n2)c1	ZINC000823651421	594224772	/nfs/dbraw/zinc/22/47/72/594224772.db2.gz	JBGWUGFASISWPA-MFKMUULPSA-N	-1	3	347.379	1.913	20	5		EDBDHM
O=[N+]([O-])c1sccc1NCCNc1ncccc1-c1nnn[n-]1	ZINC000823652304	594224915	/nfs/dbraw/zinc/22/49/15/594224915.db2.gz	ZHIWNWMGDADPQK-UHFFFAOYSA-N	-1	3	332.349	1.755	20	5		EDBDHM
O=[N+]([O-])c1sccc1NCCNc1ncccc1-c1nn[n-]n1	ZINC000823652304	594224916	/nfs/dbraw/zinc/22/49/16/594224916.db2.gz	ZHIWNWMGDADPQK-UHFFFAOYSA-N	-1	3	332.349	1.755	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1OC(=O)c1c[nH]c(-c2nnn[n-]2)c1	ZINC000826212026	594380932	/nfs/dbraw/zinc/38/09/32/594380932.db2.gz	DJMKDGBMSJKURU-UHFFFAOYSA-N	-1	3	330.260	1.331	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1OC(=O)c1c[nH]c(-c2nn[n-]n2)c1	ZINC000826212026	594380934	/nfs/dbraw/zinc/38/09/34/594380934.db2.gz	DJMKDGBMSJKURU-UHFFFAOYSA-N	-1	3	330.260	1.331	20	5		EDBDHM
Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)c1cc(-c3nnn[n-]3)c[nH]1)CC2	ZINC000826272858	594406702	/nfs/dbraw/zinc/40/67/02/594406702.db2.gz	DXOHUWLYXUGBGU-UHFFFAOYSA-N	-1	3	339.315	1.614	20	5		EDBDHM
Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)c1cc(-c3nn[n-]n3)c[nH]1)CC2	ZINC000826272858	594406704	/nfs/dbraw/zinc/40/67/04/594406704.db2.gz	DXOHUWLYXUGBGU-UHFFFAOYSA-N	-1	3	339.315	1.614	20	5		EDBDHM
O=C(Nc1cc(-c2nnn[n-]2)cc([N+](=O)[O-])c1Cl)[C@@H]1CCCO1	ZINC000826450303	594480701	/nfs/dbraw/zinc/48/07/01/594480701.db2.gz	FZHUTIBAWMFFLM-VIFPVBQESA-N	-1	3	338.711	1.546	20	5		EDBDHM
O=C(Nc1cc(-c2nn[n-]n2)cc([N+](=O)[O-])c1Cl)[C@@H]1CCCO1	ZINC000826450303	594480702	/nfs/dbraw/zinc/48/07/02/594480702.db2.gz	FZHUTIBAWMFFLM-VIFPVBQESA-N	-1	3	338.711	1.546	20	5		EDBDHM
O=C(Oc1cc(Cl)ccc1[N+](=O)[O-])c1c[nH]c(-c2nnn[n-]2)c1	ZINC000826468591	594488608	/nfs/dbraw/zinc/48/86/08/594488608.db2.gz	ZAKUVRVLIWUCLD-UHFFFAOYSA-N	-1	3	334.679	1.976	20	5		EDBDHM
O=C(Oc1cc(Cl)ccc1[N+](=O)[O-])c1c[nH]c(-c2nn[n-]n2)c1	ZINC000826468591	594488610	/nfs/dbraw/zinc/48/86/10/594488610.db2.gz	ZAKUVRVLIWUCLD-UHFFFAOYSA-N	-1	3	334.679	1.976	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1OC[C@H](O)c1ccccc1	ZINC000826497294	594501948	/nfs/dbraw/zinc/50/19/48/594501948.db2.gz	BNLDYRHITWMZNU-ZDUSSCGKSA-N	-1	3	327.300	1.887	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1OC[C@H](O)c1ccccc1	ZINC000826497294	594501951	/nfs/dbraw/zinc/50/19/51/594501951.db2.gz	BNLDYRHITWMZNU-ZDUSSCGKSA-N	-1	3	327.300	1.887	20	5		EDBDHM
C[C@@H]1CN(CCC(=O)[O-])CCN1CCOc1ccc([N+](=O)[O-])cc1	ZINC000833629142	594891720	/nfs/dbraw/zinc/89/17/20/594891720.db2.gz	ROQWUAWVOZRPKX-CYBMUJFWSA-N	-1	3	337.376	1.454	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN2CCC[C@@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000867148187	594892956	/nfs/dbraw/zinc/89/29/56/594892956.db2.gz	OLXGYQQJEDIFMC-NSHDSACASA-N	-1	3	345.396	1.805	20	5		EDBDHM
CCOc1cc(N2CCN(CCC(=O)[O-])C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000833660034	594900187	/nfs/dbraw/zinc/90/01/87/594900187.db2.gz	AVKRNZBIVHUEAP-GFCCVEGCSA-N	-1	3	337.376	1.979	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C2(CN(C)C)CCC2)cc1F	ZINC000867225395	595068279	/nfs/dbraw/zinc/06/82/79/595068279.db2.gz	PKWLRBBIKTURMG-UHFFFAOYSA-N	-1	3	345.396	1.805	20	5		EDBDHM
CCO[N-]C(=O)CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000846088170	595139998	/nfs/dbraw/zinc/13/99/98/595139998.db2.gz	JEKLBRSXZDLMFW-UHFFFAOYSA-N	-1	3	333.348	1.153	20	5		EDBDHM
CCN1CC[C@@H]([N-]C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1=O	ZINC000848592059	595412078	/nfs/dbraw/zinc/41/20/78/595412078.db2.gz	WGKDYOOFDYIDEJ-LLVKDONJSA-N	-1	3	343.286	1.303	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])N1CCCCC1	ZINC000849371799	595514936	/nfs/dbraw/zinc/51/49/36/595514936.db2.gz	WJLWAIOWVFAPHQ-NSHDSACASA-N	-1	3	328.394	1.143	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(C(=O)NCCCc2cc(=O)[nH][n-]2)cc1Cl	ZINC000854487935	596096142	/nfs/dbraw/zinc/09/61/42/596096142.db2.gz	PUZVXKOADVQALL-UHFFFAOYSA-N	-1	3	338.751	1.943	20	5		EDBDHM
CON(C)C(=O)[C@@H](C)[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000863521824	596607952	/nfs/dbraw/zinc/60/79/52/596607952.db2.gz	MPCBRQCPBUIHKP-MRVPVSSYSA-N	-1	3	347.274	1.091	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H]2CCC[C@H]3OCC[C@@H]32)cs1	ZINC000119996424	596840995	/nfs/dbraw/zinc/84/09/95/596840995.db2.gz	JCTZZPQTTNFFRX-GMTAPVOTSA-N	-1	3	332.403	1.892	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@H]2Cn2cncn2)c(-c2nnn[n-]2)c1	ZINC000738370937	598338285	/nfs/dbraw/zinc/33/82/85/598338285.db2.gz	SUSBVGHGVCODKO-NSHDSACASA-N	-1	3	341.335	1.035	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CCC[C@H]2Cn2cncn2)c(-c2nn[n-]n2)c1	ZINC000738370937	598338286	/nfs/dbraw/zinc/33/82/86/598338286.db2.gz	SUSBVGHGVCODKO-NSHDSACASA-N	-1	3	341.335	1.035	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NCc1nncn1C1CC1	ZINC000738360790	598628751	/nfs/dbraw/zinc/62/87/51/598628751.db2.gz	ZAHXFEARWRCEDR-UHFFFAOYSA-N	-1	3	327.308	1.313	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NCc1nncn1C1CC1	ZINC000738360790	598628753	/nfs/dbraw/zinc/62/87/53/598628753.db2.gz	ZAHXFEARWRCEDR-UHFFFAOYSA-N	-1	3	327.308	1.313	20	5		EDBDHM
CC(C)[C@](C)(CNC(=O)[O-])NCc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000738773675	603080122	/nfs/dbraw/zinc/08/01/22/603080122.db2.gz	UKEBFPSIZKJPCI-HNNXBMFYSA-N	-1	3	338.364	1.466	20	5		EDBDHM
CO[C@H]1CCN(c2cc(-c3nnn[n-]3)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000821697445	606425379	/nfs/dbraw/zinc/42/53/79/606425379.db2.gz	AISILUNFMZEPRE-JTQLQIEISA-N	-1	3	341.331	1.548	20	5		EDBDHM
CO[C@H]1CCN(c2cc(-c3nn[n-]n3)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000821697445	606425380	/nfs/dbraw/zinc/42/53/80/606425380.db2.gz	AISILUNFMZEPRE-JTQLQIEISA-N	-1	3	341.331	1.548	20	5		EDBDHM
CC[C@@H](NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cccc([N+](=O)[O-])c1	ZINC000825133157	609221942	/nfs/dbraw/zinc/22/19/42/609221942.db2.gz	KHLWJMXPXVBOQB-GFCCVEGCSA-N	-1	3	341.331	1.984	20	5		EDBDHM
CC[C@@H](NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cccc([N+](=O)[O-])c1	ZINC000825133157	609221944	/nfs/dbraw/zinc/22/19/44/609221944.db2.gz	KHLWJMXPXVBOQB-GFCCVEGCSA-N	-1	3	341.331	1.984	20	5		EDBDHM
CC[C@@](C)(O)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl	ZINC000160299023	529512894	/nfs/dbraw/zinc/51/28/94/529512894.db2.gz	MTYBURQTSBQDIJ-GFCCVEGCSA-N	-1	3	336.797	1.996	20	5		EDBDHM
CO[C@H]1C[C@H]([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C1(C)C	ZINC000440384332	305205127	/nfs/dbraw/zinc/20/51/27/305205127.db2.gz	VRMKMOSCDZMEKA-RYUDHWBXSA-N	-1	3	328.390	1.995	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCCc2cnn(C)c2)cc1[N+](=O)[O-]	ZINC000123539004	138319195	/nfs/dbraw/zinc/31/91/95/138319195.db2.gz	RGPXZWGOKDFYAO-UHFFFAOYSA-N	-1	3	344.418	1.609	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC[C@H](C)[S@@](C)=O	ZINC000124088890	138323677	/nfs/dbraw/zinc/32/36/77/138323677.db2.gz	PSJBVZAWWUZNQU-FVINQWEUSA-N	-1	3	334.419	1.339	20	5		EDBDHM
CCC[C@@H]([N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C(N)=O	ZINC000352531945	283565632	/nfs/dbraw/zinc/56/56/32/283565632.db2.gz	QKHROEGQEVHGRI-SNVBAGLBSA-N	-1	3	329.378	1.144	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@H](CC(C)C)OC	ZINC000416652868	251096567	/nfs/dbraw/zinc/09/65/67/251096567.db2.gz	SULOHOYVXIAWSE-LBPRGKRZSA-N	-1	3	346.405	1.943	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1CC(=O)N(C(C)C)C1	ZINC000263730633	139356230	/nfs/dbraw/zinc/35/62/30/139356230.db2.gz	ZWWVAFUJYCAMTK-LLVKDONJSA-N	-1	3	341.389	1.191	20	5		EDBDHM
Cc1cc([N+](=O)[O-])cnc1[N-]c1ccn(CC(=O)N2CCOCC2)n1	ZINC000271359446	140284926	/nfs/dbraw/zinc/28/49/26/140284926.db2.gz	UMUNLIUCAFOIND-UHFFFAOYSA-N	-1	3	346.347	1.097	20	5		EDBDHM
O=C(Cn1cnc([N+](=O)[O-])n1)Nc1cc(Br)ccc1[O-]	ZINC000340319121	142340101	/nfs/dbraw/zinc/34/01/01/142340101.db2.gz	ZRQLEITWCRRAFG-UHFFFAOYSA-N	-1	3	342.109	1.293	20	5		EDBDHM
Cc1ncc(CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)c(=O)[n-]1	ZINC000344992365	143036366	/nfs/dbraw/zinc/03/63/66/143036366.db2.gz	ZUZQHFSBJSRTRJ-UHFFFAOYSA-N	-1	3	338.345	1.414	20	5		EDBDHM
CNC(=O)[C@H]1CCC[C@H]1[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000345513833	143100543	/nfs/dbraw/zinc/10/05/43/143100543.db2.gz	DPWMJFJJIBPLFQ-WDEREUQCSA-N	-1	3	341.389	1.096	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@](C)(C(N)=O)C(C)C)cc1[N+](=O)[O-]	ZINC000352627975	149092332	/nfs/dbraw/zinc/09/23/32/149092332.db2.gz	ZPNIARXUNODWDS-NSHDSACASA-N	-1	3	335.407	1.143	20	5		EDBDHM
CCO[C@H]1COCC[C@H]1[N-]S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000352997441	149245420	/nfs/dbraw/zinc/24/54/20/149245420.db2.gz	CTUQBKFSQKATAX-OCCSQVGLSA-N	-1	3	344.389	1.208	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)[C@H]1CCCOC1	ZINC000355716215	150372261	/nfs/dbraw/zinc/37/22/61/150372261.db2.gz	QKGHRZRYSRQRGW-ZJUUUORDSA-N	-1	3	332.353	1.827	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H](CO)CC2CCC2)c([N+](=O)[O-])c1	ZINC000360369346	152009538	/nfs/dbraw/zinc/00/95/38/152009538.db2.gz	MDUDHJSAXSIBMR-LBPRGKRZSA-N	-1	3	328.390	1.733	20	5		EDBDHM
O=C([N-]CCCN1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1)C(F)(F)F	ZINC000364336233	153208660	/nfs/dbraw/zinc/20/86/60/153208660.db2.gz	KFCXZNDNJSAZJH-SNVBAGLBSA-N	-1	3	349.313	1.497	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCc1cscn1	ZINC000072711948	287255849	/nfs/dbraw/zinc/25/58/49/287255849.db2.gz	SOGYFIHDACRYKR-UHFFFAOYSA-N	-1	3	343.386	1.581	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]C[C@@H]2CCN(C3CC3)C2)cc1[N+](=O)[O-]	ZINC000123099398	222215467	/nfs/dbraw/zinc/21/54/67/222215467.db2.gz	SNARSNUGYJTBOV-JTQLQIEISA-N	-1	3	345.446	1.727	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCNC(=O)C(C)(C)C)cc1[N+](=O)[O-]	ZINC000123499737	222287917	/nfs/dbraw/zinc/28/79/17/222287917.db2.gz	KAJHJWYZZKLBPT-UHFFFAOYSA-N	-1	3	349.434	1.405	20	5		EDBDHM
COc1ccc([N+](=O)[O-])c(C(=O)N2CCc3c(nc[n-]c3=O)C2)c1	ZINC000273229732	268002229	/nfs/dbraw/zinc/00/22/29/268002229.db2.gz	MGFPBBWNJZKMTN-UHFFFAOYSA-N	-1	3	330.300	1.298	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CC=C(C)C	ZINC000277120737	273180811	/nfs/dbraw/zinc/18/08/11/273180811.db2.gz	VGLQFCVNYQVYAQ-UHFFFAOYSA-N	-1	3	328.346	1.626	20	5		EDBDHM
CCN(CC[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C1CC1	ZINC000102183758	276130678	/nfs/dbraw/zinc/13/06/78/276130678.db2.gz	BPLILVUPEQECHH-UHFFFAOYSA-N	-1	3	327.406	1.666	20	5		EDBDHM
CCN1CC[C@H]([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000359935729	276230113	/nfs/dbraw/zinc/23/01/13/276230113.db2.gz	CZFZENBBCSRVEP-JTQLQIEISA-N	-1	3	333.797	1.621	20	5		EDBDHM
C[C@@H]1CN(C2CC2)C[C@H]1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000268117240	288132991	/nfs/dbraw/zinc/13/29/91/288132991.db2.gz	AEGPJQQCEUPGLU-ZYHUDNBSSA-N	-1	3	325.390	1.356	20	5		EDBDHM
CC[C@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl)C(N)=O	ZINC000292190936	289284595	/nfs/dbraw/zinc/28/45/95/289284595.db2.gz	QVEVTCUGDPKSMV-QMMMGPOBSA-N	-1	3	335.769	1.099	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H]1[C@H]2CCO[C@H]2C1(C)C	ZINC000246689542	302049234	/nfs/dbraw/zinc/04/92/34/302049234.db2.gz	BNNHGNQDAVBRHE-LERXQTSPSA-N	-1	3	340.401	1.995	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)CCCCO	ZINC000295843177	303274333	/nfs/dbraw/zinc/27/43/33/303274333.db2.gz	WMGQTXVORWTHFL-JTQLQIEISA-N	-1	3	332.378	1.433	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]C[C@H]2CC[C@@H](CO)O2)cc1C	ZINC000431570689	305079801	/nfs/dbraw/zinc/07/98/01/305079801.db2.gz	LYJQYOGRFKTEGT-NEPJUHHUSA-N	-1	3	344.389	1.030	20	5		EDBDHM
Cn1cnc([N+](=O)[O-])c1NC1CCN(C(=O)c2ccccc2[O-])CC1	ZINC000436935709	305170189	/nfs/dbraw/zinc/17/01/89/305170189.db2.gz	LGPPBYFYIIPXPF-UHFFFAOYSA-N	-1	3	345.359	1.751	20	5		EDBDHM
CCc1ncc(C[N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)o1	ZINC000451955776	305373944	/nfs/dbraw/zinc/37/39/44/305373944.db2.gz	FPOPREQWHVZMFK-UHFFFAOYSA-N	-1	3	325.346	1.932	20	5		EDBDHM
Cc1cccc(C(=O)N2CCN(c3ncccc3[N+](=O)[O-])CC2)c1[O-]	ZINC000457127973	305483801	/nfs/dbraw/zinc/48/38/01/305483801.db2.gz	CXADIUXEBPHIFC-UHFFFAOYSA-N	-1	3	342.355	1.966	20	5		EDBDHM
