smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(OCCN2CCC[C@H](n3cncn3)C2)c([N+](=O)[O-])c1	ZINC000173652037	441814202	/nfs/dbraw/zinc/81/42/02/441814202.db2.gz	OVJDUMAQRRVIJR-ZDUSSCGKSA-N	0	1	347.375	1.911	10	5		EDBEMN
Cc1cc(N2CCC[C@H](NCc3ccc([N+](=O)[O-])cc3)C2=O)n(C)n1	ZINC000173850660	441850429	/nfs/dbraw/zinc/85/04/29/441850429.db2.gz	HJLZEIJNTFVERU-HNNXBMFYSA-N	0	1	343.387	1.922	10	5		EDBEMN
CCc1ccc(C(=O)N2CCO[C@@H](c3n[nH]c(C)n3)C2)cc1[N+](=O)[O-]	ZINC000174341631	441913958	/nfs/dbraw/zinc/91/39/58/441913958.db2.gz	DRVOOZXVGQOQND-CQSZACIVSA-N	0	1	345.359	1.797	10	5		EDBEMN
O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCC[C@H](n3cncn3)C2)c1	ZINC000171617991	442362969	/nfs/dbraw/zinc/36/29/69/442362969.db2.gz	LZFHJGJTYMZTFM-LSDHHAIUSA-N	0	1	347.375	1.263	10	5		EDBEMN
O=c1ccc([N+](=O)[O-])cn1CCN1CC[C@H](Oc2cccnc2)C1	ZINC000090552744	138279529	/nfs/dbraw/zinc/27/95/29/138279529.db2.gz	VITLGVLCLKDSMA-HNNXBMFYSA-N	0	1	330.344	1.305	10	5		EDBEMN
O=C(Nc1ccc(Br)cc1[N+](=O)[O-])[C@H]1CNCCO1	ZINC000043709068	204287808	/nfs/dbraw/zinc/28/78/08/204287808.db2.gz	BGRZDKLYPKHKDS-SNVBAGLBSA-N	0	1	330.138	1.284	10	5		EDBEMN
CC[C@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])CCN1C[C@H](C)O	ZINC000246853042	281133500	/nfs/dbraw/zinc/13/35/00/281133500.db2.gz	NCKAXSWFHXOVIS-ZFWWWQNUSA-N	0	1	335.404	1.441	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000173529295	441779836	/nfs/dbraw/zinc/77/98/36/441779836.db2.gz	KCIYUBGCETYOAM-ZDUSSCGKSA-N	0	1	331.332	1.164	10	5		EDBEMN
CN(C)[C@H]1CCCN(c2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)C1	ZINC000124522092	441933661	/nfs/dbraw/zinc/93/36/61/441933661.db2.gz	SDYHZVJRSQNDCW-LBPRGKRZSA-N	0	1	327.406	1.529	10	5		EDBEMN
CN(C[C@H]1CCCN(C)C1)c1ccc([N+](=O)[O-])c(S(C)(=O)=O)c1	ZINC000125203063	441996522	/nfs/dbraw/zinc/99/65/22/441996522.db2.gz	ZJEWKFCAEGXTBA-LBPRGKRZSA-N	0	1	341.433	1.776	10	5		EDBEMN
C[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000113306177	274374438	/nfs/dbraw/zinc/37/44/38/274374438.db2.gz	SPZFWMQDDLAJIS-DGCLKSJQSA-N	0	1	325.390	1.452	10	5		EDBEMN
Cc1nc(C[C@H]2CCCN(CCn3cc([N+](=O)[O-])ccc3=O)C2)no1	ZINC000090525863	441632616	/nfs/dbraw/zinc/63/26/16/441632616.db2.gz	KHJACFZBABUQFQ-CYBMUJFWSA-N	0	1	347.375	1.403	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CCO2)n[nH]1	ZINC000153732137	442298929	/nfs/dbraw/zinc/29/89/29/442298929.db2.gz	PGXQGDHWYWWYSE-ZDUSSCGKSA-N	0	1	346.347	1.935	10	5		EDBEMN
CC[C@H](O)CN1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000193923751	442813220	/nfs/dbraw/zinc/81/32/20/442813220.db2.gz	ZZOOCUVPTUSYRC-AWEZNQCLSA-N	0	1	338.364	1.392	10	5		EDBEMN
CC[C@@H]1CN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC[N@@H+]1CCOC	ZINC000160442159	206297525	/nfs/dbraw/zinc/29/75/25/206297525.db2.gz	KTWQGGVHSZBXML-CYBMUJFWSA-N	0	1	337.376	1.483	10	5		EDBEMN
CC[C@@H]1CN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC[N@H+]1CCOC	ZINC000160442159	206297528	/nfs/dbraw/zinc/29/75/28/206297528.db2.gz	KTWQGGVHSZBXML-CYBMUJFWSA-N	0	1	337.376	1.483	10	5		EDBEMN
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCN2CCC[C@H]2C1	ZINC000247368699	139146094	/nfs/dbraw/zinc/14/60/94/139146094.db2.gz	DRHPCOWJKSOXBM-ZDUSSCGKSA-N	0	1	325.390	1.372	10	5		EDBEMN
CCOCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C[C@@H]1C	ZINC000117424331	221061751	/nfs/dbraw/zinc/06/17/51/221061751.db2.gz	SKGDBFXCYMMZNZ-LBPRGKRZSA-N	0	1	337.376	1.483	10	5		EDBEMN
CCOCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C[C@@H]1C	ZINC000117424331	221061753	/nfs/dbraw/zinc/06/17/53/221061753.db2.gz	SKGDBFXCYMMZNZ-LBPRGKRZSA-N	0	1	337.376	1.483	10	5		EDBEMN
C[C@@H](O)CN1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000120676399	442115451	/nfs/dbraw/zinc/11/54/51/442115451.db2.gz	HYESYHXSUIVXMW-ZIAGYGMSSA-N	0	1	335.404	1.441	10	5		EDBEMN
COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+]2CCCC[C@@H]2C1	ZINC000172802446	442546432	/nfs/dbraw/zinc/54/64/32/442546432.db2.gz	KJUAIUMTYCYPQM-CQSZACIVSA-N	0	1	348.403	1.712	10	5		EDBEMN
COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCN2CCCC[C@@H]2C1	ZINC000172802446	442546436	/nfs/dbraw/zinc/54/64/36/442546436.db2.gz	KJUAIUMTYCYPQM-CQSZACIVSA-N	0	1	348.403	1.712	10	5		EDBEMN
CC(C)C[C@H](CN(C)C)NS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000188220411	138834526	/nfs/dbraw/zinc/83/45/26/138834526.db2.gz	ZICROWWZYWQAMF-GFCCVEGCSA-N	0	1	329.422	1.849	10	5		EDBEMN
C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000246974711	139129235	/nfs/dbraw/zinc/12/92/35/139129235.db2.gz	DTKVCHJAAKZTGO-PWSUYJOCSA-N	0	1	343.380	1.591	10	5		EDBEMN
CCN1CCC[C@@H](NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)C1	ZINC000194631970	273004412	/nfs/dbraw/zinc/00/44/12/273004412.db2.gz	PPBSSYWKRNZYHE-CYBMUJFWSA-N	0	1	335.360	1.596	10	5		EDBEMN
Cc1ccc(S(=O)(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000173886996	441856451	/nfs/dbraw/zinc/85/64/51/441856451.db2.gz	NWUPEMZXRLOVKH-GXTWGEPZSA-N	0	1	341.433	1.910	10	5		EDBEMN
Cc1nc([C@H]2CN(C(=O)c3ccc(F)cc3[N+](=O)[O-])CCO2)n[nH]1	ZINC000134427720	442481414	/nfs/dbraw/zinc/48/14/14/442481414.db2.gz	KHHBIFDQHNLDNO-GFCCVEGCSA-N	0	1	335.295	1.374	10	5		EDBEMN
Cc1nc([C@H]2CN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CCO2)n[nH]1	ZINC000194042187	442835850	/nfs/dbraw/zinc/83/58/50/442835850.db2.gz	CGQGQWFRLWOFNT-CYBMUJFWSA-N	0	1	348.319	1.503	10	5		EDBEMN
CCN1CCC[C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000194153586	442852716	/nfs/dbraw/zinc/85/27/16/442852716.db2.gz	YKGHSBSZQVZCER-GFCCVEGCSA-N	0	1	334.376	1.442	10	5		EDBEMN
CCOC(=O)Cc1c[nH]n(-c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1=O	ZINC000536952054	448549102	/nfs/dbraw/zinc/54/91/02/448549102.db2.gz	AFMKKRDEQMSRIU-UHFFFAOYSA-N	0	1	336.260	1.088	10	5		EDBEMN
Cc1cc(Br)c(NC(=O)c2nonc2N)cc1[N+](=O)[O-]	ZINC000169221909	226236010	/nfs/dbraw/zinc/23/60/10/226236010.db2.gz	MQVNHHVURYHBMG-UHFFFAOYSA-N	0	1	342.109	1.883	10	5		EDBEMN
CCN1CCC[C@@H](NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)C1	ZINC000067138769	441609615	/nfs/dbraw/zinc/60/96/15/441609615.db2.gz	OGJAJTFLGVHRFG-GFCCVEGCSA-N	0	1	344.375	1.390	10	5		EDBEMN
CCc1nc([C@@H]2CN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000173564572	441794135	/nfs/dbraw/zinc/79/41/35/441794135.db2.gz	WZKMVUMVDMFPPT-ZDUSSCGKSA-N	0	1	345.359	1.797	10	5		EDBEMN
CCN1CCC[C@H](Nc2cc([N+](=O)[O-])ccc2S(N)(=O)=O)C1	ZINC000181439756	442697718	/nfs/dbraw/zinc/69/77/18/442697718.db2.gz	NGIAJLNOIPXIIY-JTQLQIEISA-N	0	1	328.394	1.138	10	5		EDBEMN
CN(C)C(=O)NCCNCc1cc(Br)ccc1[N+](=O)[O-]	ZINC000160748771	202025000	/nfs/dbraw/zinc/02/50/00/202025000.db2.gz	HUFCBXRWWWLECP-UHFFFAOYSA-N	0	1	345.197	1.718	10	5		EDBEMN
C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000249212533	139189313	/nfs/dbraw/zinc/18/93/13/139189313.db2.gz	SPWCMEFUBZZOBW-FZMZJTMJSA-N	0	1	332.360	1.228	10	5		EDBEMN
CN(C)[C@H](Cc1ccccc1)C(=O)NCCn1cc([N+](=O)[O-])cn1	ZINC000164487398	442197445	/nfs/dbraw/zinc/19/74/45/442197445.db2.gz	MDTORIBPWCLWEP-OAHLLOKOSA-N	0	1	331.376	1.080	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000176939073	442276002	/nfs/dbraw/zinc/27/60/02/442276002.db2.gz	GLCRTHQBICUAPS-ZDUSSCGKSA-N	0	1	346.347	1.935	10	5		EDBEMN
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC[C@H](n2cncn2)C1	ZINC000171579704	442358777	/nfs/dbraw/zinc/35/87/77/442358777.db2.gz	VKTOIJLPBRICDR-NSHDSACASA-N	0	1	341.331	1.540	10	5		EDBEMN
CC(C)C[C@H](CN(C)C)NS(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000180880190	528502862	/nfs/dbraw/zinc/50/28/62/528502862.db2.gz	RXRAOQLBLLFKBM-LLVKDONJSA-N	0	1	347.412	1.989	10	5		EDBEMN