Cc1ccc([N-]S(C)(=O)=O)c(NC(=O)c2c[nH]nc2[N+](=O)[O-])c1	ZINC000547763598	306111090	/nfs/dbraw/zinc/11/10/90/306111090.db2.gz	DQWYFQRIZGGCAL-UHFFFAOYSA-N	-1	3	339.333	1.250	20	5		EDBDHM
Cc1nc([N-]C(=O)c2c([N+](=O)[O-])c(C)nn2C)n(-c2ccccc2)n1	ZINC000554336179	306190026	/nfs/dbraw/zinc/19/00/26/306190026.db2.gz	WGWJWWUCQGYWDC-UHFFFAOYSA-N	-1	3	341.331	1.200	20	5		EDBDHM
Cc1c([C@H](C)[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cnn1C	ZINC000046034262	441070663	/nfs/dbraw/zinc/07/06/63/441070663.db2.gz	WHZVXEANJNUFOC-JTQLQIEISA-N	-1	3	338.389	1.985	20	5		EDBDHM
CCN1CCC([N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])CC1	ZINC000026956184	441391862	/nfs/dbraw/zinc/39/18/62/441391862.db2.gz	BXVFHWYFJWNMKK-UHFFFAOYSA-N	-1	3	343.405	1.366	20	5		EDBDHM
NC(=O)c1cccc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])s2)c1	ZINC000064245307	441367468	/nfs/dbraw/zinc/36/74/68/441367468.db2.gz	CPNJQIBPDYOYSF-UHFFFAOYSA-N	-1	3	341.370	1.234	20	5		EDBDHM
CCOC(=O)C(C)(C)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000066937863	441591503	/nfs/dbraw/zinc/59/15/03/441591503.db2.gz	CGCJPTNSNNDJHP-UHFFFAOYSA-N	-1	3	330.362	1.523	20	5		EDBDHM
O=C(NCc1cccc([N+](=O)[O-])c1)Nc1ccc2c(c1)C(=O)[N-]C2=O	ZINC000067527820	441648788	/nfs/dbraw/zinc/64/87/88/441648788.db2.gz	QAEWFGUJSVZTQK-UHFFFAOYSA-N	-1	3	340.295	1.800	20	5		EDBDHM
CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CC[C@H]1NC(=O)[N-]C1=O	ZINC000056288425	441699561	/nfs/dbraw/zinc/69/95/61/441699561.db2.gz	LGNZIFCTNONVIG-CYBMUJFWSA-N	-1	3	348.359	1.320	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2C[C@H]3CC[C@@H]2O3)c1C	ZINC000121591806	441737995	/nfs/dbraw/zinc/73/79/95/441737995.db2.gz	LIAYUBSTTYIRGV-WZRBSPASSA-N	-1	3	326.374	1.810	20	5		EDBDHM
O=C(Cc1ccccc1[N+](=O)[O-])NCc1ccc(-c2nnn[n-]2)cc1	ZINC000068973793	441876002	/nfs/dbraw/zinc/87/60/02/441876002.db2.gz	KDMLMAGZVXMQRO-UHFFFAOYSA-N	-1	3	338.327	1.634	20	5		EDBDHM
O=C(Cc1ccccc1[N+](=O)[O-])NCc1ccc(-c2nn[n-]n2)cc1	ZINC000068973793	441876009	/nfs/dbraw/zinc/87/60/09/441876009.db2.gz	KDMLMAGZVXMQRO-UHFFFAOYSA-N	-1	3	338.327	1.634	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@H](CO)C(C)C)cc1[N+](=O)[O-]	ZINC000125666873	442038710	/nfs/dbraw/zinc/03/87/10/442038710.db2.gz	SSOCBXOOCPNFOE-SNVBAGLBSA-N	-1	3	336.797	1.852	20	5		EDBDHM
O=C(NC[C@@H](c1ccco1)N1CCCC1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000172156112	442417171	/nfs/dbraw/zinc/41/71/71/442417171.db2.gz	QFAIJMSOGRTZTA-ZDUSSCGKSA-N	-1	3	346.343	1.855	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2CCCC[C@H]2CO)c([N+](=O)[O-])c1	ZINC000133980797	442444026	/nfs/dbraw/zinc/44/40/26/442444026.db2.gz	DRXAVMBJBRHIEH-NWDGAFQWSA-N	-1	3	328.390	1.733	20	5		EDBDHM
CCN1CCN(CCCNC(=O)c2cc([N+](=O)[O-])ccc2[O-])CC1	ZINC000179428501	442456107	/nfs/dbraw/zinc/45/61/07/442456107.db2.gz	MSVGTLLXKWORHK-UHFFFAOYSA-N	-1	3	336.392	1.058	20	5		EDBDHM
COc1nnc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)[n-]1	ZINC000179715642	442493415	/nfs/dbraw/zinc/49/34/15/442493415.db2.gz	QEVJQICVENBKPX-UHFFFAOYSA-N	-1	3	329.276	1.160	20	5		EDBDHM
COc1nc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)n[n-]1	ZINC000179715642	442493421	/nfs/dbraw/zinc/49/34/21/442493421.db2.gz	QEVJQICVENBKPX-UHFFFAOYSA-N	-1	3	329.276	1.160	20	5		EDBDHM
COc1n[n-]c(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)n1	ZINC000179715642	442493427	/nfs/dbraw/zinc/49/34/27/442493427.db2.gz	QEVJQICVENBKPX-UHFFFAOYSA-N	-1	3	329.276	1.160	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCOC2)c(C(F)(F)F)c1	ZINC000178818812	442494072	/nfs/dbraw/zinc/49/40/72/442494072.db2.gz	KJGUUTBLGZXTOJ-ZETCQYMHSA-N	-1	3	340.279	1.681	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]Cc2ccccn2)cc1[N+](=O)[O-]	ZINC000186175683	442478509	/nfs/dbraw/zinc/47/85/09/442478509.db2.gz	XJSLKHCHFKFUDL-UHFFFAOYSA-N	-1	3	341.320	1.616	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cccc2nn[n-]c21	ZINC000187378871	442673062	/nfs/dbraw/zinc/67/30/62/442673062.db2.gz	RSRATLWYEUSCNB-UHFFFAOYSA-N	-1	3	327.300	1.805	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cccc2[n-]nnc21	ZINC000187378871	442673065	/nfs/dbraw/zinc/67/30/65/442673065.db2.gz	RSRATLWYEUSCNB-UHFFFAOYSA-N	-1	3	327.300	1.805	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cccc2n[n-]nc21	ZINC000187378871	442673068	/nfs/dbraw/zinc/67/30/68/442673068.db2.gz	RSRATLWYEUSCNB-UHFFFAOYSA-N	-1	3	327.300	1.805	20	5		EDBDHM
C[C@H](C[S@@](C)=O)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000183209867	442904398	/nfs/dbraw/zinc/90/43/98/442904398.db2.gz	BXHHTOKTVHMXFI-QOLSBQFWSA-N	-1	3	340.810	1.294	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](C)[C@@H]2CCOC2)cc1C	ZINC000266217144	443061449	/nfs/dbraw/zinc/06/14/49/443061449.db2.gz	RKAYWFANJYBXOY-NWDGAFQWSA-N	-1	3	328.390	1.915	20	5		EDBDHM
COC(=O)c1sc([N-]C(=O)c2n[nH]cc2[N+](=O)[O-])nc1C(C)C	ZINC000412398040	319230581	/nfs/dbraw/zinc/23/05/81/319230581.db2.gz	WTMWSODUDDJEOW-UHFFFAOYSA-N	-1	3	339.333	1.937	20	5		EDBDHM
COC(=O)[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)C(C)C	ZINC000267177748	443368900	/nfs/dbraw/zinc/36/89/00/443368900.db2.gz	VOTFTQLEDIFUGT-LBPRGKRZSA-N	-1	3	346.361	1.079	20	5		EDBDHM
CCC1([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CCC1	ZINC000267776706	443574137	/nfs/dbraw/zinc/57/41/37/443574137.db2.gz	PMBQZMZVGDCMHE-UHFFFAOYSA-N	-1	3	342.373	1.977	20	5		EDBDHM
COc1cccc(C(=O)N2CCc3c(nc[n-]c3=O)C2)c1[N+](=O)[O-]	ZINC000444368389	320128081	/nfs/dbraw/zinc/12/80/81/320128081.db2.gz	WZSPHDKLINILMJ-UHFFFAOYSA-N	-1	3	330.300	1.298	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H](CO)[C@H]2CCCO2)cc1C	ZINC000447939300	320148536	/nfs/dbraw/zinc/14/85/36/320148536.db2.gz	FEAUSGKNOWBXFW-WCQYABFASA-N	-1	3	344.389	1.030	20	5		EDBDHM
O=[N+]([O-])c1ccc(CS(=O)(=O)[N-]C2(c3nc[nH]n3)CCC2)cc1	ZINC000281145738	443831943	/nfs/dbraw/zinc/83/19/43/443831943.db2.gz	KGQLJYYAJKAKGV-UHFFFAOYSA-N	-1	3	337.361	1.212	20	5		EDBDHM
O=c1nc([C@@H]2CCCN(CCOc3ccc([N+](=O)[O-])cc3)C2)[nH][n-]1	ZINC000289541425	444167945	/nfs/dbraw/zinc/16/79/45/444167945.db2.gz	WROLOLUQYKZIIU-LLVKDONJSA-N	-1	3	333.348	1.265	20	5		EDBDHM
O=C([O-])c1cn([C@H]2CCCN(CCc3ccc([N+](=O)[O-])cc3)C2)nn1	ZINC000580897487	322110076	/nfs/dbraw/zinc/11/00/76/322110076.db2.gz	FTOYWMKBOGAQJU-AWEZNQCLSA-N	-1	3	345.359	1.764	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CCc2cnccn2)cc1[N+](=O)[O-]	ZINC000342531151	444733174	/nfs/dbraw/zinc/73/31/74/444733174.db2.gz	QLKDWJWFLJVYMW-UHFFFAOYSA-N	-1	3	328.375	1.276	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1C(=O)[N-]c1ncnn1-c1ccccc1	ZINC000342489646	444713188	/nfs/dbraw/zinc/71/31/88/444713188.db2.gz	KXAHBTPIZCTCID-UHFFFAOYSA-N	-1	3	339.311	1.858	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CCCN(C)[C@@H]1C	ZINC000344026567	444737292	/nfs/dbraw/zinc/73/72/92/444737292.db2.gz	GZOCCNTUVHPFCJ-PWSUYJOCSA-N	-1	3	343.405	1.364	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@]1(C)CCO[C@@H]1C	ZINC000344124453	444794192	/nfs/dbraw/zinc/79/41/92/444794192.db2.gz	WXKJGMHCXVWQEE-NOZJJQNGSA-N	-1	3	330.362	1.449	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC2(C(N)=O)CCCC2)c([N+](=O)[O-])c1	ZINC000360062965	445550529	/nfs/dbraw/zinc/55/05/29/445550529.db2.gz	ZFEDEWQEANXYIJ-UHFFFAOYSA-N	-1	3	341.389	1.227	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)NCc2ncccc2[O-])c1[N+](=O)[O-]	ZINC000360036583	445538854	/nfs/dbraw/zinc/53/88/54/445538854.db2.gz	GWPVUKHLKXDDIZ-UHFFFAOYSA-N	-1	3	337.357	1.791	20	5		EDBDHM
Nc1ncc([N+](=O)[O-])cc1C(=O)[N-]c1n[nH]c(-c2ccncc2)n1	ZINC000366594464	446273697	/nfs/dbraw/zinc/27/36/97/446273697.db2.gz	SMOHLGLZIHGXMB-UHFFFAOYSA-N	-1	3	326.276	1.004	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@H](C)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)on1	ZINC000365824651	446358477	/nfs/dbraw/zinc/35/84/77/446358477.db2.gz	ZDMGYRNDCPXJOP-NSHDSACASA-N	-1	3	348.363	1.752	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@H](C)N2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)on1	ZINC000369012125	447261141	/nfs/dbraw/zinc/26/11/41/447261141.db2.gz	WQBWEMOYGOUANX-RYUDHWBXSA-N	-1	3	348.363	1.752	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1Sc1n[n-]c(CO)n1	ZINC000530477851	447894181	/nfs/dbraw/zinc/89/41/81/447894181.db2.gz	DHLKIOKDJFCKIA-UHFFFAOYSA-N	-1	3	344.736	1.796	20	5		EDBDHM
COCCCN1CCC(Nc2nccc(C(=O)[O-])c2[N+](=O)[O-])CC1	ZINC000578445784	448548360	/nfs/dbraw/zinc/54/83/60/448548360.db2.gz	SHJAXORMUIHFCZ-UHFFFAOYSA-N	-1	3	338.364	1.601	20	5		EDBDHM
Cc1cc(C[N-]S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)on1	ZINC000175090879	533713276	/nfs/dbraw/zinc/71/32/76/533713276.db2.gz	ICMMNMUBCWFPHQ-UHFFFAOYSA-N	-1	3	325.346	1.987	20	5		EDBDHM
CCOc1cc(CN2CC[C@](COC)(C(=O)[O-])C2)ccc1[N+](=O)[O-]	ZINC000573498506	448642934	/nfs/dbraw/zinc/64/29/34/448642934.db2.gz	GYTKSWIKYHLTFP-INIZCTEOSA-N	-1	3	338.360	1.917	20	5		EDBDHM
CC[C@H](C)C[C@@H](CO)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000592084251	448670889	/nfs/dbraw/zinc/67/08/89/448670889.db2.gz	VBHMDCSIGAJIQE-QWRGUYRKSA-N	-1	3	346.405	1.679	20	5		EDBDHM
COC(=O)CC1([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)CC1	ZINC000568032389	448804471	/nfs/dbraw/zinc/80/44/71/448804471.db2.gz	AMLUKLGRKYXSJT-UHFFFAOYSA-N	-1	3	334.375	1.339	20	5		EDBDHM
CC(=O)c1cc(N2CCN(C(C)(C)C(=O)[O-])CC2)ccc1[N+](=O)[O-]	ZINC000521050223	448950634	/nfs/dbraw/zinc/95/06/34/448950634.db2.gz	FRBWZTVDULLSTF-UHFFFAOYSA-N	-1	3	335.360	1.783	20	5		EDBDHM
Cc1ccsc1CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593573427	449082363	/nfs/dbraw/zinc/08/23/63/449082363.db2.gz	ADMFJXBCKYYLHI-UHFFFAOYSA-N	-1	3	327.387	1.881	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@H]2CC23CCSCC3)nc1	ZINC000593610505	449107826	/nfs/dbraw/zinc/10/78/26/449107826.db2.gz	ZOZVDTIJYQQXHH-SNVBAGLBSA-N	-1	3	343.430	1.801	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]Cc2ccnn2C)c(F)cc1[N+](=O)[O-]	ZINC000590589756	449205515	/nfs/dbraw/zinc/20/55/15/449205515.db2.gz	ZYKFBOJRSDANDI-UHFFFAOYSA-N	-1	3	328.325	1.254	20	5		EDBDHM
Cc1nc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)sc1C	ZINC000593552721	449343462	/nfs/dbraw/zinc/34/34/62/449343462.db2.gz	IAOYVBXBBBTQOR-UHFFFAOYSA-N	-1	3	328.375	1.542	20	5		EDBDHM
O=C(c1ccc(F)cc1)N1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596070423	449346312	/nfs/dbraw/zinc/34/63/12/449346312.db2.gz	BYJMRHPTRNEPEW-UHFFFAOYSA-N	-1	3	346.318	1.797	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@@H](CO)C2CCCCC2)nc1	ZINC000593556130	449346689	/nfs/dbraw/zinc/34/66/89/449346689.db2.gz	JQLRCPHVYXEGLI-LBPRGKRZSA-N	-1	3	329.378	1.209	20	5		EDBDHM
C[C@@H]1CCCCN1CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593531236	449328753	/nfs/dbraw/zinc/32/87/53/449328753.db2.gz	PNVGFQLJTBBGTG-LLVKDONJSA-N	-1	3	328.394	1.143	20	5		EDBDHM
C[C@H]1CCCC[C@H]1OCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593532234	449329137	/nfs/dbraw/zinc/32/91/37/449329137.db2.gz	ZIFLGXLCAQPWBQ-WCQYABFASA-N	-1	3	343.405	1.863	20	5		EDBDHM
Cc1nc(C)c(CC[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)s1	ZINC000593541705	449335911	/nfs/dbraw/zinc/33/59/11/449335911.db2.gz	NMLXZSFHMKKFTK-UHFFFAOYSA-N	-1	3	342.402	1.584	20	5		EDBDHM
Cc1cnc(OC2CCN(c3cc[n-]c(=O)c3[N+](=O)[O-])CC2)nc1	ZINC000596300991	449464466	/nfs/dbraw/zinc/46/44/66/449464466.db2.gz	WGRASNYVNGVGSG-UHFFFAOYSA-N	-1	3	331.332	1.842	20	5		EDBDHM
CC(C)Oc1nc(N2CCC[C@H]2c2nc(=N)n(C)[n-]2)ccc1[N+](=O)[O-]	ZINC000596252003	449439622	/nfs/dbraw/zinc/43/96/22/449439622.db2.gz	CHAJVSSXPVZELN-JTQLQIEISA-N	-1	3	347.379	1.660	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])N1CCC[C@H](C)C1	ZINC000594749366	449665734	/nfs/dbraw/zinc/66/57/34/449665734.db2.gz	SNVCILCEGVZFLW-RYUDHWBXSA-N	-1	3	342.421	1.389	20	5		EDBDHM
CC[C@H](COCC1CC1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000594801257	449713331	/nfs/dbraw/zinc/71/33/31/449713331.db2.gz	LXAUIDVGHNBPBN-LLVKDONJSA-N	-1	3	329.378	1.473	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@H](CO)CC1CC1	ZINC000594864708	449777757	/nfs/dbraw/zinc/77/77/57/449777757.db2.gz	LRKYHFGMSHFPDL-GFCCVEGCSA-N	-1	3	328.390	1.590	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]C[C@]1(C)CC1(F)F	ZINC000594852203	449760229	/nfs/dbraw/zinc/76/02/29/449760229.db2.gz	OKJYBRMANMOKFR-NSHDSACASA-N	-1	3	336.316	1.927	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@]12C[C@@H]1COC2(C)C	ZINC000599398233	449944222	/nfs/dbraw/zinc/94/42/22/449944222.db2.gz	XGNVUHKTJAPXQK-OTYXRUKQSA-N	-1	3	342.373	1.449	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@@]2(C)CCCOC2)c(F)cc1[N+](=O)[O-]	ZINC000601385858	449903114	/nfs/dbraw/zinc/90/31/14/449903114.db2.gz	XMSPTPHTGJQGEW-ZDUSSCGKSA-N	-1	3	332.353	1.890	20	5		EDBDHM
CC(C)(C(=O)NCCCc1cc(=O)[nH][n-]1)c1ccccc1[N+](=O)[O-]	ZINC000597665592	450180818	/nfs/dbraw/zinc/18/08/18/450180818.db2.gz	RUGZREAXGCTJPQ-UHFFFAOYSA-N	-1	3	332.360	1.645	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(=O)n(C)c1	ZINC000619466900	450482158	/nfs/dbraw/zinc/48/21/58/450482158.db2.gz	CIJWBJPBWRWLFU-UHFFFAOYSA-N	-1	3	339.329	1.103	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(C)[nH]c1=O	ZINC000619468199	450482291	/nfs/dbraw/zinc/48/22/91/450482291.db2.gz	FZIHYDBPAXZFGY-UHFFFAOYSA-N	-1	3	339.329	1.813	20	5		EDBDHM
O=C(OCc1cc(F)ccc1[N+](=O)[O-])c1ccc2c(c1)C(=O)[N-]C2=O	ZINC000732339688	578706417	/nfs/dbraw/zinc/70/64/17/578706417.db2.gz	JQEHVKQJKARJQR-UHFFFAOYSA-N	-1	3	344.254	1.975	20	5		EDBDHM
O=C(O[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1cncc([O-])c1	ZINC000732394743	578709224	/nfs/dbraw/zinc/70/92/24/578709224.db2.gz	TUOATVYPHOUICM-AWEZNQCLSA-N	-1	3	343.295	1.658	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1cncc([O-])c1	ZINC000732395022	578709376	/nfs/dbraw/zinc/70/93/76/578709376.db2.gz	ZWTZDCFTITUXJI-UHFFFAOYSA-N	-1	3	331.284	1.799	20	5		EDBDHM
COc1cc(C(=O)Nc2ccc(-c3nnn[n-]3)cn2)ccc1[N+](=O)[O-]	ZINC000737042298	579042995	/nfs/dbraw/zinc/04/29/95/579042995.db2.gz	QTWWJWZHIWQHHG-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
COc1cc(C(=O)Nc2ccc(-c3nn[n-]n3)cn2)ccc1[N+](=O)[O-]	ZINC000737042298	579042996	/nfs/dbraw/zinc/04/29/96/579042996.db2.gz	QTWWJWZHIWQHHG-UHFFFAOYSA-N	-1	3	341.287	1.431	20	5		EDBDHM
Cc1nc2n(n1)C[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)CC2	ZINC000737488772	579097236	/nfs/dbraw/zinc/09/72/36/579097236.db2.gz	CYZICNKVVKJFHX-SECBINFHSA-N	-1	3	341.335	1.102	20	5		EDBDHM
Cc1nc2n(n1)C[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)CC2	ZINC000737488772	579097238	/nfs/dbraw/zinc/09/72/38/579097238.db2.gz	CYZICNKVVKJFHX-SECBINFHSA-N	-1	3	341.335	1.102	20	5		EDBDHM
O=C([O-])/C=C\c1ccc(NC2CCN(CCO)CC2)c([N+](=O)[O-])c1	ZINC000739625810	579227944	/nfs/dbraw/zinc/22/79/44/579227944.db2.gz	RIBJXQDWNYDFON-RQOWECAXSA-N	-1	3	335.360	1.561	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-][C@@H](CCO)C2CC2)cc1[N+](=O)[O-]	ZINC000777978412	580454113	/nfs/dbraw/zinc/45/41/13/580454113.db2.gz	FIEXKDQJUAWSDM-NSHDSACASA-N	-1	3	348.352	1.182	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@H]2CCn3ccnc3C2)cs1	ZINC000778094124	580456139	/nfs/dbraw/zinc/45/61/39/580456139.db2.gz	HDOPCVWEDATLDC-QMMMGPOBSA-N	-1	3	328.375	1.146	20	5		EDBDHM
COc1cccc(CC[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)n1	ZINC000768855545	580222613	/nfs/dbraw/zinc/22/26/13/580222613.db2.gz	ZLGBKZNLDDZUEU-UHFFFAOYSA-N	-1	3	343.386	1.581	20	5		EDBDHM
CN1CCC(O[N-]C(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)CC1	ZINC000773540228	580340161	/nfs/dbraw/zinc/34/01/61/580340161.db2.gz	FXPYTDQNKKGMEE-HNNXBMFYSA-N	-1	3	348.359	1.230	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-][C@@H]2CCCN(C)C2)c1	ZINC000779878823	580500744	/nfs/dbraw/zinc/50/07/44/580500744.db2.gz	DYLFWPITHLTXOG-SNVBAGLBSA-N	-1	3	347.824	1.929	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)[C@@H]1CCCO1	ZINC000788711083	580728363	/nfs/dbraw/zinc/72/83/63/580728363.db2.gz	UCJSCQPTNMSXAC-UWVGGRQHSA-N	-1	3	336.391	1.129	20	5		EDBDHM
CCOc1cc(NC([O-])=NOCCO)c([N+](=O)[O-])cc1OCC	ZINC000792217818	580813765	/nfs/dbraw/zinc/81/37/65/580813765.db2.gz	KIXMMGYYFRTGNN-UHFFFAOYSA-N	-1	3	329.309	1.438	20	5		EDBDHM
CCOc1cc(NC(=O)[N-]OCCO)c([N+](=O)[O-])cc1OCC	ZINC000792217818	580813766	/nfs/dbraw/zinc/81/37/66/580813766.db2.gz	KIXMMGYYFRTGNN-UHFFFAOYSA-N	-1	3	329.309	1.438	20	5		EDBDHM
C[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])cc(Cl)c1F)c1nnc[nH]1	ZINC000798226561	580991399	/nfs/dbraw/zinc/99/13/99/580991399.db2.gz	BKHBKMZMPJQGGJ-RXMQYKEDSA-N	-1	3	349.731	1.545	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N[C@H]1CCc2n[nH]cc2C1	ZINC000738357598	598896254	/nfs/dbraw/zinc/89/62/54/598896254.db2.gz	GFVSJEPTKBOMSI-JTQLQIEISA-N	-1	3	326.320	1.467	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCC[C@H](O)C(F)(F)F)c(-c2nnn[n-]2)c1	ZINC000738370375	598896513	/nfs/dbraw/zinc/89/65/13/598896513.db2.gz	PFEOEOVPSCLVAM-VIFPVBQESA-N	-1	3	332.242	1.500	20	5		EDBDHM
O=[N+]([O-])c1ccc(NCC[C@H](O)C(F)(F)F)c(-c2nn[n-]n2)c1	ZINC000738370375	598896516	/nfs/dbraw/zinc/89/65/16/598896516.db2.gz	PFEOEOVPSCLVAM-VIFPVBQESA-N	-1	3	332.242	1.500	20	5		EDBDHM
C[C@H](NC(=O)c1ccc(-c2nnn[n-]2)cn1)c1cccc([N+](=O)[O-])c1	ZINC000736120063	592990173	/nfs/dbraw/zinc/99/01/73/592990173.db2.gz	VCFPIUTYJYIUQL-VIFPVBQESA-N	-1	3	339.315	1.661	20	5		EDBDHM
C[C@H](NC(=O)c1ccc(-c2nn[n-]n2)cn1)c1cccc([N+](=O)[O-])c1	ZINC000736120063	592990176	/nfs/dbraw/zinc/99/01/76/592990176.db2.gz	VCFPIUTYJYIUQL-VIFPVBQESA-N	-1	3	339.315	1.661	20	5		EDBDHM
C[C@@H](C[C@@H](O)c1ccco1)Nc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820234981	593801389	/nfs/dbraw/zinc/80/13/89/593801389.db2.gz	PSUBXADJBXYZSE-GZMMTYOYSA-N	-1	3	345.319	1.687	20	5		EDBDHM
C[C@@H](C[C@@H](O)c1ccco1)Nc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820234981	593801390	/nfs/dbraw/zinc/80/13/90/593801390.db2.gz	PSUBXADJBXYZSE-GZMMTYOYSA-N	-1	3	345.319	1.687	20	5		EDBDHM
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])n1C)c1cccc(-c2nnn[n-]2)c1	ZINC000820397902	593816254	/nfs/dbraw/zinc/81/62/54/593816254.db2.gz	WPRNDHSEYWPHDD-SECBINFHSA-N	-1	3	341.331	1.604	20	5		EDBDHM
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])n1C)c1cccc(-c2nn[n-]n2)c1	ZINC000820397902	593816255	/nfs/dbraw/zinc/81/62/55/593816255.db2.gz	WPRNDHSEYWPHDD-SECBINFHSA-N	-1	3	341.331	1.604	20	5		EDBDHM
COc1ccc(-c2nnn[n-]2)cc1Cn1cc([N+](=O)[O-])c(C)cc1=O	ZINC000821752898	593929969	/nfs/dbraw/zinc/92/99/69/593929969.db2.gz	UYIXJPHYSTWXKE-UHFFFAOYSA-N	-1	3	342.315	1.302	20	5		EDBDHM
COc1ccc(-c2nn[n-]n2)cc1Cn1cc([N+](=O)[O-])c(C)cc1=O	ZINC000821752898	593929972	/nfs/dbraw/zinc/92/99/72/593929972.db2.gz	UYIXJPHYSTWXKE-UHFFFAOYSA-N	-1	3	342.315	1.302	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(=O)n1Cc1ccc(-c2nnn[n-]2)cc1F	ZINC000822270958	594022424	/nfs/dbraw/zinc/02/24/24/594022424.db2.gz	FQIXHURCTUNEEQ-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(=O)n1Cc1ccc(-c2nn[n-]n2)cc1F	ZINC000822270958	594022425	/nfs/dbraw/zinc/02/24/25/594022425.db2.gz	FQIXHURCTUNEEQ-UHFFFAOYSA-N	-1	3	330.279	1.432	20	5		EDBDHM
Cc1nn(C)c(NCCOc2ccc(-c3nnn[n-]3)cc2)c1[N+](=O)[O-]	ZINC000822496465	594057538	/nfs/dbraw/zinc/05/75/38/594057538.db2.gz	NQKBMVXJPJZCQB-UHFFFAOYSA-N	-1	3	344.335	1.308	20	5		EDBDHM
Cc1nn(C)c(NCCOc2ccc(-c3nn[n-]n3)cc2)c1[N+](=O)[O-]	ZINC000822496465	594057540	/nfs/dbraw/zinc/05/75/40/594057540.db2.gz	NQKBMVXJPJZCQB-UHFFFAOYSA-N	-1	3	344.335	1.308	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1NCCCOC[C@H]1CCCO1	ZINC000823630518	594223129	/nfs/dbraw/zinc/22/31/29/594223129.db2.gz	ZIZBFJMPFYEBTJ-GFCCVEGCSA-N	-1	3	348.363	1.773	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NCCCOC[C@H]1CCCO1	ZINC000823630518	594223130	/nfs/dbraw/zinc/22/31/30/594223130.db2.gz	ZIZBFJMPFYEBTJ-GFCCVEGCSA-N	-1	3	348.363	1.773	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@H]2CCCn3ncnc32)c(-c2nnn[n-]2)c1	ZINC000823639428	594223841	/nfs/dbraw/zinc/22/38/41/594223841.db2.gz	ACUNRLHJWPZNJZ-NSHDSACASA-N	-1	3	327.308	1.313	20	5		EDBDHM
O=[N+]([O-])c1ccc(N[C@H]2CCCn3ncnc32)c(-c2nn[n-]n2)c1	ZINC000823639428	594223842	/nfs/dbraw/zinc/22/38/42/594223842.db2.gz	ACUNRLHJWPZNJZ-NSHDSACASA-N	-1	3	327.308	1.313	20	5		EDBDHM
O=[N+]([O-])c1ccccc1CNCCOc1ccc(-c2nnn[n-]2)cc1	ZINC000823647223	594224544	/nfs/dbraw/zinc/22/45/44/594224544.db2.gz	IAZOFKGLJAMMNC-UHFFFAOYSA-N	-1	3	340.343	1.944	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCC[C@@H](O)c2ccccc2)c(-c2nnn[n-]2)c1	ZINC000823652005	594224801	/nfs/dbraw/zinc/22/48/01/594224801.db2.gz	VRFMRHYBSYSVIU-CYBMUJFWSA-N	-1	3	341.331	1.706	20	5		EDBDHM
O=[N+]([O-])c1cnc(NCC[C@@H](O)c2ccccc2)c(-c2nn[n-]n2)c1	ZINC000823652005	594224802	/nfs/dbraw/zinc/22/48/02/594224802.db2.gz	VRFMRHYBSYSVIU-CYBMUJFWSA-N	-1	3	341.331	1.706	20	5		EDBDHM
CCc1nnc([C@H](C)Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])[nH]1	ZINC000825745104	594236197	/nfs/dbraw/zinc/23/61/97/594236197.db2.gz	HXLRNXDJAMTWQZ-ZETCQYMHSA-N	-1	3	329.324	1.629	20	5		EDBDHM
CCN1CCC[C@@H]1CN(C)C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000829764911	594258660	/nfs/dbraw/zinc/25/86/60/594258660.db2.gz	BMQOQHRIUACUQI-CYBMUJFWSA-N	-1	3	335.360	1.849	20	5		EDBDHM
CN(C)c1cccc(CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])n1	ZINC000825879162	594267481	/nfs/dbraw/zinc/26/74/81/594267481.db2.gz	IOENALZZJJSILD-UHFFFAOYSA-N	-1	3	340.347	1.848	20	5		EDBDHM
CN(C)c1cccc(CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])n1	ZINC000825879162	594267483	/nfs/dbraw/zinc/26/74/83/594267483.db2.gz	IOENALZZJJSILD-UHFFFAOYSA-N	-1	3	340.347	1.848	20	5		EDBDHM
C[C@]1(C(=O)[O-])CCN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000828028783	594325463	/nfs/dbraw/zinc/32/54/63/594325463.db2.gz	BQTSUXSUBVPUOW-HNNXBMFYSA-N	-1	3	331.332	1.607	20	5		EDBDHM
O=C(Cn1ccc(-c2nnn[n-]2)c1)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000826424217	594470465	/nfs/dbraw/zinc/47/04/65/594470465.db2.gz	BAUAFJYCBLLQSB-UHFFFAOYSA-N	-1	3	347.722	1.869	20	5		EDBDHM
O=C(Cn1ccc(-c2nn[n-]n2)c1)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000826424217	594470468	/nfs/dbraw/zinc/47/04/68/594470468.db2.gz	BAUAFJYCBLLQSB-UHFFFAOYSA-N	-1	3	347.722	1.869	20	5		EDBDHM
O=C(OCc1cc(F)ccc1[N+](=O)[O-])c1ccc(-c2nnn[n-]2)[nH]1	ZINC000826464798	594486495	/nfs/dbraw/zinc/48/64/95/594486495.db2.gz	MMEOXSQKQWGCTN-UHFFFAOYSA-N	-1	3	332.251	1.599	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1OS(=O)(=O)CC1CCC1	ZINC000826497605	594502317	/nfs/dbraw/zinc/50/23/17/594502317.db2.gz	NDBCDOQTCONIJA-UHFFFAOYSA-N	-1	3	339.333	1.284	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1OS(=O)(=O)CC1CCC1	ZINC000826497605	594502318	/nfs/dbraw/zinc/50/23/18/594502318.db2.gz	NDBCDOQTCONIJA-UHFFFAOYSA-N	-1	3	339.333	1.284	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CC[C@@H]([C@H]2CCOC2)C1	ZINC000826497671	594502664	/nfs/dbraw/zinc/50/26/64/594502664.db2.gz	PMCLPLLXUOXUKP-NEPJUHHUSA-N	-1	3	330.348	1.638	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CC[C@@H]([C@H]2CCOC2)C1	ZINC000826497671	594502665	/nfs/dbraw/zinc/50/26/65/594502665.db2.gz	PMCLPLLXUOXUKP-NEPJUHHUSA-N	-1	3	330.348	1.638	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CC[C@@H]([C@H]3CCOC3)C2)c(-c2nnn[n-]2)c1	ZINC000826498490	594502789	/nfs/dbraw/zinc/50/27/89/594502789.db2.gz	XDAPGHBHQJGRJZ-MNOVXSKESA-N	-1	3	330.348	1.638	20	5		EDBDHM
O=[N+]([O-])c1ccc(N2CC[C@@H]([C@H]3CCOC3)C2)c(-c2nn[n-]n2)c1	ZINC000826498490	594502791	/nfs/dbraw/zinc/50/27/91/594502791.db2.gz	XDAPGHBHQJGRJZ-MNOVXSKESA-N	-1	3	330.348	1.638	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N1CCC(CCCO)CC1	ZINC000826497798	594503014	/nfs/dbraw/zinc/50/30/14/594503014.db2.gz	VFROBFCUBAKAFT-UHFFFAOYSA-N	-1	3	332.364	1.764	20	5		EDBDHM
O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1N1CCC(CCCO)CC1	ZINC000826497798	594503016	/nfs/dbraw/zinc/50/30/16/594503016.db2.gz	VFROBFCUBAKAFT-UHFFFAOYSA-N	-1	3	332.364	1.764	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)[N-]C[C@H](C)N(C)C)c1	ZINC000832399328	594747575	/nfs/dbraw/zinc/74/75/75/594747575.db2.gz	ABBJWWDJWBKDRZ-VIFPVBQESA-N	-1	3	335.813	1.785	20	5		EDBDHM
CC(C)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C1CCOCC1	ZINC000845923004	595097354	/nfs/dbraw/zinc/09/73/54/595097354.db2.gz	LIBALGSCPGSMSO-UHFFFAOYSA-N	-1	3	329.378	1.473	20	5		EDBDHM