CCCc1[nH]nc(C(=O)N2CCO[C@H](Cn3cccn3)C2)c1[N+](=O)[O-]	ZINC000111649713	204367201	/nfs/dbraw/zinc/36/72/01/204367201.db2.gz	QPHGDSYUKTXNGE-NSHDSACASA-N	0	1	348.363	1.008	10	5		EDBEMN
CC[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C[C@H](C)O	ZINC000247524432	442860014	/nfs/dbraw/zinc/86/00/14/442860014.db2.gz	NRNFXZONCRMBQJ-JSGCOSHPSA-N	0	1	336.392	1.904	10	5		EDBEMN
Cc1cc(N2CCC[C@@H](NCc3ccc([N+](=O)[O-])cc3)C2=O)n(C)n1	ZINC000173850676	231050943	/nfs/dbraw/zinc/05/09/43/231050943.db2.gz	HJLZEIJNTFVERU-OAHLLOKOSA-N	0	1	343.387	1.922	10	5		EDBEMN
C[NH+]1CCN(Nc2ncnc([N-]c3nccs3)c2[N+](=O)[O-])CC1	ZINC000040623532	213359034	/nfs/dbraw/zinc/35/90/34/213359034.db2.gz	HIPCFRNZXSRYBZ-UHFFFAOYSA-N	0	1	336.381	1.159	10	5		EDBEMN
O=C1NC(=O)c2cc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3)ccc21	ZINC000019815275	212072028	/nfs/dbraw/zinc/07/20/28/212072028.db2.gz	RNOCZTFZCRXCMR-UHFFFAOYSA-N	0	1	347.308	1.279	10	5		EDBEMN
CC[C@@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])CCN1C[C@H](C)O	ZINC000246853021	139124158	/nfs/dbraw/zinc/12/41/58/139124158.db2.gz	NCKAXSWFHXOVIS-DZGCQCFKSA-N	0	1	335.404	1.441	10	5		EDBEMN
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN2CCC[C@@H]2C1	ZINC000171770923	227273865	/nfs/dbraw/zinc/27/38/65/227273865.db2.gz	LKPPBNVGWGFPEF-GFCCVEGCSA-N	0	1	341.389	1.072	10	5		EDBEMN
CCc1nc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3C)CCO2)n[nH]1	ZINC000173554087	441788831	/nfs/dbraw/zinc/78/88/31/441788831.db2.gz	SZQYRJZTFHBZEI-ZDUSSCGKSA-N	0	1	345.359	1.797	10	5		EDBEMN
CCc1nc([C@@H]2CN(C(=O)c3csc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000173566435	441793931	/nfs/dbraw/zinc/79/39/31/441793931.db2.gz	YDJKJQXWJSHFIQ-VIFPVBQESA-N	0	1	337.361	1.551	10	5		EDBEMN
CC(C)N1C[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000173882516	441855498	/nfs/dbraw/zinc/85/54/98/441855498.db2.gz	NLCYZTPUCOWNQU-FZMZJTMJSA-N	0	1	327.406	1.602	10	5		EDBEMN
CC(C)N1C[C@@H](C)[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000246912512	442821774	/nfs/dbraw/zinc/82/17/74/442821774.db2.gz	IJVJDEDWWBYBQK-VXGBXAGGSA-N	0	1	327.406	1.602	10	5		EDBEMN
Cc1ccc(C)c(S(=O)(=O)N2CCN3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000189960859	443037818	/nfs/dbraw/zinc/03/78/18/443037818.db2.gz	FTPIREHPPSMRNB-CYBMUJFWSA-N	0	1	339.417	1.680	10	5		EDBEMN
C[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000246974692	139129129	/nfs/dbraw/zinc/12/91/29/139129129.db2.gz	DTKVCHJAAKZTGO-JQWIXIFHSA-N	0	1	343.380	1.591	10	5		EDBEMN
C[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000113305196	441601474	/nfs/dbraw/zinc/60/14/74/441601474.db2.gz	DTKVCHJAAKZTGO-CMPLNLGQSA-N	0	1	343.380	1.591	10	5		EDBEMN
CCOCCN1CCN(c2c([N+](=O)[O-])c(C)nn2C)C[C@@H]1CC	ZINC000114709550	441677034	/nfs/dbraw/zinc/67/70/34/441677034.db2.gz	HIDGGLMUXPRGDF-ZDUSSCGKSA-N	0	1	325.413	1.574	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])c(C)s3)CCO2)n[nH]1	ZINC000173602132	441802352	/nfs/dbraw/zinc/80/23/52/441802352.db2.gz	AIKLDKDDVOFEJS-JTQLQIEISA-N	0	1	337.361	1.605	10	5		EDBEMN
CC(C)N1C[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H](C)C1	ZINC000173884937	529104558	/nfs/dbraw/zinc/10/45/58/529104558.db2.gz	BJLNOFWSALRLPY-GWCFXTLKSA-N	0	1	345.396	1.741	10	5		EDBEMN
COCCN1CCN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])C[C@H]1C	ZINC000184202049	532967960	/nfs/dbraw/zinc/96/79/60/532967960.db2.gz	HACQAEJCLMHARY-GFCCVEGCSA-N	0	1	341.383	1.895	10	5		EDBEMN
Cc1nc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3C)CCO2)n[nH]1	ZINC000173515099	441774885	/nfs/dbraw/zinc/77/48/85/441774885.db2.gz	WUSDDUFNUFSUAN-CYBMUJFWSA-N	0	1	331.332	1.543	10	5		EDBEMN