COc1cc(OCC(=O)[N-]OC2CCN(C)CC2)ccc1[N+](=O)[O-]	ZINC000846646288	595291616	/nfs/dbraw/zinc/29/16/16/595291616.db2.gz	CIHADXJRWJWCEX-UHFFFAOYSA-N	-1	3	339.348	1.124	20	5		EDBDHM
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC[C@H]2CN3CCC[C@@H]3CO2)n1	ZINC000844208177	595302831	/nfs/dbraw/zinc/30/28/31/595302831.db2.gz	JWZHDVQRQBLQMS-MNOVXSKESA-N	-1	3	336.348	1.272	20	5		EDBDHM
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)[N-]OCCN1CCCC1=O	ZINC000856042706	595883886	/nfs/dbraw/zinc/88/38/86/595883886.db2.gz	LHDZIWZTYGAIFX-QXMHVHEDSA-N	-1	3	333.344	1.668	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCc3ccccc3CC2)c(-c2nnn[n-]2)c1	ZINC000738369829	599173149	/nfs/dbraw/zinc/17/31/49/599173149.db2.gz	PQQRMJARJKQQCS-UHFFFAOYSA-N	-1	3	337.343	1.775	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCc3ccccc3CC2)c(-c2nn[n-]n2)c1	ZINC000738369829	599173150	/nfs/dbraw/zinc/17/31/50/599173150.db2.gz	PQQRMJARJKQQCS-UHFFFAOYSA-N	-1	3	337.343	1.775	20	5		EDBDHM
COC(=O)C1=CC[C@@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000859288026	596034171	/nfs/dbraw/zinc/03/41/71/596034171.db2.gz	SOGJAIARUJNSLF-SECBINFHSA-N	-1	3	344.320	1.274	20	5		EDBDHM
CCOC(=O)C1=CC[C@@H]([N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000859317130	596047483	/nfs/dbraw/zinc/04/74/83/596047483.db2.gz	KUYGSAPXEOLVHA-SECBINFHSA-N	-1	3	346.386	1.587	20	5		EDBDHM
O=C(c1c([O-])cccc1O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000125555844	596952319	/nfs/dbraw/zinc/95/23/19/596952319.db2.gz	JBFCOEONBPOEAG-UHFFFAOYSA-N	-1	3	343.339	1.968	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@@H]2c2ccccn2)c(-c2nnn[n-]2)c1	ZINC000738368698	598499518	/nfs/dbraw/zinc/49/95/18/598499518.db2.gz	IWGBEPSUGSNNGB-CYBMUJFWSA-N	-1	3	338.331	1.906	20	5		EDBDHM
O=[N+]([O-])c1cnc(N2CCC[C@@H]2c2ccccn2)c(-c2nn[n-]n2)c1	ZINC000738368698	598499520	/nfs/dbraw/zinc/49/95/20/598499520.db2.gz	IWGBEPSUGSNNGB-CYBMUJFWSA-N	-1	3	338.331	1.906	20	5		EDBDHM
O=C(CCc1c[nH]cn1)N=c1cc(-c2cccc([N+](=O)[O-])c2)[n-][nH]1	ZINC000352155776	697091271	/nfs/dbraw/zinc/09/12/71/697091271.db2.gz	GBQZRLPIZYUUQS-UHFFFAOYSA-N	-1	3	326.316	1.701	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-]CC(=O)N2CCCCC2)c([N+](=O)[O-])c1	ZINC000101571864	219140216	/nfs/dbraw/zinc/14/02/16/219140216.db2.gz	VFSZTSBSJAWZQU-UHFFFAOYSA-N	-1	3	341.389	1.194	20	5		EDBDHM
O=C(Nc1cc2c(cc1F)NC(=O)CC2)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000357107584	284286462	/nfs/dbraw/zinc/28/64/62/284286462.db2.gz	LDRTVIOCZFSDKY-UHFFFAOYSA-N	-1	3	346.274	1.972	20	5		EDBDHM
CCN1CCC([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)CC1	ZINC000118957525	221211008	/nfs/dbraw/zinc/21/10/08/221211008.db2.gz	BPMQWJWOWFTGIP-UHFFFAOYSA-N	-1	3	333.435	1.727	20	5		EDBDHM
COC(=O)[C@@H](CC(C)C)[N-]S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000264109412	139380950	/nfs/dbraw/zinc/38/09/50/139380950.db2.gz	IRNYZMXHLDBKNC-CYBMUJFWSA-N	-1	3	344.389	1.602	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]CCC[C@H](C)CO	ZINC000270220533	140062276	/nfs/dbraw/zinc/06/22/76/140062276.db2.gz	HIPDVLCEPLTGPV-JTQLQIEISA-N	-1	3	332.378	1.290	20	5		EDBDHM
Cc1nn(C)c(C(=O)[N-]c2ccccc2SCC(N)=O)c1[N+](=O)[O-]	ZINC000345503827	143099343	/nfs/dbraw/zinc/09/93/43/143099343.db2.gz	APZWQCBCEJEHPW-UHFFFAOYSA-N	-1	3	349.372	1.466	20	5		EDBDHM
CCn1ncnc1C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1C	ZINC000360369597	152009583	/nfs/dbraw/zinc/00/95/83/152009583.db2.gz	QIFJBJBDLIMCND-UHFFFAOYSA-N	-1	3	339.377	1.302	20	5		EDBDHM
COCCCN(C)CC[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000360653445	152139828	/nfs/dbraw/zinc/13/98/28/152139828.db2.gz	PQQMLLKGIODYBI-UHFFFAOYSA-N	-1	3	345.421	1.150	20	5		EDBDHM
Cc1ccnc(N2CC(S(=O)(=O)[N-]c3ccccc3)C2)c1[N+](=O)[O-]	ZINC000364022413	153124936	/nfs/dbraw/zinc/12/49/36/153124936.db2.gz	ZLZCUUBXNKMWGD-UHFFFAOYSA-N	-1	3	348.384	1.929	20	5		EDBDHM
Cc1cc(C(=O)N[C@@H]2c3ccccc3C[C@H]2O)c([N+](=O)[O-])c(=O)[n-]1	ZINC000367175345	154029921	/nfs/dbraw/zinc/02/99/21/154029921.db2.gz	WLSWFLRWFWOBBO-CHWSQXEVSA-N	-1	3	329.312	1.392	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]C[C@H](CO)C1CC1	ZINC000352550023	162247076	/nfs/dbraw/zinc/24/70/76/162247076.db2.gz	JZYGHTNRZSOPFT-SECBINFHSA-N	-1	3	334.781	1.545	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2CCC(=O)N(C)C2)cc1C	ZINC000160097771	225336845	/nfs/dbraw/zinc/33/68/45/225336845.db2.gz	XGJPNAHUVSWGPX-LLVKDONJSA-N	-1	3	341.389	1.111	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C[C@H](C)O	ZINC000120790306	287364695	/nfs/dbraw/zinc/36/46/95/287364695.db2.gz	OFJWPOOJFORTID-BDAKNGLRSA-N	-1	3	336.797	1.934	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@@H]2C[C@@H](C)N(C3CC3)C2)c([N+](=O)[O-])c1	ZINC000124036416	222367151	/nfs/dbraw/zinc/36/71/51/222367151.db2.gz	LYKJSCUZAZKNHQ-VXGBXAGGSA-N	-1	3	339.417	1.807	20	5		EDBDHM
CC(=O)NCCC[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000189830755	278102156	/nfs/dbraw/zinc/10/21/56/278102156.db2.gz	NLVMNRNHUHBGDI-UHFFFAOYSA-N	-1	3	329.378	1.016	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](CO)C1CCCC1	ZINC000289706272	288764218	/nfs/dbraw/zinc/76/42/18/288764218.db2.gz	YGQLCZITNACEFQ-LBPRGKRZSA-N	-1	3	328.390	1.733	20	5		EDBDHM
CNC(=O)[C@H]([N-]c1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C(C)C	ZINC000301941338	303704213	/nfs/dbraw/zinc/70/42/13/303704213.db2.gz	VRXNUKHGFRCHLG-SECBINFHSA-N	-1	3	335.407	1.242	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCCO[C@@H]1CCOC1	ZINC000268227423	304810243	/nfs/dbraw/zinc/81/02/43/304810243.db2.gz	KKLATUNWJOHKNZ-LLVKDONJSA-N	-1	3	330.362	1.069	20	5		EDBDHM
CO[C@@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1(C)C	ZINC000440395488	305205443	/nfs/dbraw/zinc/20/54/43/305205443.db2.gz	CVNZDFAHVDUYSA-NWDGAFQWSA-N	-1	3	332.353	1.826	20	5		EDBDHM
CCOC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)cn1C	ZINC000440491563	305207913	/nfs/dbraw/zinc/20/79/13/305207913.db2.gz	WUWSPDMLJCXSSI-UHFFFAOYSA-N	-1	3	334.288	1.463	20	5		EDBDHM
COC(=O)Cc1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc1	ZINC000444862238	305254137	/nfs/dbraw/zinc/25/41/37/305254137.db2.gz	UTRRTENWTOIHOQ-UHFFFAOYSA-N	-1	3	331.284	1.663	20	5		EDBDHM
CCc1n[nH]c([N-]S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)n1	ZINC000451031554	305331789	/nfs/dbraw/zinc/33/17/89/305331789.db2.gz	WPERGNFTHJGKSN-UHFFFAOYSA-N	-1	3	325.350	1.693	20	5		EDBDHM
CCC1(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)COC1	ZINC000451952155	305373579	/nfs/dbraw/zinc/37/35/79/305373579.db2.gz	OFBAFVDXQYZRIJ-UHFFFAOYSA-N	-1	3	330.362	1.308	20	5		EDBDHM
CO[C@H]([C@H](C)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])C1CC1	ZINC000451985299	305376298	/nfs/dbraw/zinc/37/62/98/305376298.db2.gz	HZALFLRWHUPXOX-GXFFZTMASA-N	-1	3	328.390	1.995	20	5		EDBDHM
O=C(C=Cc1ccccc1[N+](=O)[O-])N1CCc2nc[n-]c(=O)c2C1	ZINC000493687145	447367450	/nfs/dbraw/zinc/36/74/50/447367450.db2.gz	GZVZTCOVFCMKRR-AATRIKPKSA-N	-1	3	326.312	1.689	20	5		EDBDHM
Cc1nnc(C[N-]S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)s1	ZINC000542799468	306058691	/nfs/dbraw/zinc/05/86/91/306058691.db2.gz	IPWIWUITQGZUGG-UHFFFAOYSA-N	-1	3	328.375	1.374	20	5		EDBDHM
CCCn1c(SCc2ccc(C(N)=O)cc2[N+](=O)[O-])n[n-]c1=O	ZINC000017231618	441239081	/nfs/dbraw/zinc/23/90/81/441239081.db2.gz	FFKGKADGBIZTIX-UHFFFAOYSA-N	-1	3	337.361	1.693	20	5		EDBDHM
Cc1c(C(=O)NCCNC(=O)c2ccc([O-])cc2)cccc1[N+](=O)[O-]	ZINC000047545286	441203195	/nfs/dbraw/zinc/20/31/95/441203195.db2.gz	YRPQWTJLQAZNGK-UHFFFAOYSA-N	-1	3	343.339	1.769	20	5		EDBDHM
CC[C@@H](C)[C@@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000016083538	441215151	/nfs/dbraw/zinc/21/51/51/441215151.db2.gz	KYILFFWWKQIEEZ-BXKDBHETSA-N	-1	3	330.362	1.461	20	5		EDBDHM
Cc1noc(C)c1CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000107310390	441408541	/nfs/dbraw/zinc/40/85/41/441408541.db2.gz	APQNAHCXDDDMHZ-UHFFFAOYSA-N	-1	3	343.336	1.860	20	5		EDBDHM
O=C(COc1ccccc1[N+](=O)[O-])Nc1nnc(C(F)(F)F)[n-]1	ZINC000036714155	441609911	/nfs/dbraw/zinc/60/99/11/441609911.db2.gz	BNPGPJLKPRQCMO-UHFFFAOYSA-N	-1	3	331.210	1.749	20	5		EDBDHM
O=C(COc1ccccc1[N+](=O)[O-])Nc1nc(C(F)(F)F)n[n-]1	ZINC000036714155	441609916	/nfs/dbraw/zinc/60/99/16/441609916.db2.gz	BNPGPJLKPRQCMO-UHFFFAOYSA-N	-1	3	331.210	1.749	20	5		EDBDHM
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)[N-]C1CCN(C2CC2)CC1	ZINC000123688674	441894692	/nfs/dbraw/zinc/89/46/92/441894692.db2.gz	AQWLQKDILIVADH-UHFFFAOYSA-N	-1	3	343.380	1.639	20	5		EDBDHM
COC[C@@H]([N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-])C1CC1	ZINC000152369245	442203752	/nfs/dbraw/zinc/20/37/52/442203752.db2.gz	KTBPSBARCIQYET-GFCCVEGCSA-N	-1	3	328.390	1.915	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H]1CCCC[C@@H]1CO	ZINC000178916570	442524980	/nfs/dbraw/zinc/52/49/80/442524980.db2.gz	SVXRNJICOKUBPT-NEPJUHHUSA-N	-1	3	328.390	1.733	20	5		EDBDHM
CCN(C)C(=O)[C@@H](C)[N-]S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000188460995	442753088	/nfs/dbraw/zinc/75/30/88/442753088.db2.gz	NKORUJXLAIREKJ-LLVKDONJSA-N	-1	3	343.405	1.357	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](C)[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000266242281	443071099	/nfs/dbraw/zinc/07/10/99/443071099.db2.gz	WIFPKEWXLYWYJR-VHSXEESVSA-N	-1	3	330.362	1.307	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)[C@@H]1CCOC1	ZINC000266249387	443073761	/nfs/dbraw/zinc/07/37/61/443073761.db2.gz	XJLYEGGUOLNCSV-NXEZZACHSA-N	-1	3	330.362	1.307	20	5		EDBDHM
CCS(=O)(=O)[N-]Cc1nc(-c2cc(C)cc([N+](=O)[O-])c2)no1	ZINC000351142250	319094057	/nfs/dbraw/zinc/09/40/57/319094057.db2.gz	DRVLLPKRGATGTK-UHFFFAOYSA-N	-1	3	326.334	1.393	20	5		EDBDHM
CCNC(=O)C(C)(C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000416520635	319439170	/nfs/dbraw/zinc/43/91/70/319439170.db2.gz	PZMLQCBMGAOVRA-UHFFFAOYSA-N	-1	3	349.796	1.441	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CS[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000416583590	319447893	/nfs/dbraw/zinc/44/78/93/319447893.db2.gz	FRFGUWREUSLIPC-IUCAKERBSA-N	-1	3	332.403	1.776	20	5		EDBDHM
C[C@H]([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])c1nnc2n1CCC2	ZINC000264523921	443314646	/nfs/dbraw/zinc/31/46/46/443314646.db2.gz	JUPAIGDKHDPPKR-VIFPVBQESA-N	-1	3	337.361	1.172	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](CO)CC(C)C	ZINC000269660132	443384590	/nfs/dbraw/zinc/38/45/90/443384590.db2.gz	AZRRIJRBTALUMQ-JTQLQIEISA-N	-1	3	332.378	1.289	20	5		EDBDHM
CC(C)[C@H]1OCC[C@H]1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000267305877	443412463	/nfs/dbraw/zinc/41/24/63/443412463.db2.gz	VUJWOAXONBAWRO-SMDDNHRTSA-N	-1	3	328.390	1.934	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](CO)CC(C)(C)C	ZINC000269727987	443413503	/nfs/dbraw/zinc/41/35/03/443413503.db2.gz	WZMKXIDBTREXLC-JTQLQIEISA-N	-1	3	346.405	1.679	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]CC2([S@@](C)=O)CC2)c1C	ZINC000282718118	443415090	/nfs/dbraw/zinc/41/50/90/443415090.db2.gz	ZCGRPEFEXKIAKY-OAQYLSRUSA-N	-1	3	346.430	1.401	20	5		EDBDHM
COc1cc(N2CCC[C@H]2C[C@]2(C)NC(=O)[N-]C2=O)ccc1[N+](=O)[O-]	ZINC000286279742	443682594	/nfs/dbraw/zinc/68/25/94/443682594.db2.gz	GVFNDVPCKAFEBL-ZBEGNZNMSA-N	-1	3	348.359	1.560	20	5		EDBDHM
C[C@@H](Cn1ccnc1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000299096220	443953323	/nfs/dbraw/zinc/95/33/23/443953323.db2.gz	XXBUEGBROXDXRN-VIFPVBQESA-N	-1	3	344.780	1.812	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C1CC1)C(C)(C)CO	ZINC000289624678	444182575	/nfs/dbraw/zinc/18/25/75/444182575.db2.gz	TVWYAPUTUJHJDB-AWEZNQCLSA-N	-1	3	342.417	1.979	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-][C@H]2CCCCC[C@H]2O)c(F)c1	ZINC000317493970	444315893	/nfs/dbraw/zinc/31/58/93/444315893.db2.gz	CFUGNSCRRLOQEO-NWDGAFQWSA-N	-1	3	332.353	1.706	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1CC[C@@H](C)C1	ZINC000323183348	444342229	/nfs/dbraw/zinc/34/22/29/444342229.db2.gz	PWORQBZDWDWDAP-NXEZZACHSA-N	-1	3	342.373	1.848	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@H]2CCC[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000323775426	444345794	/nfs/dbraw/zinc/34/57/94/444345794.db2.gz	YUGQAHBZXNZAQW-QWRGUYRKSA-N	-1	3	344.389	1.433	20	5		EDBDHM
COCCOCCCC[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000337742916	444384562	/nfs/dbraw/zinc/38/45/62/444384562.db2.gz	MFFAPYUNPRDFJS-UHFFFAOYSA-N	-1	3	346.405	1.625	20	5		EDBDHM
O=[N+]([O-])c1ccc([O-])cc1CN1CCC(CN2CCOCC2)CC1	ZINC000332092528	444500678	/nfs/dbraw/zinc/50/06/78/444500678.db2.gz	ABUOAJGCCQAKQX-UHFFFAOYSA-N	-1	3	335.404	1.845	20	5		EDBDHM
CC1CCN(C[C@@H](O)CNc2nc(C(=O)[O-])ccc2[N+](=O)[O-])CC1	ZINC000580569259	322069763	/nfs/dbraw/zinc/06/97/63/322069763.db2.gz	GSNJTACFRCLKRN-NSHDSACASA-N	-1	3	338.364	1.193	20	5		EDBDHM
COCC[C@](C)(O)C[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000342497600	444717019	/nfs/dbraw/zinc/71/70/19/444717019.db2.gz	AMQGJQHDJQAZFE-NSHDSACASA-N	-1	3	338.407	1.031	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000344001684	444719859	/nfs/dbraw/zinc/71/98/59/444719859.db2.gz	ZZIWITCUSWEMJC-JTQLQIEISA-N	-1	3	330.362	1.308	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@]1(C)CCO[C@@H]1C	ZINC000344124454	444794103	/nfs/dbraw/zinc/79/41/03/444794103.db2.gz	WXKJGMHCXVWQEE-RNCFNFMXSA-N	-1	3	330.362	1.449	20	5		EDBDHM
Cc1ccnc(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)c1	ZINC000339048228	445007887	/nfs/dbraw/zinc/00/78/87/445007887.db2.gz	RGXMUKJXPCFGOX-UHFFFAOYSA-N	-1	3	325.321	1.916	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H]1CCC[C@@H]1F	ZINC000339121916	445041744	/nfs/dbraw/zinc/04/17/44/445041744.db2.gz	ALLJEDOIKJQJLY-QWRGUYRKSA-N	-1	3	346.336	1.550	20	5		EDBDHM
COc1cccc(C(=O)N2CCc3nc[n-]c(=O)c3C2)c1[N+](=O)[O-]	ZINC000356989543	445363320	/nfs/dbraw/zinc/36/33/20/445363320.db2.gz	ADRHHAYGNSJRFW-UHFFFAOYSA-N	-1	3	330.300	1.298	20	5		EDBDHM
Cc1cc([N-]C(=O)[C@H](C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)on1	ZINC000357091521	445422712	/nfs/dbraw/zinc/42/27/12/445422712.db2.gz	AQWVUPJHRXIAPC-VIFPVBQESA-N	-1	3	339.329	1.692	20	5		EDBDHM
CCO[C@H]1COCC[C@H]1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000352977581	445567891	/nfs/dbraw/zinc/56/78/91/445567891.db2.gz	PGXUOHXWSJQXTG-PWSUYJOCSA-N	-1	3	330.362	1.067	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCN(C)[C@@H](C)C2)c1C	ZINC000360215009	445633268	/nfs/dbraw/zinc/63/32/68/445633268.db2.gz	IOOVIZQDXMECSZ-AAEUAGOBSA-N	-1	3	341.433	1.973	20	5		EDBDHM
CCC[C@H]([N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])C(=O)OC	ZINC000358615320	445677551	/nfs/dbraw/zinc/67/75/51/445677551.db2.gz	WGMUIIJGFWPUBW-JTQLQIEISA-N	-1	3	330.362	1.523	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]C[C@@H]2CC[C@@H](O)C2)cc1[N+](=O)[O-]	ZINC000353821136	445771359	/nfs/dbraw/zinc/77/13/59/445771359.db2.gz	BHYDHKGBHZCNIA-RKDXNWHRSA-N	-1	3	348.352	1.182	20	5		EDBDHM
COc1cc(S(=O)(=O)[N-]CCOC(F)(F)F)ccc1[N+](=O)[O-]	ZINC000353786570	445755529	/nfs/dbraw/zinc/75/55/29/445755529.db2.gz	HXEVAOKBMILPPH-UHFFFAOYSA-N	-1	3	344.267	1.418	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@H](CO)C(C)(C)C)c1[N+](=O)[O-]	ZINC000190132355	533707650	/nfs/dbraw/zinc/70/76/50/533707650.db2.gz	XYBIAJGBMPRZOP-LLVKDONJSA-N	-1	3	330.406	1.897	20	5		EDBDHM
C[C@@H]1C[C@H]1N1CCN(c2nccc(C(=O)[O-])c2[N+](=O)[O-])C[C@@H](C)C1	ZINC000583324591	326051092	/nfs/dbraw/zinc/05/10/92/326051092.db2.gz	AUHOANCECZIHQO-DMDPSCGWSA-N	-1	3	334.376	1.855	20	5		EDBDHM
O=C(Nc1ccc(C(=O)NC2CC2)cc1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000361984346	446128552	/nfs/dbraw/zinc/12/85/52/446128552.db2.gz	SZHDXJFPCKUPOU-UHFFFAOYSA-N	-1	3	342.311	1.840	20	5		EDBDHM
O=C(Nc1cnn(C[C@H]2CCCO2)c1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000365670399	446294816	/nfs/dbraw/zinc/29/48/16/446294816.db2.gz	SWQLVUQLJMYYMH-LLVKDONJSA-N	-1	3	333.304	1.323	20	5		EDBDHM
Cc1c(Br)c(Sc2nc(CO)n[n-]2)ncc1[N+](=O)[O-]	ZINC000530531664	447907302	/nfs/dbraw/zinc/90/73/02/447907302.db2.gz	WGPPECHVJCSWDN-UHFFFAOYSA-N	-1	3	346.166	1.822	20	5		EDBDHM
Cc1c(Br)c(Sc2n[n-]c(CO)n2)ncc1[N+](=O)[O-]	ZINC000530531664	447907307	/nfs/dbraw/zinc/90/73/07/447907307.db2.gz	WGPPECHVJCSWDN-UHFFFAOYSA-N	-1	3	346.166	1.822	20	5		EDBDHM
C[C@H]1CN(c2ncc(C(=O)[O-])cc2[N+](=O)[O-])CCN(C2CCC2)C1	ZINC000514940632	448230176	/nfs/dbraw/zinc/23/01/76/448230176.db2.gz	ZNNWBZMDUKMCIQ-LLVKDONJSA-N	-1	3	334.376	1.999	20	5		EDBDHM
O=C(CCOc1ccccc1[N+](=O)[O-])N1CCc2c(=O)[n-]cnc2C1	ZINC000577778557	448385563	/nfs/dbraw/zinc/38/55/63/448385563.db2.gz	NAMOPQUODKSCRF-UHFFFAOYSA-N	-1	3	344.327	1.444	20	5		EDBDHM
O=C(c1cccc2[n-]nnc21)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000582396670	449083036	/nfs/dbraw/zinc/08/30/36/449083036.db2.gz	SWQBEKBFJKQMFV-UHFFFAOYSA-N	-1	3	341.331	1.540	20	5		EDBDHM
O=C(c1cccc2nn[n-]c21)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000582396670	449083039	/nfs/dbraw/zinc/08/30/39/449083039.db2.gz	SWQBEKBFJKQMFV-UHFFFAOYSA-N	-1	3	341.331	1.540	20	5		EDBDHM
O=C(c1cccc2n[n-]nc21)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000582396670	449083044	/nfs/dbraw/zinc/08/30/44/449083044.db2.gz	SWQBEKBFJKQMFV-UHFFFAOYSA-N	-1	3	341.331	1.540	20	5		EDBDHM
CSc1ccc(C(=O)NCCc2c(C)[n-][nH]c2=O)cc1[N+](=O)[O-]	ZINC000522262922	449069440	/nfs/dbraw/zinc/06/94/40/449069440.db2.gz	CTOOKVJRKZVVGY-JTQLQIEISA-N	-1	3	336.373	1.559	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H](C)COCC1CC1	ZINC000593654362	449132343	/nfs/dbraw/zinc/13/23/43/449132343.db2.gz	WPEAKTFZDFERNT-JTQLQIEISA-N	-1	3	344.389	1.697	20	5		EDBDHM
CC1(C)CCC[C@@](O)(C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000593589604	449093387	/nfs/dbraw/zinc/09/33/87/449093387.db2.gz	WFPNPYNVLFRSQC-AWEZNQCLSA-N	-1	3	343.405	1.599	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-]CCCn2cncn2)cc1C	ZINC000604277135	449201182	/nfs/dbraw/zinc/20/11/82/449201182.db2.gz	NTISHJMATRHTMX-UHFFFAOYSA-N	-1	3	339.377	1.172	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CCO[C@H]1CCCCO1	ZINC000590586084	449202650	/nfs/dbraw/zinc/20/26/50/449202650.db2.gz	ITQUHTFPWBNPIK-ZDUSSCGKSA-N	-1	3	344.389	1.725	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]C[C@@H](O)C2CCCCC2)nc1	ZINC000593549185	449340202	/nfs/dbraw/zinc/34/02/02/449340202.db2.gz	CFGWNSSFEFLJCH-GFCCVEGCSA-N	-1	3	329.378	1.209	20	5		EDBDHM
COC(=O)[C@@H](CNc1cc[n-]c(=O)c1[N+](=O)[O-])Cc1ccc(O)cc1	ZINC000596124061	449374241	/nfs/dbraw/zinc/37/42/41/449374241.db2.gz	TYNVPOLVGDSTOK-LLVKDONJSA-N	-1	3	347.327	1.845	20	5		EDBDHM
C[C@H](Cc1ccsc1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593534438	449331261	/nfs/dbraw/zinc/33/12/61/449331261.db2.gz	NIIKIWJGJYSQBR-SECBINFHSA-N	-1	3	327.387	1.961	20	5		EDBDHM
Cc1cc(N2CCC[C@@H](Nc3cc[n-]c(=O)c3[N+](=O)[O-])C2)n(C)n1	ZINC000596212396	449418056	/nfs/dbraw/zinc/41/80/56/449418056.db2.gz	FASGTKVZZJZEGG-LLVKDONJSA-N	-1	3	332.364	1.818	20	5		EDBDHM
C[C@H](CC[N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])N1CCCCC1	ZINC000594770649	449683596	/nfs/dbraw/zinc/68/35/96/449683596.db2.gz	BQDJNEFLJQOFAZ-GFCCVEGCSA-N	-1	3	342.421	1.533	20	5		EDBDHM
CC(C)(C)N1CC[C@H](C[N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])C1	ZINC000594790546	449699589	/nfs/dbraw/zinc/69/95/89/449699589.db2.gz	MPKBCRZLWHBACM-LLVKDONJSA-N	-1	3	342.421	1.389	20	5		EDBDHM
O=[N+]([O-])c1c2cccnc2ccc1S(=O)(=O)[N-]CCN1CCC1	ZINC000594775981	449687782	/nfs/dbraw/zinc/68/77/82/449687782.db2.gz	OVVODFFVDUQGCE-UHFFFAOYSA-N	-1	3	336.373	1.127	20	5		EDBDHM
C[C@@H]1CCC[C@H](C[N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)O1	ZINC000594849861	449757643	/nfs/dbraw/zinc/75/76/43/449757643.db2.gz	AFSYZVYLGOTNNN-MWLCHTKSSA-N	-1	3	332.353	1.970	20	5		EDBDHM
CCN1CCC[C@H]([N-]S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)C1	ZINC000601314122	449823433	/nfs/dbraw/zinc/82/34/33/449823433.db2.gz	YXVUUZJFIPVCGJ-NSHDSACASA-N	-1	3	345.396	1.805	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-]CCN2CC[C@H](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000601361142	449874638	/nfs/dbraw/zinc/87/46/38/449874638.db2.gz	CNWLFJKCVHKVDV-JTQLQIEISA-N	-1	3	345.396	1.662	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)C1CCCC1	ZINC000599472444	450000943	/nfs/dbraw/zinc/00/09/43/450000943.db2.gz	GKNSXMRUFVYPSZ-UHFFFAOYSA-N	-1	3	340.401	1.816	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H]1CO[C@H](C2CC2)C1	ZINC000599484006	450012474	/nfs/dbraw/zinc/01/24/74/450012474.db2.gz	JWVQAZSIYLMAFT-MFKMUULPSA-N	-1	3	342.373	1.449	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@H](C)c1nccn1C	ZINC000595383425	450097800	/nfs/dbraw/zinc/09/78/00/450097800.db2.gz	NIVYKVVCTNXVGM-VIFPVBQESA-N	-1	3	340.361	1.376	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1C[C@@H](C)O[C@@H](C)C1	ZINC000619494476	450491115	/nfs/dbraw/zinc/49/11/15/450491115.db2.gz	CWJKIYKTOPNLRQ-JGPRNRPPSA-N	-1	3	344.389	1.838	20	5		EDBDHM
O=C(OCCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)C(=O)[N-]C2=O	ZINC000732339249	578706358	/nfs/dbraw/zinc/70/63/58/578706358.db2.gz	FHLAKJGBULFNOB-UHFFFAOYSA-N	-1	3	340.291	1.878	20	5		EDBDHM
O=C(Nc1ccncc1-c1nnn[n-]1)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000738194624	579170093	/nfs/dbraw/zinc/17/00/93/579170093.db2.gz	FTFXNTFIMUBFKY-UHFFFAOYSA-N	-1	3	345.706	1.498	20	5		EDBDHM
O=C(Nc1ccncc1-c1nn[n-]n1)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000738194624	579170094	/nfs/dbraw/zinc/17/00/94/579170094.db2.gz	FTFXNTFIMUBFKY-UHFFFAOYSA-N	-1	3	345.706	1.498	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])n[nH]1	ZINC000738392142	579188818	/nfs/dbraw/zinc/18/88/18/579188818.db2.gz	ZLZZWHBEHGNSQR-UHFFFAOYSA-N	-1	3	340.361	1.367	20	5		EDBDHM
CCc1cc(C[N-]S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])[nH]n1	ZINC000738392142	579188819	/nfs/dbraw/zinc/18/88/19/579188819.db2.gz	ZLZZWHBEHGNSQR-UHFFFAOYSA-N	-1	3	340.361	1.367	20	5		EDBDHM
C[C@H]1CCN(CC[N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1	ZINC000745942245	579568115	/nfs/dbraw/zinc/56/81/15/579568115.db2.gz	CAZJQHQMQUNNGW-JTQLQIEISA-N	-1	3	331.369	1.354	20	5		EDBDHM
O=C([N-]c1ncccn1)c1c2c(cc([N+](=O)[O-])c1[N+](=O)[O-])OCCO2	ZINC000751225470	579797999	/nfs/dbraw/zinc/79/79/99/579797999.db2.gz	SISFMMNGENEOOF-UHFFFAOYSA-N	-1	3	347.243	1.317	20	5		EDBDHM
CC[C@H](C)[C@H]([N-]S(=O)(=O)c1csc([N+](=O)[O-])c1)C(=O)OC	ZINC000768811608	580220986	/nfs/dbraw/zinc/22/09/86/580220986.db2.gz	IWCCUFAZYBHKFX-XVKPBYJWSA-N	-1	3	336.391	1.522	20	5		EDBDHM
Cc1ccc([C@H](O)C[N-]S(=O)(=O)c2csc([N+](=O)[O-])c2)o1	ZINC000768841967	580222098	/nfs/dbraw/zinc/22/20/98/580222098.db2.gz	LBILLRNMINSYFB-SECBINFHSA-N	-1	3	332.359	1.570	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-][C@@H](CO)c2cccc(F)c2)cs1	ZINC000768849872	580222390	/nfs/dbraw/zinc/22/23/90/580222390.db2.gz	RLMKYZUCUDSCNR-NSHDSACASA-N	-1	3	346.361	1.807	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]C[C@H]2CSCCS2)cs1	ZINC000768855598	580222617	/nfs/dbraw/zinc/22/26/17/580222617.db2.gz	ZXJDAISZYUXZIY-ZETCQYMHSA-N	-1	3	340.473	1.783	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]N=c2[nH]cccc2[N+](=O)[O-])cs1	ZINC000768889965	580223621	/nfs/dbraw/zinc/22/36/21/580223621.db2.gz	QOTBASZWEIQJQX-UHFFFAOYSA-N	-1	3	345.318	1.265	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)NN=c2[n-]cccc2[N+](=O)[O-])cs1	ZINC000768889965	580223622	/nfs/dbraw/zinc/22/36/22/580223622.db2.gz	QOTBASZWEIQJQX-UHFFFAOYSA-N	-1	3	345.318	1.265	20	5		EDBDHM
Cc1c(CO)cc([N+](=O)[O-])c([N-][C@@H](C)c2ncn(C)n2)c1[N+](=O)[O-]	ZINC000780616102	580528960	/nfs/dbraw/zinc/52/89/60/580528960.db2.gz	JDOFVBUVNCEQDU-QMMMGPOBSA-N	-1	3	336.308	1.605	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](CCO)C1CC1	ZINC000795120645	580913742	/nfs/dbraw/zinc/91/37/42/580913742.db2.gz	LQLUFCBHWBPPMY-SNVBAGLBSA-N	-1	3	330.362	1.043	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1cccc(F)n1	ZINC000795147813	580914477	/nfs/dbraw/zinc/91/44/77/580914477.db2.gz	YKOHZCMMAZFRNK-UHFFFAOYSA-N	-1	3	341.320	1.616	20	5		EDBDHM
O=[N+]([O-])c1ccc(S(=O)(=O)[N-]Cc2cccnc2F)c(F)c1	ZINC000795268000	580917179	/nfs/dbraw/zinc/91/71/79/580917179.db2.gz	MIBNZKWNHILALQ-UHFFFAOYSA-N	-1	3	329.284	1.747	20	5		EDBDHM
Cc1nc2sccc2c(=O)n1[N-]C(=O)c1ccc([N+](=O)[O-])n1C	ZINC000797396440	580974479	/nfs/dbraw/zinc/97/44/79/580974479.db2.gz	ZLARMAWTNCZXIN-UHFFFAOYSA-N	-1	3	333.329	1.397	20	5		EDBDHM