CCc1nc([C@@H]2CN(c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CCO2)n[nH]1	ZINC000131689076	442377906	/nfs/dbraw/zinc/37/79/06/442377906.db2.gz	RQFUYOQXQNGSAA-LBPRGKRZSA-N	0	1	348.319	1.761	10	5		EDBEMN
Cc1nc([C@H]2CN(C(=O)C=Cc3ccc([N+](=O)[O-])cc3)CCO2)n[nH]1	ZINC000255057320	443083199	/nfs/dbraw/zinc/08/31/99/443083199.db2.gz	SENMTCQZFCCNBK-HJHHMULASA-N	0	1	343.343	1.635	10	5		EDBEMN
CC[C@@H](NCc1cc(=O)n(C)c(=O)n1C)c1cccc([N+](=O)[O-])c1	ZINC000181537490	529181153	/nfs/dbraw/zinc/18/11/53/529181153.db2.gz	QCEVJCLYFPRPGG-CQSZACIVSA-N	0	1	332.360	1.233	10	5		EDBEMN
Cc1cc(S(=O)(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000246096360	139094884	/nfs/dbraw/zinc/09/48/84/139094884.db2.gz	HBSCUIKIGSMCER-TZMCWYRMSA-N	0	1	341.433	1.910	10	5		EDBEMN
Cc1cc(S(=O)(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000246096360	139094885	/nfs/dbraw/zinc/09/48/85/139094885.db2.gz	HBSCUIKIGSMCER-TZMCWYRMSA-N	0	1	341.433	1.910	10	5		EDBEMN
Cc1ccc(S(=O)(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1[N+](=O)[O-]	ZINC000247495918	139150652	/nfs/dbraw/zinc/15/06/52/139150652.db2.gz	UPQZNQCJVRFIRB-OLZOCXBDSA-N	0	1	339.417	1.760	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)C=Cc3ccc([N+](=O)[O-])cc3)CCO2)n[nH]1	ZINC000255057321	443082589	/nfs/dbraw/zinc/08/25/89/443082589.db2.gz	SENMTCQZFCCNBK-ZBKLQPJUSA-N	0	1	343.343	1.635	10	5		EDBEMN
COCCN1CCN(Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C[C@H]1C	ZINC000121198431	596301366	/nfs/dbraw/zinc/30/13/66/596301366.db2.gz	QMXFCQFVEHSKFE-CYBMUJFWSA-N	0	1	347.419	1.863	10	5		EDBEMN
COc1ccc(COC(=O)C[NH3+])c2nc3cccc(C(=O)[O-])c3nc12	ZINC000003918949	210094784	/nfs/dbraw/zinc/09/47/84/210094784.db2.gz	QYYNGHDLTPGQCH-UHFFFAOYSA-N	0	1	341.323	1.492	10	5		EDBEMN
CC(C)N1C[C@H](C)[C@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000248720649	139173044	/nfs/dbraw/zinc/17/30/44/139173044.db2.gz	HUPPXNJGOTXEJZ-SMDDNHRTSA-N	0	1	327.406	1.602	10	5		EDBEMN
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCN2CCC[C@@H]2C1	ZINC000171770758	533143772	/nfs/dbraw/zinc/14/37/72/533143772.db2.gz	GOIKMQCCURMEPG-GFCCVEGCSA-N	0	1	341.389	1.072	10	5		EDBEMN
Cc1c(Br)c(N[C@H](C)c2nn[nH]n2)ncc1[N+](=O)[O-]	ZINC000165752312	226135693	/nfs/dbraw/zinc/13/56/93/226135693.db2.gz	CRPVHVPWDAICKF-RXMQYKEDSA-N	0	1	328.130	1.747	10	5		EDBEMN
CCn1cnnc1C1CCN(CCn2cc([N+](=O)[O-])ccc2=O)CC1	ZINC000090529096	441632723	/nfs/dbraw/zinc/63/27/23/441632723.db2.gz	ZGKMOUPLZBYWDU-UHFFFAOYSA-N	0	1	346.391	1.248	10	5		EDBEMN
CC[C@H]1CN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC[N@@H+]1CCOC	ZINC000160442291	441883657	/nfs/dbraw/zinc/88/36/57/441883657.db2.gz	KTWQGGVHSZBXML-ZDUSSCGKSA-N	0	1	337.376	1.483	10	5		EDBEMN
CC[C@H]1CN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC[N@H+]1CCOC	ZINC000160442291	441883659	/nfs/dbraw/zinc/88/36/59/441883659.db2.gz	KTWQGGVHSZBXML-ZDUSSCGKSA-N	0	1	337.376	1.483	10	5		EDBEMN
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N1CCN2CCCC[C@@H]2C1	ZINC000195319502	139013971	/nfs/dbraw/zinc/01/39/71/139013971.db2.gz	MDPGGAOQVPKPRH-OAHLLOKOSA-N	0	1	346.387	1.021	10	5		EDBEMN
Cc1nc([C@@H]2CN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000246205035	139099059	/nfs/dbraw/zinc/09/90/59/139099059.db2.gz	BLVGQSOHCZVIRH-KGLIPLIRSA-N	0	1	333.348	1.128	10	5		EDBEMN
Cc1ccc(S(=O)(=O)N2CCN3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000247599996	139153082	/nfs/dbraw/zinc/15/30/82/139153082.db2.gz	UHCUWEKWUNBREW-LBPRGKRZSA-N	0	1	325.390	1.372	10	5		EDBEMN
O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CCC[C@@H](n2cncn2)C1	ZINC000248374198	139161168	/nfs/dbraw/zinc/16/11/68/139161168.db2.gz	OODXTQJXEXTECV-ZIAGYGMSSA-N	0	1	347.375	1.263	10	5		EDBEMN
CCc1nc([C@@H]2CN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000173610030	441803456	/nfs/dbraw/zinc/80/34/56/441803456.db2.gz	QPRBCONUJZWQMH-LBPRGKRZSA-N	0	1	346.347	1.071	10	5		EDBEMN