Cc1nnc([C@H](C)[N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)[nH]1	ZINC000804815253	590780366	/nfs/dbraw/zinc/78/03/66/590780366.db2.gz	PTIOIGDNGSTCGH-ZETCQYMHSA-N	-1	3	325.275	1.991	20	5		EDBDHM
Cc1nc([C@H](C)[N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)n[nH]1	ZINC000804815253	590780370	/nfs/dbraw/zinc/78/03/70/590780370.db2.gz	PTIOIGDNGSTCGH-ZETCQYMHSA-N	-1	3	325.275	1.991	20	5		EDBDHM
CCS(=O)(=O)C[C@H](C)Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000736655282	593023376	/nfs/dbraw/zinc/02/33/76/593023376.db2.gz	AKFYEIQYMHVBLS-QMMMGPOBSA-N	-1	3	340.365	1.010	20	5		EDBDHM
CCS(=O)(=O)C[C@H](C)Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000736655282	593023377	/nfs/dbraw/zinc/02/33/77/593023377.db2.gz	AKFYEIQYMHVBLS-QMMMGPOBSA-N	-1	3	340.365	1.010	20	5		EDBDHM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]CC[C@H](O)C(F)(F)F)cs1	ZINC000768846579	593442325	/nfs/dbraw/zinc/44/23/25/593442325.db2.gz	LUOZGBFMEIUTQZ-LURJTMIESA-N	-1	3	334.297	1.248	20	5		EDBDHM
CC(C)OCCO[N-]C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21	ZINC000812805322	593509786	/nfs/dbraw/zinc/50/97/86/593509786.db2.gz	KMIRUUOBDINTJN-UHFFFAOYSA-N	-1	3	335.316	1.935	20	5		EDBDHM
CC(C)N1C[C@@H](Nc2ccc(-c3nnn[n-]3)c([N+](=O)[O-])c2)CC1=O	ZINC000820128653	593793386	/nfs/dbraw/zinc/79/33/86/593793386.db2.gz	SMMZKSPGPJSVLS-JTQLQIEISA-N	-1	3	331.336	1.196	20	5		EDBDHM
C[C@H](Cc1ccncc1)Nc1ncc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000820308499	593808620	/nfs/dbraw/zinc/80/86/20/593808620.db2.gz	VWTTUDWSWYXXRP-SECBINFHSA-N	-1	3	326.320	1.608	20	5		EDBDHM
C[C@H](Cc1ccncc1)Nc1ncc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000820308499	593808621	/nfs/dbraw/zinc/80/86/21/593808621.db2.gz	VWTTUDWSWYXXRP-SECBINFHSA-N	-1	3	326.320	1.608	20	5		EDBDHM
Cc1cc(C[C@H](C)Nc2nccc(-c3nnn[n-]3)c2[N+](=O)[O-])n[nH]1	ZINC000822200158	594008549	/nfs/dbraw/zinc/00/85/49/594008549.db2.gz	WUMHEJUIXLOQOA-ZETCQYMHSA-N	-1	3	329.324	1.245	20	5		EDBDHM
Cc1cc(C[C@H](C)Nc2nccc(-c3nnn[n-]3)c2[N+](=O)[O-])[nH]n1	ZINC000822200158	594008551	/nfs/dbraw/zinc/00/85/51/594008551.db2.gz	WUMHEJUIXLOQOA-ZETCQYMHSA-N	-1	3	329.324	1.245	20	5		EDBDHM
Cc1cc(C[C@H](C)Nc2nccc(-c3nn[n-]n3)c2[N+](=O)[O-])n[nH]1	ZINC000822200158	594008554	/nfs/dbraw/zinc/00/85/54/594008554.db2.gz	WUMHEJUIXLOQOA-ZETCQYMHSA-N	-1	3	329.324	1.245	20	5		EDBDHM
Cc1cc(C[C@H](C)Nc2nccc(-c3nn[n-]n3)c2[N+](=O)[O-])[nH]n1	ZINC000822200158	594008557	/nfs/dbraw/zinc/00/85/57/594008557.db2.gz	WUMHEJUIXLOQOA-ZETCQYMHSA-N	-1	3	329.324	1.245	20	5		EDBDHM
CCOC(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)C1	ZINC000821337869	594021983	/nfs/dbraw/zinc/02/19/83/594021983.db2.gz	PPXXBHVHVNEDCQ-SNVBAGLBSA-N	-1	3	346.347	1.554	20	5		EDBDHM
CCOC(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)C1	ZINC000821337869	594021984	/nfs/dbraw/zinc/02/19/84/594021984.db2.gz	PPXXBHVHVNEDCQ-SNVBAGLBSA-N	-1	3	346.347	1.554	20	5		EDBDHM
NC(=O)[C@H]1CCCCC[C@@H]1Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000822860410	594112376	/nfs/dbraw/zinc/11/23/76/594112376.db2.gz	UGXRQDFXTJBQOJ-QWRGUYRKSA-N	-1	3	345.363	1.621	20	5		EDBDHM
NC(=O)[C@H]1CCCCC[C@@H]1Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000822860410	594112378	/nfs/dbraw/zinc/11/23/78/594112378.db2.gz	UGXRQDFXTJBQOJ-QWRGUYRKSA-N	-1	3	345.363	1.621	20	5		EDBDHM
CCN(C(=O)Cn1ccc([N+](=O)[O-])n1)c1ccc(-c2nnn[n-]2)cc1	ZINC000825376274	594175776	/nfs/dbraw/zinc/17/57/76/594175776.db2.gz	FGULRDFCHWQOMR-UHFFFAOYSA-N	-1	3	342.319	1.025	20	5		EDBDHM
CCN(C(=O)Cn1ccc([N+](=O)[O-])n1)c1ccc(-c2nn[n-]n2)cc1	ZINC000825376274	594175777	/nfs/dbraw/zinc/17/57/77/594175777.db2.gz	FGULRDFCHWQOMR-UHFFFAOYSA-N	-1	3	342.319	1.025	20	5		EDBDHM
O=[N+]([O-])c1cc(NCCCOC[C@@H]2CCOC2)ccc1-c1nnn[n-]1	ZINC000823635290	594223518	/nfs/dbraw/zinc/22/35/18/594223518.db2.gz	UXGZQRLEPDXCLZ-NSHDSACASA-N	-1	3	348.363	1.630	20	5		EDBDHM
CCc1nn(C)c(NCc2cc(-c3nnn[n-]3)ccc2F)c1[N+](=O)[O-]	ZINC000825759388	594239715	/nfs/dbraw/zinc/23/97/15/594239715.db2.gz	DWSFMUDOKIKRPY-UHFFFAOYSA-N	-1	3	346.326	1.822	20	5		EDBDHM
CCc1nn(C)c(NCc2cc(-c3nn[n-]n3)ccc2F)c1[N+](=O)[O-]	ZINC000825759388	594239716	/nfs/dbraw/zinc/23/97/16/594239716.db2.gz	DWSFMUDOKIKRPY-UHFFFAOYSA-N	-1	3	346.326	1.822	20	5		EDBDHM
CN(CC(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1-c1nnn[n-]1	ZINC000825897799	594271849	/nfs/dbraw/zinc/27/18/49/594271849.db2.gz	NZXPTTNUWGFXDE-UHFFFAOYSA-N	-1	3	334.336	1.553	20	5		EDBDHM
CN(CC(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1-c1nn[n-]n1	ZINC000825897799	594271850	/nfs/dbraw/zinc/27/18/50/594271850.db2.gz	NZXPTTNUWGFXDE-UHFFFAOYSA-N	-1	3	334.336	1.553	20	5		EDBDHM
CN(C[C@H]1CCCC[C@H]1O)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000825909205	594275768	/nfs/dbraw/zinc/27/57/68/594275768.db2.gz	UFOFBANHSUXEKC-BXUZGUMPSA-N	-1	3	332.364	1.762	20	5		EDBDHM
CN(C[C@H]1CCCC[C@H]1O)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000825909205	594275770	/nfs/dbraw/zinc/27/57/70/594275770.db2.gz	UFOFBANHSUXEKC-BXUZGUMPSA-N	-1	3	332.364	1.762	20	5		EDBDHM
CN(C[C@@H]1CCCC[C@@H]1O)c1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-]	ZINC000825909206	594275990	/nfs/dbraw/zinc/27/59/90/594275990.db2.gz	UFOFBANHSUXEKC-FZMZJTMJSA-N	-1	3	332.364	1.762	20	5		EDBDHM
CN(C[C@@H]1CCCC[C@@H]1O)c1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-]	ZINC000825909206	594275991	/nfs/dbraw/zinc/27/59/91/594275991.db2.gz	UFOFBANHSUXEKC-FZMZJTMJSA-N	-1	3	332.364	1.762	20	5		EDBDHM
COc1ccc(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)cc1[N+](=O)[O-]	ZINC000826209738	594380530	/nfs/dbraw/zinc/38/05/30/594380530.db2.gz	OGWZMCXMBSVANP-UHFFFAOYSA-N	-1	3	329.276	1.364	20	5		EDBDHM
COc1ccc(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)cc1[N+](=O)[O-]	ZINC000826209738	594380531	/nfs/dbraw/zinc/38/05/31/594380531.db2.gz	OGWZMCXMBSVANP-UHFFFAOYSA-N	-1	3	329.276	1.364	20	5		EDBDHM
O=[N+]([O-])c1cc(N2CCC(c3cc[nH]n3)CC2)ccc1-c1nnn[n-]1	ZINC000826498462	594502960	/nfs/dbraw/zinc/50/29/60/594502960.db2.gz	VYWVRFUQHBFEOA-UHFFFAOYSA-N	-1	3	340.347	1.882	20	5		EDBDHM
COc1ccc(OCCN(C)[C@@H]2CCN(C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000829499689	594626534	/nfs/dbraw/zinc/62/65/34/594626534.db2.gz	BSDJDYKDCZJSIH-LLVKDONJSA-N	-1	3	339.348	1.666	20	5		EDBDHM
O=C([O-])N1CCC[C@@H]1[C@@H]1CCCN(CCn2ccc([N+](=O)[O-])n2)C1	ZINC000832004296	594718594	/nfs/dbraw/zinc/71/85/94/594718594.db2.gz	DVFCQNCVDPEZEC-CHWSQXEVSA-N	-1	3	337.380	1.646	20	5		EDBDHM
CC1(C)COC(=O)[C@@H]1[N-]S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1	ZINC000841533041	594916637	/nfs/dbraw/zinc/91/66/37/594916637.db2.gz	APAXVGHNMOUVOP-LBPRGKRZSA-N	-1	3	342.373	1.008	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(OCCC(=O)[N-]O[C@@H](CO)C(C)C)c1	ZINC000836901539	595012711	/nfs/dbraw/zinc/01/27/11/595012711.db2.gz	SMUZXNQICJZLJA-AWEZNQCLSA-N	-1	3	326.349	1.737	20	5		EDBDHM
O=C([O-])N[C@@H]1CCC[C@@H]2CN(C[C@H](O)c3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000834186804	595046445	/nfs/dbraw/zinc/04/64/45/595046445.db2.gz	KSLVOIHYVYGNDQ-BVUBDWEXSA-N	-1	3	349.387	1.996	20	5		EDBDHM
O=C(C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)OC1CCCCC1	ZINC000845888845	595089299	/nfs/dbraw/zinc/08/92/99/595089299.db2.gz	ZUXQZZWIGYBQQL-UHFFFAOYSA-N	-1	3	343.361	1.144	20	5		EDBDHM
CS[C@@H]1CN(c2ccc(CC(=O)[O-])cc2[N+](=O)[O-])C[C@@H]1N(C)C	ZINC000844215509	595304008	/nfs/dbraw/zinc/30/40/08/595304008.db2.gz	QQVRPAOMXGBNPD-UONOGXRCSA-N	-1	3	339.417	1.704	20	5		EDBDHM
O=C([N-]CC1(O)CCCC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848582058	595408885	/nfs/dbraw/zinc/40/88/85/595408885.db2.gz	FPWUUOVHEUEVDC-UHFFFAOYSA-N	-1	3	330.287	1.988	20	5		EDBDHM
C[C@@](O)(C[N-]C(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000848582965	595409273	/nfs/dbraw/zinc/40/92/73/595409273.db2.gz	MEKAUBRFWQWFGR-CYBMUJFWSA-N	-1	3	330.287	1.844	20	5		EDBDHM
CC1(C[N-]C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)OCCO1	ZINC000848586134	595410351	/nfs/dbraw/zinc/41/03/51/595410351.db2.gz	HKOJZYQVZRNJRL-UHFFFAOYSA-N	-1	3	332.259	1.446	20	5		EDBDHM
C[C@H]1CCNC(=O)[C@@H]1[N-]C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000848589356	595411072	/nfs/dbraw/zinc/41/10/72/595411072.db2.gz	DOPPPZFSBNQSIY-GZMMTYOYSA-N	-1	3	343.286	1.207	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(OC)OC	ZINC000849406523	595521678	/nfs/dbraw/zinc/52/16/78/595521678.db2.gz	KXJSRYMWVGIVKR-SNVBAGLBSA-N	-1	3	348.377	1.279	20	5		EDBDHM
C[C@@H]1C[C@H]1COC(=O)C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000859677240	596164624	/nfs/dbraw/zinc/16/46/24/596164624.db2.gz	HBWPOXWVHLWUGO-ZJUUUORDSA-N	-1	3	328.346	1.072	20	5		EDBDHM
NC(=O)c1cnc([N-]C(=O)c2cc(F)c([N+](=O)[O-])cc2F)s1	ZINC000124951284	597015923	/nfs/dbraw/zinc/01/59/23/597015923.db2.gz	RFOJTWWIRFBWKC-UHFFFAOYSA-N	-1	3	328.256	1.681	20	5		EDBDHM
Cc1nn(C)c2c1N(C(=O)c1n[n-]c3ccc([N+](=O)[O-])cc31)CCO2	ZINC000268180119	282277767	/nfs/dbraw/zinc/27/77/67/282277767.db2.gz	NIKXHULFMBETRW-UHFFFAOYSA-N	-1	3	342.315	1.552	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H](C)C(=O)NC(C)C)cc1C	ZINC000416623389	251088395	/nfs/dbraw/zinc/08/83/95/251088395.db2.gz	OEZGDEGTOOTGRD-LLVKDONJSA-N	-1	3	343.405	1.403	20	5		EDBDHM
COc1cc([C@H]2NC(=O)CN2Cc2ccccc2)c([N+](=O)[O-])cc1[O-]	ZINC000112369298	220316365	/nfs/dbraw/zinc/31/63/65/220316365.db2.gz	AZHWFPVKDSDNTD-KRWDZBQOSA-N	-1	3	343.339	1.940	20	5		EDBDHM
CCN1CC[C@@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])c([O-])c3)[C@H]2C1	ZINC000355315065	285379337	/nfs/dbraw/zinc/37/93/37/285379337.db2.gz	IFEUETKSEBJDGA-ZFWWWQNUSA-N	-1	3	335.360	1.236	20	5		EDBDHM
CCOc1cc([N+](=O)[O-])c(C(=O)Nc2n[n-]c(OC)n2)cc1OC	ZINC000271230469	140260651	/nfs/dbraw/zinc/26/06/51/140260651.db2.gz	AWNXGIKABQIRHB-UHFFFAOYSA-N	-1	3	337.292	1.381	20	5		EDBDHM
CC(C)[C@H](O)C1(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000271821255	140356124	/nfs/dbraw/zinc/35/61/24/140356124.db2.gz	NHJGLGUPIJSIAR-ZDUSSCGKSA-N	-1	3	328.390	1.670	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]CCCCCCO	ZINC000271834357	140358475	/nfs/dbraw/zinc/35/84/75/140358475.db2.gz	PGSGDZGRPNBYLT-UHFFFAOYSA-N	-1	3	332.378	1.434	20	5		EDBDHM
Cc1ccc(S(=O)(=O)[N-][C@H]2CN(C3CC3)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000331416888	141022020	/nfs/dbraw/zinc/02/20/20/141022020.db2.gz	AGCMNJRLXIBXTL-YPMHNXCESA-N	-1	3	339.417	1.664	20	5		EDBDHM
O=C(Nc1cccc(N2CCNC2=O)c1)c1cc([N+](=O)[O-])c[n-]c1=O	ZINC000339372445	142029383	/nfs/dbraw/zinc/02/93/83/142029383.db2.gz	SZQYEXTXZZVEHB-UHFFFAOYSA-N	-1	3	343.299	1.477	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]Cc1nccc(C(F)F)n1	ZINC000344963074	143031666	/nfs/dbraw/zinc/03/16/66/143031666.db2.gz	XYCQBHZRTMNZDL-UHFFFAOYSA-N	-1	3	344.299	1.801	20	5		EDBDHM
O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCc2c(=O)[n-]cnc2C1	ZINC000345218678	143065911	/nfs/dbraw/zinc/06/59/11/143065911.db2.gz	IAEFDXLTVYAQBG-UHFFFAOYSA-N	-1	3	340.299	1.165	20	5		EDBDHM
Cc1ccc([O-])c(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)n1	ZINC000345928730	143148263	/nfs/dbraw/zinc/14/82/63/143148263.db2.gz	NYTPFPGEEZRVJC-UHFFFAOYSA-N	-1	3	340.299	1.837	20	5		EDBDHM
O=C(Nc1cccc(OCC(F)F)n1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000347985312	143387683	/nfs/dbraw/zinc/38/76/83/143387683.db2.gz	WUWUYUQFJZMYAT-UHFFFAOYSA-N	-1	3	340.242	1.987	20	5		EDBDHM
CCc1nnc(C[N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)s1	ZINC000352592290	149078039	/nfs/dbraw/zinc/07/80/39/149078039.db2.gz	CUPSAAYKZGWZRI-UHFFFAOYSA-N	-1	3	342.402	1.628	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC2(OC)CCC2)c([N+](=O)[O-])c1	ZINC000355735977	150380636	/nfs/dbraw/zinc/38/06/36/150380636.db2.gz	XXLKEKRSWSSMJN-UHFFFAOYSA-N	-1	3	330.362	1.451	20	5		EDBDHM
O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCc2c(=O)[n-]cnc2C1	ZINC000360979676	152269607	/nfs/dbraw/zinc/26/96/07/152269607.db2.gz	XIIUJTHRNTXDCX-UHFFFAOYSA-N	-1	3	334.719	1.942	20	5		EDBDHM
CC1(C)C[C@@H]1C[N-]S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000352470229	162199522	/nfs/dbraw/zinc/19/95/22/162199522.db2.gz	IITJRFNYLGKVDN-SECBINFHSA-N	-1	3	342.373	1.690	20	5		EDBDHM
COC(=O)c1cc(C(=O)NCc2ncccc2[O-])cc([N+](=O)[O-])c1	ZINC000352502076	162216495	/nfs/dbraw/zinc/21/64/95/162216495.db2.gz	QRCYZNDLPHUORA-UHFFFAOYSA-N	-1	3	331.284	1.412	20	5		EDBDHM
CC1CCN(C[C@@H](O)CNC(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC1	ZINC000119220124	287350756	/nfs/dbraw/zinc/35/07/56/287350756.db2.gz	PWHTWVWCWYBTJG-ZDUSSCGKSA-N	-1	3	337.376	1.123	20	5		EDBDHM
C[C@H](CO)[N-]S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000122809396	222162598	/nfs/dbraw/zinc/16/25/98/222162598.db2.gz	FAHVNGBBCCMSFS-ZCFIWIBFSA-N	-1	3	339.167	1.016	20	5		EDBDHM
C[C@@H]1C[C@@H]([N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])CN1C1CC1	ZINC000124059670	222371404	/nfs/dbraw/zinc/37/14/04/222371404.db2.gz	GRIMABOWSVHJQL-NXEZZACHSA-N	-1	3	343.380	1.637	20	5		EDBDHM
CCC(CC)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC	ZINC000276081625	268394895	/nfs/dbraw/zinc/39/48/95/268394895.db2.gz	GLLYPXIFXCVJFE-UHFFFAOYSA-N	-1	3	330.362	1.848	20	5		EDBDHM
CS[C@H](CO)[C@H](C)[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000276919884	268497088	/nfs/dbraw/zinc/49/70/88/268497088.db2.gz	YRTLXKBHGPHNAO-WDEREUQCSA-N	-1	3	348.446	1.602	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@H]2CCOC[C@H]2C)cc1C	ZINC000277947939	273237203	/nfs/dbraw/zinc/23/72/03/273237203.db2.gz	RINCLOGAPSADDU-NEPJUHHUSA-N	-1	3	328.390	1.915	20	5		EDBDHM
COc1c(F)cc(S(=O)(=O)[N-]CCC2(O)CCC2)cc1[N+](=O)[O-]	ZINC000283903177	274004531	/nfs/dbraw/zinc/00/45/31/274004531.db2.gz	KBRMFXXAKLSPBX-UHFFFAOYSA-N	-1	3	348.352	1.326	20	5		EDBDHM
CC(C)[C@@](C)([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C(N)=O	ZINC000285430108	274539999	/nfs/dbraw/zinc/53/99/99/274539999.db2.gz	WQSQZPXTVHTKQB-GFCCVEGCSA-N	-1	3	349.796	1.427	20	5		EDBDHM
CC[C@H](C)[C@H]([N-]S(C)(=O)=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1	ZINC000348013432	280793195	/nfs/dbraw/zinc/79/31/95/280793195.db2.gz	OORAXDRWHNFPCK-UFBFGSQYSA-N	-1	3	347.368	1.636	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-]C2(CC(N)=O)CCC2)c1[N+](=O)[O-]	ZINC000360023249	301554983	/nfs/dbraw/zinc/55/49/83/301554983.db2.gz	KJWSQTBXROZLBV-UHFFFAOYSA-N	-1	3	341.389	1.288	20	5		EDBDHM
CC/C(C)=C/C(=O)NCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000295718892	303256989	/nfs/dbraw/zinc/25/69/89/303256989.db2.gz	DJWWLWUNPXTBTF-ZHACJKMWSA-N	-1	3	341.389	1.346	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-])[C@H](O)C(F)F	ZINC000295761443	303262912	/nfs/dbraw/zinc/26/29/12/303262912.db2.gz	PEOQZQSGBSLUNI-SCZZXKLOSA-N	-1	3	338.332	1.586	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]C[C@@H]1CCN(C)C(=O)C1	ZINC000425179472	304952020	/nfs/dbraw/zinc/95/20/20/304952020.db2.gz	BCXLZJYHVFAIQJ-LLVKDONJSA-N	-1	3	341.389	1.050	20	5		EDBDHM
Cc1[nH]c(=O)[n-]c(=O)c1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000427151746	304985906	/nfs/dbraw/zinc/98/59/06/304985906.db2.gz	XHIYKBPEMXMCNL-UHFFFAOYSA-N	-1	3	343.299	1.767	20	5		EDBDHM
O=C(c1ccc(O)cc1[O-])N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000436665065	305164368	/nfs/dbraw/zinc/16/43/68/305164368.db2.gz	NAUXUFDCOVDSPH-JTQLQIEISA-N	-1	3	344.327	1.728	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-]CC2([S@](C)=O)CC2)cc1[N+](=O)[O-]	ZINC000443092463	305235221	/nfs/dbraw/zinc/23/52/21/305235221.db2.gz	ZXXCMBWNKOYDNF-IBGZPJMESA-N	-1	3	338.432	1.154	20	5		EDBDHM
CCC1(C[N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])COC1	ZINC000451950338	305373533	/nfs/dbraw/zinc/37/35/33/305373533.db2.gz	GUYVHMQOVAMCSG-UHFFFAOYSA-N	-1	3	328.390	1.917	20	5		EDBDHM
C[C@H](Cc1cnn(C)c1)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000451959750	305374193	/nfs/dbraw/zinc/37/41/93/305374193.db2.gz	DMIIFVFVHUXYGA-SECBINFHSA-N	-1	3	342.352	1.377	20	5		EDBDHM
CCO[C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	ZINC000452062601	305381396	/nfs/dbraw/zinc/38/13/96/305381396.db2.gz	TYDPNQNVZGBYOR-DGCLKSJQSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1nccc([N-]C(=O)c2nn(C)cc2[N+](=O)[O-])c1Br	ZINC000525850573	305829083	/nfs/dbraw/zinc/82/90/83/305829083.db2.gz	LLAZFRHZIIKFRQ-UHFFFAOYSA-N	-1	3	340.137	1.468	20	5		EDBDHM
CN1CCN(CCCCNC(=O)c2cc([O-])cc([N+](=O)[O-])c2)CC1	ZINC000543731215	306068107	/nfs/dbraw/zinc/06/81/07/306068107.db2.gz	XEUKOBMTCDCHMD-UHFFFAOYSA-N	-1	3	336.392	1.058	20	5		EDBDHM
CCOC(=O)Cc1csc([N-]C(=O)c2c[nH]nc2[N+](=O)[O-])n1	ZINC000547756331	306110800	/nfs/dbraw/zinc/11/08/00/306110800.db2.gz	PDIDWFQBNZCSDL-UHFFFAOYSA-N	-1	3	325.306	1.132	20	5		EDBDHM
Cn1ncc2c1CCC[C@H]2[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000026850606	441386619	/nfs/dbraw/zinc/38/66/19/441386619.db2.gz	QGHKJEBBNRIVLA-LLVKDONJSA-N	-1	3	336.373	1.684	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@H](C)[C@@H]1CCCO1	ZINC000028327330	441430780	/nfs/dbraw/zinc/43/07/80/441430780.db2.gz	YESJDHVNHKJSHQ-KOLCDFICSA-N	-1	3	330.362	1.449	20	5		EDBDHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCCOC[C@H]1CCCO1	ZINC000030498865	441494957	/nfs/dbraw/zinc/49/49/57/441494957.db2.gz	XMSOVNXGLBZSBL-GFCCVEGCSA-N	-1	3	344.389	1.459	20	5		EDBDHM
CCC(CC)(CO)C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000159223587	441796124	/nfs/dbraw/zinc/79/61/24/441796124.db2.gz	IZWHNIYWUNKSHV-UHFFFAOYSA-N	-1	3	330.406	1.980	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-][C@@H]1C[C@H]2CC[C@@H]1O2	ZINC000151046679	441995925	/nfs/dbraw/zinc/99/59/25/441995925.db2.gz	QIPJKSIKEDMINI-KKZNHRDASA-N	-1	3	332.765	1.846	20	5		EDBDHM
O=C([N-]c1cccc(CN2CCOCC2)n1)c1ccc([N+](=O)[O-])o1	ZINC000179784681	442503242	/nfs/dbraw/zinc/50/32/42/442503242.db2.gz	LWDSEVITICGSRS-UHFFFAOYSA-N	-1	3	332.316	1.667	20	5		EDBDHM
Cn1cc(-c2csc(NC(=O)c3c[n-]c(=O)c([N+](=O)[O-])c3)n2)cn1	ZINC000188277809	442732655	/nfs/dbraw/zinc/73/26/55/442732655.db2.gz	ROJBINHEYIAABC-UHFFFAOYSA-N	-1	3	346.328	1.805	20	5		EDBDHM
C[C@H](O)CC(C)(C)C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000182812155	442829519	/nfs/dbraw/zinc/82/95/19/442829519.db2.gz	YYQIYDASORDXJG-VIFPVBQESA-N	-1	3	334.369	1.809	20	5		EDBDHM
CCN1CCC[C@H]1C[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000189793150	443012345	/nfs/dbraw/zinc/01/23/45/443012345.db2.gz	JQYIIGQJDVIDAF-ZDUSSCGKSA-N	-1	3	341.433	1.974	20	5		EDBDHM
Cc1ccc(C)c(S(=O)(=O)[N-][C@@H]2CCCCNC2=O)c1[N+](=O)[O-]	ZINC000189840344	443018851	/nfs/dbraw/zinc/01/88/51/443018851.db2.gz	HLNHDWXPQLECGH-LLVKDONJSA-N	-1	3	341.389	1.159	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@H](C)[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000266242282	443071138	/nfs/dbraw/zinc/07/11/38/443071138.db2.gz	WIFPKEWXLYWYJR-ZJUUUORDSA-N	-1	3	330.362	1.307	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H]1CCC[C@@H]1O	ZINC000269295976	443270930	/nfs/dbraw/zinc/27/09/30/443270930.db2.gz	NQUKOULHPUZJLK-ONGXEEELSA-N	-1	3	330.362	1.043	20	5		EDBDHM
COC(=O)C[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000416379348	319419513	/nfs/dbraw/zinc/41/95/13/319419513.db2.gz	WOIULDBSEFENLD-UHFFFAOYSA-N	-1	3	342.251	1.065	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H](CCO)C(C)(C)C)c([N+](=O)[O-])c1	ZINC000269675176	443390794	/nfs/dbraw/zinc/39/07/94/443390794.db2.gz	FASJNUDTUUIPRV-ZDUSSCGKSA-N	-1	3	346.405	1.679	20	5		EDBDHM
C[C@H]1CN(CCCNC(=O)c2ccc([O-])c([N+](=O)[O-])c2)CCCO1	ZINC000278767650	443431156	/nfs/dbraw/zinc/43/11/56/443431156.db2.gz	XQNTWMLYYUJHSY-LBPRGKRZSA-N	-1	3	337.376	1.531	20	5		EDBDHM
COc1ccncc1C[N-]S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000431588359	319943490	/nfs/dbraw/zinc/94/34/90/319943490.db2.gz	FLIHELUTALBYLB-UHFFFAOYSA-N	-1	3	337.357	1.785	20	5		EDBDHM
CN(C)[C@@]1(CNC(=O)c2cc([N+](=O)[O-])ccc2[O-])CCSC1	ZINC000436967262	320029033	/nfs/dbraw/zinc/02/90/33/320029033.db2.gz	QAROZLDUDUDSTB-CQSZACIVSA-N	-1	3	325.390	1.468	20	5		EDBDHM
C[C@]1(c2ccc(NC(=O)c3cc([N+](=O)[O-])c[nH]3)cc2)NC(=O)[N-]C1=O	ZINC000516503119	320436889	/nfs/dbraw/zinc/43/68/89/320436889.db2.gz	RTEOZBCDYOYONG-OAHLLOKOSA-N	-1	3	343.299	1.230	20	5		EDBDHM
CCOC[C@@H]([N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC)C(C)C	ZINC000276793706	443829482	/nfs/dbraw/zinc/82/94/82/443829482.db2.gz	YHHPTBMDJHRDJM-GFCCVEGCSA-N	-1	3	346.405	1.943	20	5		EDBDHM
CCC(=O)c1ccc(N2CCC[C@@]3(C2)NC(=O)[N-]C3=O)c([N+](=O)[O-])c1	ZINC000281377835	443893583	/nfs/dbraw/zinc/89/35/83/443893583.db2.gz	FFXXPLZORJUPPP-INIZCTEOSA-N	-1	3	346.343	1.366	20	5		EDBDHM
C[C@H]([N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C(=O)NCCF	ZINC000282005106	444060196	/nfs/dbraw/zinc/06/01/96/444060196.db2.gz	MJIUQNQCSPKWEC-QMMMGPOBSA-N	-1	3	333.266	1.277	20	5		EDBDHM
O=c1[n-]cnc2c1CCN(c1ncnc3sc([N+](=O)[O-])cc31)C2	ZINC000576419536	321564958	/nfs/dbraw/zinc/56/49/58/321564958.db2.gz	NMWJFMKKNKVASR-UHFFFAOYSA-N	-1	3	330.329	1.658	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@](C)(O)C(C)C	ZINC000319815017	444325917	/nfs/dbraw/zinc/32/59/17/444325917.db2.gz	DSNVAVLDLSOEGS-ZDUSSCGKSA-N	-1	3	332.378	1.289	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]CC2(CCO)CC2)c([N+](=O)[O-])c1	ZINC000318320323	444319063	/nfs/dbraw/zinc/31/90/63/444319063.db2.gz	PUAUGITVIYNGNB-UHFFFAOYSA-N	-1	3	330.362	1.044	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000312670006	444295075	/nfs/dbraw/zinc/29/50/75/444295075.db2.gz	IIRFLAQKHFQHGA-MWLCHTKSSA-N	-1	3	330.362	1.043	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@@H](C)C1CC1	ZINC000322498022	444340002	/nfs/dbraw/zinc/34/00/02/444340002.db2.gz	BTCPULYRPJXPOP-SECBINFHSA-N	-1	3	342.373	1.706	20	5		EDBDHM
Cc1cc(C(=O)Nc2[n-]nnc2C(=O)NC2CC2)cc([N+](=O)[O-])c1	ZINC000297748480	444328320	/nfs/dbraw/zinc/32/83/20/444328320.db2.gz	NZBCITNAADIXHU-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
Cc1cc(C(=O)Nc2nn[n-]c2C(=O)NC2CC2)cc([N+](=O)[O-])c1	ZINC000297748480	444328322	/nfs/dbraw/zinc/32/83/22/444328322.db2.gz	NZBCITNAADIXHU-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
Cc1cc(C(=O)Nc2n[n-]nc2C(=O)NC2CC2)cc([N+](=O)[O-])c1	ZINC000297748480	444328323	/nfs/dbraw/zinc/32/83/23/444328323.db2.gz	NZBCITNAADIXHU-UHFFFAOYSA-N	-1	3	330.304	1.166	20	5		EDBDHM
CCC(CC)([N-]S(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)OC	ZINC000337958585	444471188	/nfs/dbraw/zinc/47/11/88/444471188.db2.gz	HTFJYUKWCJLFRP-UHFFFAOYSA-N	-1	3	330.362	1.605	20	5		EDBDHM
CCN1CCN([C@@H](C)CNc2ncc(C(=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000580716456	322087041	/nfs/dbraw/zinc/08/70/41/322087041.db2.gz	IFCILGFLLYEFHD-NSHDSACASA-N	-1	3	337.380	1.126	20	5		EDBDHM
COc1ccc(CNC(=O)Cc2c(C)nc(C)[n-]c2=O)cc1[N+](=O)[O-]	ZINC000342184260	444553669	/nfs/dbraw/zinc/55/36/69/444553669.db2.gz	ZATNJFXHDGOFLZ-UHFFFAOYSA-N	-1	3	346.343	1.575	20	5		EDBDHM
Cc1sc(S(=O)(=O)[N-][C@@H]2CCCN(C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000342500844	444718528	/nfs/dbraw/zinc/71/85/28/444718528.db2.gz	DEGIFRVCLNUMFO-PSASIEDQSA-N	-1	3	333.435	1.726	20	5		EDBDHM
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-][C@@]1(C)CCO[C@H]1C	ZINC000344124456	444794581	/nfs/dbraw/zinc/79/45/81/444794581.db2.gz	WXKJGMHCXVWQEE-ZANVPECISA-N	-1	3	330.362	1.449	20	5		EDBDHM
C[C@@H](NC(=O)c1cc(=O)[n-]c(N(C)C)n1)c1ccccc1[N+](=O)[O-]	ZINC000338819374	444869125	/nfs/dbraw/zinc/86/91/25/444869125.db2.gz	XNZUUVSSKLTGDK-SECBINFHSA-N	-1	3	331.332	1.647	20	5		EDBDHM
CC1([N-]S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CCC1	ZINC000339045398	445005950	/nfs/dbraw/zinc/00/59/50/445005950.db2.gz	BGNWQPOTLNYAIV-UHFFFAOYSA-N	-1	3	328.346	1.587	20	5		EDBDHM
CC[C@](C)([N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C(=O)OC	ZINC000343470375	445228922	/nfs/dbraw/zinc/22/89/22/445228922.db2.gz	SCIOLPFRNVADPM-NSHDSACASA-N	-1	3	336.391	1.585	20	5		EDBDHM
CO[C@@H]1C[C@@H](CN2CCCC2)N(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C1	ZINC000347893860	445254684	/nfs/dbraw/zinc/25/46/84/445254684.db2.gz	CGRZQMDMSNDJJF-UONOGXRCSA-N	-1	3	349.387	1.626	20	5		EDBDHM
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]Cc1ncccc1O	ZINC000360022780	445533016	/nfs/dbraw/zinc/53/30/16/445533016.db2.gz	IUZINDJZQHJWPC-UHFFFAOYSA-N	-1	3	343.748	1.827	20	5		EDBDHM
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]Cc2ccnc(C)n2)c1C	ZINC000360181491	445615347	/nfs/dbraw/zinc/61/53/47/445615347.db2.gz	QURXFTKPLFDLJF-UHFFFAOYSA-N	-1	3	336.373	1.789	20	5		EDBDHM