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CCN3CCC[C@@H]3C2)cc1C	ZINC000171770726	442380183	/nfs/dbraw/zinc/38/01/83/442380183.db2.gz	NNWVTFUABFNKLQ-CYBMUJFWSA-N	0	1	339.417	1.680	10	5		EDBEMN
O=C(CN1CCN2CCCC[C@H]2C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000248358046	139160584	/nfs/dbraw/zinc/16/05/84/139160584.db2.gz	QGUCOIWEKKAATQ-INIZCTEOSA-N	0	1	344.415	1.654	10	5		EDBEMN
CC[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2[O-])CC[N@@H+]1CCOC	ZINC000152228736	442185038	/nfs/dbraw/zinc/18/50/38/442185038.db2.gz	LAOZVIYVGGUXQF-GFCCVEGCSA-N	0	1	337.376	1.483	10	5		EDBEMN
CC[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2[O-])CC[N@H+]1CCOC	ZINC000152228736	442185039	/nfs/dbraw/zinc/18/50/39/442185039.db2.gz	LAOZVIYVGGUXQF-GFCCVEGCSA-N	0	1	337.376	1.483	10	5		EDBEMN
CCOCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])C[C@@H]1C	ZINC000186631005	442577648	/nfs/dbraw/zinc/57/76/48/442577648.db2.gz	GTNDGAVJRCNZIO-LBPRGKRZSA-N	0	1	337.376	1.483	10	5		EDBEMN
CCOCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])C[C@@H]1C	ZINC000186631005	442577653	/nfs/dbraw/zinc/57/76/53/442577653.db2.gz	GTNDGAVJRCNZIO-LBPRGKRZSA-N	0	1	337.376	1.483	10	5		EDBEMN
CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])CC[N@H+]1C[C@@H](C)O	ZINC000182058852	442732529	/nfs/dbraw/zinc/73/25/29/442732529.db2.gz	QOFPPEMSFKAMAX-VXGBXAGGSA-N	0	1	337.376	1.218	10	5		EDBEMN
CCN1CCC[C@@H](NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])C1	ZINC000194624460	442926908	/nfs/dbraw/zinc/92/69/08/442926908.db2.gz	NXWXURQLZBVLQO-LLVKDONJSA-N	0	1	337.376	1.826	10	5		EDBEMN
CCCc1[nH]nc(C(=O)N2CCO[C@@H](Cn3cccn3)C2)c1[N+](=O)[O-]	ZINC000111649716	220174786	/nfs/dbraw/zinc/17/47/86/220174786.db2.gz	QPHGDSYUKTXNGE-LLVKDONJSA-N	0	1	348.363	1.008	10	5		EDBEMN
CC[C@@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])CCN1CCOC	ZINC000117307471	221050158	/nfs/dbraw/zinc/05/01/58/221050158.db2.gz	CHSCRXHEKCMHKY-OAHLLOKOSA-N	0	1	335.404	1.707	10	5		EDBEMN
CC[C@@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])CCN1C[C@@H](C)O	ZINC000174597084	287136756	/nfs/dbraw/zinc/13/67/56/287136756.db2.gz	NCKAXSWFHXOVIS-UKRRQHHQSA-N	0	1	335.404	1.441	10	5		EDBEMN
C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000247474069	288314531	/nfs/dbraw/zinc/31/45/31/288314531.db2.gz	RYUKHZRNBRSELH-MNOVXSKESA-N	0	1	343.380	1.591	10	5		EDBEMN
CC[C@H](O)CN1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000177083708	442295179	/nfs/dbraw/zinc/29/51/79/442295179.db2.gz	LKWXKWFIOOTTKA-ZDUSSCGKSA-N	0	1	334.376	1.625	10	5		EDBEMN
CCOCC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])C[C@@H]1C	ZINC000182026609	442729650	/nfs/dbraw/zinc/72/96/50/442729650.db2.gz	PHSDICQEPIUQFJ-LBPRGKRZSA-N	0	1	337.376	1.483	10	5		EDBEMN
CCOCC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])C[C@@H]1C	ZINC000182026609	442729651	/nfs/dbraw/zinc/72/96/51/442729651.db2.gz	PHSDICQEPIUQFJ-LBPRGKRZSA-N	0	1	337.376	1.483	10	5		EDBEMN
CC(C)N1C[C@@H](C)[C@@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000185859228	443270023	/nfs/dbraw/zinc/27/00/23/443270023.db2.gz	HUPPXNJGOTXEJZ-RISCZKNCSA-N	0	1	327.406	1.602	10	5		EDBEMN
Cc1ccnc(Nc2[nH]cnc(=NN3CCN(C)CC3)c2[N+](=O)[O-])c1	ZINC000040588218	213355717	/nfs/dbraw/zinc/35/57/17/213355717.db2.gz	AIHGHMQXPDYTAV-UHFFFAOYSA-N	0	1	344.379	1.406	10	5		EDBEMN
CC[C@H]1CN(C(=O)Nc2ccncc2[N+](=O)[O-])CCN1C[C@H](C)O	ZINC000248396452	139161765	/nfs/dbraw/zinc/16/17/65/139161765.db2.gz	GZUSSPOKBKDAFB-RYUDHWBXSA-N	0	1	337.380	1.299	10	5		EDBEMN
C[C@H]1[NH2+]CCC[C@H]1[N-]S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000193455576	280049177	/nfs/dbraw/zinc/04/91/77/280049177.db2.gz	CDRSIHNAEBBKML-PSASIEDQSA-N	0	1	333.797	1.667	10	5		EDBEMN