O=[N+]([O-])c1ccc(-c2noc([N-][C@H](CO)C3CCOCC3)n2)cc1	ZINC000360272394	445669603	/nfs/dbraw/zinc/66/96/03/445669603.db2.gz	BXUWNQMGWRWIQN-CYBMUJFWSA-N	-1	3	334.332	1.844	20	5		EDBDHM
CC[C@@]1([N-]S(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)CCOC1	ZINC000616460688	450428968	/nfs/dbraw/zinc/42/89/68/450428968.db2.gz	HMBSXHMRIDJBCG-CYBMUJFWSA-N	-1	3	348.352	1.590	20	5		EDBDHM
O=C(Nc1nnc(-c2ccccn2)s1)c1c[n-]c(=O)c([N+](=O)[O-])c1	ZINC000361917931	446065565	/nfs/dbraw/zinc/06/55/65/446065565.db2.gz	BUVQEGGNLGKXLR-UHFFFAOYSA-N	-1	3	344.312	1.861	20	5		EDBDHM
C/C=C\C[C@@H](CO)[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000351569116	446167175	/nfs/dbraw/zinc/16/71/75/446167175.db2.gz	SVTKVUBLKQARCG-XOULXFPDSA-N	-1	3	330.362	1.209	20	5		EDBDHM
O=C(NC1CCN([C@@H]2CCOC2)CC1)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000373464405	446226400	/nfs/dbraw/zinc/22/64/00/446226400.db2.gz	FKBITCCXMIMWEO-CYBMUJFWSA-N	-1	3	335.360	1.284	20	5		EDBDHM
COc1nnc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)[n-]1	ZINC000359571731	446298375	/nfs/dbraw/zinc/29/83/75/446298375.db2.gz	OHVZVOWEMVAEAG-UHFFFAOYSA-N	-1	3	329.219	1.575	20	5		EDBDHM
COc1nc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)n[n-]1	ZINC000359571731	446298377	/nfs/dbraw/zinc/29/83/77/446298377.db2.gz	OHVZVOWEMVAEAG-UHFFFAOYSA-N	-1	3	329.219	1.575	20	5		EDBDHM
COc1n[n-]c(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)n1	ZINC000359571731	446298379	/nfs/dbraw/zinc/29/83/79/446298379.db2.gz	OHVZVOWEMVAEAG-UHFFFAOYSA-N	-1	3	329.219	1.575	20	5		EDBDHM
COC(=O)c1cc(OCC(=O)[N-]c2cc(C)no2)ccc1[N+](=O)[O-]	ZINC000446063485	447225854	/nfs/dbraw/zinc/22/58/54/447225854.db2.gz	VEPYOSAVBHRXOR-UHFFFAOYSA-N	-1	3	335.272	1.695	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2nnn[n-]2)cc1	ZINC000369009548	447260426	/nfs/dbraw/zinc/26/04/26/447260426.db2.gz	BTIVSIQJPZYSLX-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2nn[n-]n2)cc1	ZINC000369009548	447260431	/nfs/dbraw/zinc/26/04/31/447260431.db2.gz	BTIVSIQJPZYSLX-UHFFFAOYSA-N	-1	3	325.288	1.731	20	5		EDBDHM
Cc1cnc(CC[N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cn1	ZINC000416499248	447626833	/nfs/dbraw/zinc/62/68/33/447626833.db2.gz	AZDZLYKCVSHJIN-UHFFFAOYSA-N	-1	3	336.373	1.523	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@@H]1[C@@H]2CCC[C@@H]21	ZINC000486849704	447825828	/nfs/dbraw/zinc/82/58/28/447825828.db2.gz	JLEDNFBGQKUOCB-DDFAGTSDSA-N	-1	3	340.357	1.458	20	5		EDBDHM
Cc1[n-][nH]c(=O)c1CCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2	ZINC000523695370	447901846	/nfs/dbraw/zinc/90/18/46/447901846.db2.gz	YOGUKHLSLBPVTR-JTQLQIEISA-N	-1	3	331.332	1.403	20	5		EDBDHM
COC[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)C(C)C	ZINC000525188400	447975697	/nfs/dbraw/zinc/97/56/97/447975697.db2.gz	AEACJBVVBISGLF-NSHDSACASA-N	-1	3	332.378	1.553	20	5		EDBDHM
COC[C@]1(C(=O)[O-])CCCN(Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000577618545	448344033	/nfs/dbraw/zinc/34/40/33/448344033.db2.gz	KDJOLMAXKBAVFD-INIZCTEOSA-N	-1	3	338.360	1.917	20	5		EDBDHM
C[C@H](CN1CCC(C)CC1)[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000574171050	448810016	/nfs/dbraw/zinc/81/00/16/448810016.db2.gz	SMGHAQYZZRVHPX-GFCCVEGCSA-N	-1	3	342.421	1.389	20	5		EDBDHM
CC(C)(C)N1CC[C@@H]([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])C1=O	ZINC000574273286	448832859	/nfs/dbraw/zinc/83/28/59/448832859.db2.gz	MERCCXQDPDIKBL-SNVBAGLBSA-N	-1	3	341.389	1.273	20	5		EDBDHM
O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCCCc1cc(=O)[nH][n-]1	ZINC000588875829	448944213	/nfs/dbraw/zinc/94/42/13/448944213.db2.gz	IAYMCEXMWAZYHX-UHFFFAOYSA-N	-1	3	347.375	1.559	20	5		EDBDHM
CC(C)[C@H]1C[C@H]([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cn2)CCO1	ZINC000593573087	449081576	/nfs/dbraw/zinc/08/15/76/449081576.db2.gz	VMAPPSZDMHVOCJ-ZYHUDNBSSA-N	-1	3	329.378	1.472	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@H](C)COCC1CC1	ZINC000593654877	449132249	/nfs/dbraw/zinc/13/22/49/449132249.db2.gz	XPQSRYHYLLMFHI-SNVBAGLBSA-N	-1	3	344.389	1.697	20	5		EDBDHM
CC[C@H](CO)N1CCN(c2cc(C)c([N+](=O)[O-])c(C(=O)[O-])c2)CC1	ZINC000592976887	449091983	/nfs/dbraw/zinc/09/19/83/449091983.db2.gz	GCBKYYCESHWHJV-GFCCVEGCSA-N	-1	3	337.376	1.494	20	5		EDBDHM
Cc1cccnc1CCC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593601234	449100954	/nfs/dbraw/zinc/10/09/54/449100954.db2.gz	MMDUKSJQESGTGN-UHFFFAOYSA-N	-1	3	336.373	1.604	20	5		EDBDHM
Cc1ncsc1CC[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593601754	449101297	/nfs/dbraw/zinc/10/12/97/449101297.db2.gz	PLDFHKGFRSBZKC-UHFFFAOYSA-N	-1	3	328.375	1.276	20	5		EDBDHM
CC[C@@H]([N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1OC)C(C)(C)O	ZINC000590169910	449114072	/nfs/dbraw/zinc/11/40/72/449114072.db2.gz	BWVFGBCUQSHFKJ-LLVKDONJSA-N	-1	3	332.378	1.431	20	5		EDBDHM
Cn1[n-]c([C@H]2CCCN2C(=O)Cc2ccc(F)cc2[N+](=O)[O-])nc1=N	ZINC000593679190	449144349	/nfs/dbraw/zinc/14/43/49/449144349.db2.gz	JKADNWOGPRBYHT-LLVKDONJSA-N	-1	3	348.338	1.181	20	5		EDBDHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]CC(=O)NC1CCCC1	ZINC000604502868	449238813	/nfs/dbraw/zinc/23/88/13/449238813.db2.gz	VUCZRGICHJAMSU-UHFFFAOYSA-N	-1	3	341.389	1.240	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)N1CCCC[C@H]1C	ZINC000593528561	449326291	/nfs/dbraw/zinc/32/62/91/449326291.db2.gz	NHMFPTKRGQNRCR-NEPJUHHUSA-N	-1	3	342.421	1.531	20	5		EDBDHM
C[C@H](c1cccnc1)N1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1	ZINC000596128409	449378201	/nfs/dbraw/zinc/37/82/01/449378201.db2.gz	HDVJCRFXESIPSJ-GFCCVEGCSA-N	-1	3	329.360	1.974	20	5		EDBDHM
C[C@@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)N1CCC[C@@H](C)C1	ZINC000593532125	449329051	/nfs/dbraw/zinc/32/90/51/449329051.db2.gz	WSTZWGOCWHXTGP-NEPJUHHUSA-N	-1	3	342.421	1.389	20	5		EDBDHM
COc1ccc(C[C@@H](CO)CNc2cc[n-]c(=O)c2[N+](=O)[O-])cc1O	ZINC000596143893	449383589	/nfs/dbraw/zinc/38/35/89/449383589.db2.gz	CFOBBSXAVHUUSI-LLVKDONJSA-N	-1	3	349.343	1.673	20	5		EDBDHM
O=c1[n-]ccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000596248868	449438191	/nfs/dbraw/zinc/43/81/91/449438191.db2.gz	MJTREZORXVMITA-LRDDRELGSA-N	-1	3	333.319	2.000	20	5		EDBDHM
Cn1[n-]c([C@@H]2CCCN2c2nc3cc([N+](=O)[O-])ccc3[nH]2)nc1=N	ZINC000596252019	449439598	/nfs/dbraw/zinc/43/95/98/449439598.db2.gz	DAEAFKATIILCFQ-NSHDSACASA-N	-1	3	328.336	1.354	20	5		EDBDHM
COC[C@H](CC(C)(C)C)[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000594477788	449542474	/nfs/dbraw/zinc/54/24/74/449542474.db2.gz	ARVQXRWHEFASOW-JTQLQIEISA-N	-1	3	331.394	1.719	20	5		EDBDHM
C[C@H](C[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(=O)OC(C)(C)C	ZINC000594477665	449542820	/nfs/dbraw/zinc/54/28/20/449542820.db2.gz	IHWOLZVPZCYHQJ-SECBINFHSA-N	-1	3	345.377	1.246	20	5		EDBDHM
CC1CCN(CC[N-]S(=O)(=O)c2ncccc2[N+](=O)[O-])CC1	ZINC000594749611	449665590	/nfs/dbraw/zinc/66/55/90/449665590.db2.gz	VPWGIXDAMAKOGX-UHFFFAOYSA-N	-1	3	328.394	1.000	20	5		EDBDHM
CC(C)[C@H](O)C[N-]S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000594760206	449674161	/nfs/dbraw/zinc/67/41/61/449674161.db2.gz	SBRXPXISLDKHDZ-GFCCVEGCSA-N	-1	3	339.373	1.438	20	5		EDBDHM
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@]12C[C@H]1CCC2	ZINC000594804894	449717839	/nfs/dbraw/zinc/71/78/39/449717839.db2.gz	RAAGJPSABHSWRA-YMTOWFKASA-N	-1	3	340.357	1.602	20	5		EDBDHM
COc1ccc(S(=O)(=O)[N-]C[C@@H]2CCC[C@H](C)O2)c([N+](=O)[O-])c1	ZINC000594852244	449760007	/nfs/dbraw/zinc/76/00/07/449760007.db2.gz	PHMXSGINZHHWII-JQWIXIFHSA-N	-1	3	344.389	1.839	20	5		EDBDHM
Cc1cc(S(=O)(=O)[N-][C@H]2CN(C3CC3)C[C@@H]2C)c([N+](=O)[O-])s1	ZINC000601370370	449885198	/nfs/dbraw/zinc/88/51/98/449885198.db2.gz	XTZDJXDBCIOFGG-KWQFWETISA-N	-1	3	345.446	1.726	20	5		EDBDHM
Cc1cc([N+](=O)[O-])c(S(=O)(=O)[N-][C@@H]2C(=O)NCC2(C)C)cc1C	ZINC000595355626	450070732	/nfs/dbraw/zinc/07/07/32/450070732.db2.gz	VZTDRYRRLWCCRC-GFCCVEGCSA-N	-1	3	341.389	1.015	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]C[C@H]1CCOC1(C)C	ZINC000595393304	450106107	/nfs/dbraw/zinc/10/61/07/450106107.db2.gz	UQZUQGCJTTZYPP-SNVBAGLBSA-N	-1	3	344.389	1.697	20	5		EDBDHM
CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000597695085	450202594	/nfs/dbraw/zinc/20/25/94/450202594.db2.gz	PWASCSRSMLGOHR-UONOGXRCSA-N	-1	3	335.360	1.236	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-]Cc1csc(C)n1	ZINC000619477230	450485011	/nfs/dbraw/zinc/48/50/11/450485011.db2.gz	YUZLXRNXZSFPLQ-UHFFFAOYSA-N	-1	3	343.386	1.847	20	5		EDBDHM
COc1c([N+](=O)[O-])cccc1S(=O)(=O)[N-][C@@H]1C[C@@H](OC)C1(C)C	ZINC000619490066	450488714	/nfs/dbraw/zinc/48/87/14/450488714.db2.gz	QAANAPSBKKRQIP-VXGBXAGGSA-N	-1	3	344.389	1.695	20	5		EDBDHM
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-][C@H](C)c1ccc[nH]1	ZINC000760403601	580029973	/nfs/dbraw/zinc/02/99/73/580029973.db2.gz	IDCZWUIKYPCVFH-SECBINFHSA-N	-1	3	325.346	1.971	20	5		EDBDHM
C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000736807046	579022592	/nfs/dbraw/zinc/02/25/92/579022592.db2.gz	KGLLZSJAZDGJGU-QMTHXVAHSA-N	-1	3	335.360	1.705	20	5		EDBDHM
COC(=O)C1CCC(Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1	ZINC000736908503	579030551	/nfs/dbraw/zinc/03/05/51/579030551.db2.gz	GIEGLGSBZXWTAC-UHFFFAOYSA-N	-1	3	346.347	1.919	20	5		EDBDHM
COC(=O)C1CCC(Nc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1	ZINC000736908503	579030552	/nfs/dbraw/zinc/03/05/52/579030552.db2.gz	GIEGLGSBZXWTAC-UHFFFAOYSA-N	-1	3	346.347	1.919	20	5		EDBDHM
Cc1cc(C)c(-c2nnn[n-]2)c(SCCn2cc([N+](=O)[O-])cn2)n1	ZINC000737242573	579059277	/nfs/dbraw/zinc/05/92/77/579059277.db2.gz	XAIKVXORHQZVDZ-UHFFFAOYSA-N	-1	3	346.376	1.776	20	5		EDBDHM
Cc1cc(C)c(-c2nn[n-]n2)c(SCCn2cc([N+](=O)[O-])cn2)n1	ZINC000737242573	579059278	/nfs/dbraw/zinc/05/92/78/579059278.db2.gz	XAIKVXORHQZVDZ-UHFFFAOYSA-N	-1	3	346.376	1.776	20	5		EDBDHM
Cc1cnn(C2CN(c3ccc(-c4nnn[n-]4)cc3[N+](=O)[O-])C2)c1	ZINC000737441714	579091536	/nfs/dbraw/zinc/09/15/36/579091536.db2.gz	AIEAGCCPZMXYBB-UHFFFAOYSA-N	-1	3	326.320	1.341	20	5		EDBDHM
Cc1cnn(C2CN(c3ccc(-c4nn[n-]n4)cc3[N+](=O)[O-])C2)c1	ZINC000737441714	579091538	/nfs/dbraw/zinc/09/15/38/579091538.db2.gz	AIEAGCCPZMXYBB-UHFFFAOYSA-N	-1	3	326.320	1.341	20	5		EDBDHM
Cc1cc(Cl)c(S(=O)(=O)[N-][C@@H](CO)CC2CC2)cc1[N+](=O)[O-]	ZINC000754821005	579913591	/nfs/dbraw/zinc/91/35/91/579913591.db2.gz	ZPHWLRLDGWNTTN-SNVBAGLBSA-N	-1	3	348.808	1.996	20	5		EDBDHM
CCSc1ccc([N+](=O)[O-])cc1C(=O)[N-]N1CC(=O)N(C)C1=O	ZINC000776246106	580412637	/nfs/dbraw/zinc/41/26/37/580412637.db2.gz	OUJOCZSYCTWBOR-UHFFFAOYSA-N	-1	3	338.345	1.246	20	5		EDBDHM
CCOC(=O)c1ncc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)[n-]1	ZINC000788175220	580713359	/nfs/dbraw/zinc/71/33/59/580713359.db2.gz	HOVFUYQPZZSYSJ-UHFFFAOYSA-N	-1	3	333.304	1.638	20	5		EDBDHM
CCOC(=O)c1nc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)c[n-]1	ZINC000788175220	580713360	/nfs/dbraw/zinc/71/33/60/580713360.db2.gz	HOVFUYQPZZSYSJ-UHFFFAOYSA-N	-1	3	333.304	1.638	20	5		EDBDHM
O=C1[N-]C(=O)[C@@]2(CCCN(c3nc4ccc([N+](=O)[O-])cc4s3)C2)N1	ZINC000788579349	580724997	/nfs/dbraw/zinc/72/49/97/580724997.db2.gz	YLWCYEJKQWRVLP-AWEZNQCLSA-N	-1	3	347.356	1.383	20	5		EDBDHM
O=c1[n-]ccc(N2CCn3c(cnc3C(F)(F)F)C2)c1[N+](=O)[O-]	ZINC000896205911	591384321	/nfs/dbraw/zinc/38/43/21/591384321.db2.gz	KZDDCAILSAULPU-UHFFFAOYSA-N	-1	3	329.238	1.931	20	5		EDBDHM
Cc1sc2ncn([N-]C(=O)c3cc([N+](=O)[O-])cn3C)c(=O)c2c1C	ZINC000022380401	591884750	/nfs/dbraw/zinc/88/47/50/591884750.db2.gz	FHQPWPIMXOUTRT-UHFFFAOYSA-N	-1	3	347.356	1.705	20	5		EDBDHM
CCN1CC[C@H]2OCCN(c3cc(C)c([N+](=O)[O-])c(C(=O)[O-])c3)[C@H]2C1	ZINC000910384530	592856562	/nfs/dbraw/zinc/85/65/62/592856562.db2.gz	PTVJWQUWACAATE-LSDHHAIUSA-N	-1	3	349.387	1.901	20	5		EDBDHM
COc1cc(COC(=O)c2cnn[n-]2)c([N+](=O)[O-])cc1OC(F)F	ZINC000805610091	593113732	/nfs/dbraw/zinc/11/37/32/593113732.db2.gz	WZZYKZMMLCIMBA-UHFFFAOYSA-N	-1	3	344.230	1.680	20	5		EDBDHM
COc1cc(COC(=O)c2c[n-]nn2)c([N+](=O)[O-])cc1OC(F)F	ZINC000805610091	593113734	/nfs/dbraw/zinc/11/37/34/593113734.db2.gz	WZZYKZMMLCIMBA-UHFFFAOYSA-N	-1	3	344.230	1.680	20	5		EDBDHM