Cc1cc(C)c(S(=O)(=O)N2CC[C@H](N(C)C)C2)cc1[N+](=O)[O-]	ZINC000191924533	442541542	/nfs/dbraw/zinc/54/15/42/442541542.db2.gz	GMNDIHPWDAPNID-LBPRGKRZSA-N	0	1	327.406	1.536	10	5		EDBEMN
COc1cc(OCC(=O)N2CCN3CCCC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000195050934	139005663	/nfs/dbraw/zinc/00/56/63/139005663.db2.gz	YSVOLZSJUQEONE-ZDUSSCGKSA-N	0	1	349.387	1.679	10	5		EDBEMN
O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000248047652	139157778	/nfs/dbraw/zinc/15/77/78/139157778.db2.gz	NFIZKRXJRYYMHN-HNNXBMFYSA-N	0	1	339.417	1.247	10	5		EDBEMN
C[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000113305591	297096740	/nfs/dbraw/zinc/09/67/40/297096740.db2.gz	NTCJZRITWQNPRC-VXGBXAGGSA-N	0	1	325.390	1.452	10	5		EDBEMN
C[C@@H](O)CN1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H]1C	ZINC000193899084	442808806	/nfs/dbraw/zinc/80/88/06/442808806.db2.gz	HJAXKYXTNHPBOM-VXGBXAGGSA-N	0	1	338.364	1.390	10	5		EDBEMN
CCOc1cc(C[C@H]2[C@H](O)C3CCN2CC3)cc([N+](=O)[O-])c1OC	ZINC000169961385	528288022	/nfs/dbraw/zinc/28/80/22/528288022.db2.gz	SIKKQXIXVFFPNQ-XJKSGUPXSA-N	0	1	336.388	2.000	10	5		EDBEMN
CCc1nc([C@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])cc3)CCO2)n[nH]1	ZINC000130036553	529700792	/nfs/dbraw/zinc/70/07/92/529700792.db2.gz	JWWZLZIBMOYDKB-GFCCVEGCSA-N	0	1	346.347	1.881	10	5		EDBEMN
C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000249212534	139189322	/nfs/dbraw/zinc/18/93/22/139189322.db2.gz	SPWCMEFUBZZOBW-RISCZKNCSA-N	0	1	332.360	1.228	10	5		EDBEMN
COc1ccc(S(=O)(=O)N2CCN3CCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000247647608	286348906	/nfs/dbraw/zinc/34/89/06/286348906.db2.gz	VRFXYWGJUAXNJS-NSHDSACASA-N	0	1	341.389	1.072	10	5		EDBEMN
CN(C)[C@@H]1CCN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000170873500	442281029	/nfs/dbraw/zinc/28/10/29/442281029.db2.gz	HUECCOXUAMXITH-SNVBAGLBSA-N	0	1	333.797	1.573	10	5		EDBEMN
CCc1nc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CCO2)n[nH]1	ZINC000173612485	529699794	/nfs/dbraw/zinc/69/97/94/529699794.db2.gz	OWQMDWCQSVTONI-ZDUSSCGKSA-N	0	1	345.359	1.797	10	5		EDBEMN
CCN1CCC[C@H](NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)C1	ZINC000194631955	273004407	/nfs/dbraw/zinc/00/44/07/273004407.db2.gz	PPBSSYWKRNZYHE-ZDUSSCGKSA-N	0	1	335.360	1.596	10	5		EDBEMN
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000113305655	302046283	/nfs/dbraw/zinc/04/62/83/302046283.db2.gz	NPKSJDBPLDSAIY-STQMWFEESA-N	0	1	339.417	1.760	10	5		EDBEMN
CC(C)N1C[C@H](NS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000174002513	441877221	/nfs/dbraw/zinc/87/72/21/441877221.db2.gz	VDRCYOUPISGHDZ-JQWIXIFHSA-N	0	1	345.396	1.741	10	5		EDBEMN
CC(C)[N@H+]1C[C@H]([N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000174002513	441877225	/nfs/dbraw/zinc/87/72/25/441877225.db2.gz	VDRCYOUPISGHDZ-JQWIXIFHSA-N	0	1	345.396	1.741	10	5		EDBEMN
CC(C)[N@@H+]1C[C@H]([N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000174002513	441877228	/nfs/dbraw/zinc/87/72/28/441877228.db2.gz	VDRCYOUPISGHDZ-JQWIXIFHSA-N	0	1	345.396	1.741	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)Cc3cccc([N+](=O)[O-])c3C)CCO2)n[nH]1	ZINC000126130162	442081759	/nfs/dbraw/zinc/08/17/59/442081759.db2.gz	BABDDBOBJUDRDO-AWEZNQCLSA-N	0	1	345.359	1.472	10	5		EDBEMN
CC(C)(CNCc1ccc(Cl)c([N+](=O)[O-])c1)NS(C)(=O)=O	ZINC000068990171	215351522	/nfs/dbraw/zinc/35/15/22/215351522.db2.gz	DNVMRZKBURBXMP-UHFFFAOYSA-N	0	1	335.813	1.666	10	5		EDBEMN
O=[N+]([O-])c1cccc(CS(=O)(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000178691760	442457155	/nfs/dbraw/zinc/45/71/55/442457155.db2.gz	UTDHPMJWNWCYGO-CQSZACIVSA-N	0	1	325.390	1.205	10	5		EDBEMN
C[C@@H](O)CN1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H]1C	ZINC000193899101	442808687	/nfs/dbraw/zinc/80/86/87/442808687.db2.gz	HJAXKYXTNHPBOM-NWDGAFQWSA-N	0	1	338.364	1.390	10	5		EDBEMN
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCN2CCC[C@@H]2C1	ZINC000171770602	227272971	/nfs/dbraw/zinc/27/29/71/227272971.db2.gz	KMSMFTKOULLZMS-GFCCVEGCSA-N	0	1	325.390	1.372	10	5		EDBEMN
Cc1nc([C@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CCO2)n[nH]1	ZINC000153732246	442298616	/nfs/dbraw/zinc/29/86/16/442298616.db2.gz	PGXQGDHWYWWYSE-CYBMUJFWSA-N	0	1	346.347	1.935	10	5		EDBEMN
CC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])CC[N@@H+]1CCOC	ZINC000182026967	442729433	/nfs/dbraw/zinc/72/94/33/442729433.db2.gz	FSNFZWPWEFPRAL-LBPRGKRZSA-N	0	1	337.376	1.483	10	5		EDBEMN
CC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])CC[N@H+]1CCOC	ZINC000182026967	442729436	/nfs/dbraw/zinc/72/94/36/442729436.db2.gz	FSNFZWPWEFPRAL-LBPRGKRZSA-N	0	1	337.376	1.483	10	5		EDBEMN
Cn1cc([C@H]2CCC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])cn1	ZINC000182231777	442747740	/nfs/dbraw/zinc/74/77/40/442747740.db2.gz	GNJGWUSGBIRRHT-LSDHHAIUSA-N	0	1	346.387	1.905	10	5		EDBEMN
Cn1cc([C@H]2CCCN2C[C@H](O)COc2ccccc2[N+](=O)[O-])cn1	ZINC000182231777	442747742	/nfs/dbraw/zinc/74/77/42/442747742.db2.gz	GNJGWUSGBIRRHT-LSDHHAIUSA-N	0	1	346.387	1.905	10	5		EDBEMN
NCc1ccc(S(=O)(=O)NCc2ccccc2[N+](=O)[O-])s1	ZINC000050016026	214040741	/nfs/dbraw/zinc/04/07/41/214040741.db2.gz	OULJDCQPMLBWLH-UHFFFAOYSA-N	0	1	327.387	1.594	10	5		EDBEMN
Cc1ccc(S(=O)(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000246188344	139098263	/nfs/dbraw/zinc/09/82/63/139098263.db2.gz	NWUPEMZXRLOVKH-OCCSQVGLSA-N	0	1	341.433	1.910	10	5		EDBEMN
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN2CCC[C@H]2C1	ZINC000247489552	139150371	/nfs/dbraw/zinc/15/03/71/139150371.db2.gz	LKPPBNVGWGFPEF-LBPRGKRZSA-N	0	1	341.389	1.072	10	5		EDBEMN
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCC[C@@H](n2cncn2)C1	ZINC000248374197	139161055	/nfs/dbraw/zinc/16/10/55/139161055.db2.gz	OODXTQJXEXTECV-KGLIPLIRSA-N	0	1	347.375	1.263	10	5		EDBEMN
CC(C)(C)OC[C@@H](O)CN1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000047744814	441223682	/nfs/dbraw/zinc/22/36/82/441223682.db2.gz	SRAGKJBOMBOMCS-INIZCTEOSA-N	0	1	337.420	1.893	10	5		EDBEMN
CC[C@@H](O)CN1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1	ZINC000172761614	442537097	/nfs/dbraw/zinc/53/70/97/442537097.db2.gz	KLCGYEOOTXIXQY-CYBMUJFWSA-N	0	1	348.403	1.372	10	5		EDBEMN
CC[C@@H]1CN(C(=O)Nc2ccncc2[N+](=O)[O-])CCN1C[C@@H](C)O	ZINC000183556030	529373529	/nfs/dbraw/zinc/37/35/29/529373529.db2.gz	GZUSSPOKBKDAFB-VXGBXAGGSA-N	0	1	337.380	1.299	10	5		EDBEMN
N[C@@]1(C(=O)Nc2cc([N+](=O)[O-])ccc2Br)CCOC1	ZINC000159450350	225219966	/nfs/dbraw/zinc/21/99/66/225219966.db2.gz	OLAGFDQIAVELPE-NSHDSACASA-N	0	1	330.138	1.414	10	5		EDBEMN
CC[C@H](O)CN1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1	ZINC000106397025	441338852	/nfs/dbraw/zinc/33/88/52/441338852.db2.gz	OACXCTADQSQTBQ-WHWKNOJMSA-N	0	1	333.388	1.523	10	5		EDBEMN
CC[C@@H]1CN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C[C@@H](C)O	ZINC000121076674	442174966	/nfs/dbraw/zinc/17/49/66/442174966.db2.gz	SAXHBWYCPKVIHH-GDBMZVCRSA-N	0	1	349.431	1.831	10	5		EDBEMN
CC[C@@H]1CN(C(=O)CCc2cccc([N+](=O)[O-])c2)CCN1C[C@@H](C)O	ZINC000121076674	442174970	/nfs/dbraw/zinc/17/49/70/442174970.db2.gz	SAXHBWYCPKVIHH-GDBMZVCRSA-N	0	1	349.431	1.831	10	5		EDBEMN
C[C@@H](O)C[N@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H]1C	ZINC000177054033	442291524	/nfs/dbraw/zinc/29/15/24/442291524.db2.gz	SRJBMINLAYHEOX-VXGBXAGGSA-N	0	1	334.376	1.623	10	5		EDBEMN
C[C@@H](O)CN1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H]1C	ZINC000177054033	442291526	/nfs/dbraw/zinc/29/15/26/442291526.db2.gz	SRJBMINLAYHEOX-VXGBXAGGSA-N	0	1	334.376	1.623	10	5		EDBEMN
CCN1CCC[C@H](NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)C1	ZINC000067138768	215116437	/nfs/dbraw/zinc/11/64/37/215116437.db2.gz	OGJAJTFLGVHRFG-LBPRGKRZSA-N	0	1	344.375	1.390	10	5		EDBEMN
O=[N+]([O-])c1ccc(CNC[C@@H]2COCCO2)c(Br)c1	ZINC000038061650	213200002	/nfs/dbraw/zinc/20/00/02/213200002.db2.gz	CPHISEZDNSSPQK-LLVKDONJSA-N	0	1	331.166	1.862	10	5		EDBEMN
CN(C)[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)C1	ZINC000124521853	441934426	/nfs/dbraw/zinc/93/44/26/441934426.db2.gz	SDYHZVJRSQNDCW-GFCCVEGCSA-N	0	1	327.406	1.529	10	5		EDBEMN
[NH3+]C[C@H]1CCC[C@H]1[N-]S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000237847791	698429659	/nfs/dbraw/zinc/42/96/59/698429659.db2.gz	RSSPZISHHOOCMO-PSASIEDQSA-N	0	1	333.797	1.654	10	5		EDBEMN
CCc1[nH]nc(C(=O)N2CCC[C@H](n3cc(C)cn3)C2)c1[N+](=O)[O-]	ZINC000171823724	529465627	/nfs/dbraw/zinc/46/56/27/529465627.db2.gz	WADRAMSVKYNMGS-NSHDSACASA-N	0	1	332.364	1.863	10	5		EDBEMN
O=[N+]([O-])c1ccc(Br)c(NS(=O)(=O)c2c[nH]cn2)c1	ZINC000159500424	225230389	/nfs/dbraw/zinc/23/03/89/225230389.db2.gz	RXWNUDZAXBOXEI-UHFFFAOYSA-N	0	1	347.150	1.881	10	5		EDBEMN
O=C(CNc1ccc([N+](=O)[O-])cc1Br)N1CCNCC1	ZINC000044467098	440848847	/nfs/dbraw/zinc/84/88/47/440848847.db2.gz	BQZINJIKDLIEDP-UHFFFAOYSA-N	0	1	343.181	1.201	10	5		EDBEMN
C[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000113306179	441601848	/nfs/dbraw/zinc/60/18/48/441601848.db2.gz	SPZFWMQDDLAJIS-WCQYABFASA-N	0	1	325.390	1.452	10	5		EDBEMN
C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000190107011	443057935	/nfs/dbraw/zinc/05/79/35/443057935.db2.gz	SPWCMEFUBZZOBW-BXUZGUMPSA-N	0	1	332.360	1.228	10	5		EDBEMN
C[N@H+](Cc1cccnc1)C[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000190670914	443160800	/nfs/dbraw/zinc/16/08/00/443160800.db2.gz	YAEHXWVLGKMRSQ-CYBMUJFWSA-N	0	1	344.375	1.307	10	5		EDBEMN
Cc1cc(S(=O)(=O)N2CC[C@H](N(C)C)C2)cc([N+](=O)[O-])c1F	ZINC000154302365	534036197	/nfs/dbraw/zinc/03/61/97/534036197.db2.gz	FKOQGISCMMKBQR-JTQLQIEISA-N	0	1	331.369	1.367	10	5		EDBEMN
CCOC(=O)/C=C/C(=O)NC(=S)Nc1ccc([N+](=O)[O-])cc1O	ZINC000012495233	211393803	/nfs/dbraw/zinc/39/38/03/211393803.db2.gz	XXBGWYFDCIXCRJ-AATRIKPKSA-N	0	1	339.329	1.233	10	5		EDBEMN
CCCCOC[C@H](O)CN1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000193372250	272991828	/nfs/dbraw/zinc/99/18/28/272991828.db2.gz	VYXFCWLHIOYLPD-QGZVFWFLSA-N	0	1	337.420	1.894	10	5		EDBEMN
CCc1n[nH]c(C(=O)N2CCN(CCOC)[C@@H](CC)C2)c1[N+](=O)[O-]	ZINC000172309457	442441732	/nfs/dbraw/zinc/44/17/32/442441732.db2.gz	QZXKGISIEUVNJW-NSHDSACASA-N	0	1	339.396	1.063	10	5		EDBEMN
CC[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C[C@@H](C)O	ZINC000173270251	442637636	/nfs/dbraw/zinc/63/76/36/442637636.db2.gz	NRNFXZONCRMBQJ-TZMCWYRMSA-N	0	1	336.392	1.904	10	5		EDBEMN
CC[C@H](NCC(=O)N1CCN(C(C)=O)CC1)c1cccc([N+](=O)[O-])c1	ZINC000181530711	442702103	/nfs/dbraw/zinc/70/21/03/442702103.db2.gz	KTUUKRHLXBAHLS-INIZCTEOSA-N	0	1	348.403	1.326	10	5		EDBEMN
CCN1CCC[C@H](NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])C1	ZINC000194624444	442926292	/nfs/dbraw/zinc/92/62/92/442926292.db2.gz	NXWXURQLZBVLQO-NSHDSACASA-N	0	1	337.376	1.826	10	5		EDBEMN
Cc1ccc(C)c(S(=O)(=O)N2CCN3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000249390150	442971376	/nfs/dbraw/zinc/97/13/76/442971376.db2.gz	FTPIREHPPSMRNB-ZDUSSCGKSA-N	0	1	339.417	1.680	10	5		EDBEMN
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000246088393	443266821	/nfs/dbraw/zinc/26/68/21/443266821.db2.gz	GLROCOVPKOVDLR-TZMCWYRMSA-N	0	1	341.433	1.910	10	5		EDBEMN
Cc1c(Br)c(=O)n(Cc2cc(N)ccn2)cc1[N+](=O)[O-]	ZINC000165423385	533706911	/nfs/dbraw/zinc/70/69/11/533706911.db2.gz	XVHOHTIEGAIIAP-UHFFFAOYSA-N	0	1	339.149	1.853	10	5		EDBEMN
CC[C@H]1CN(C(=O)Nc2ccncc2[N+](=O)[O-])CCN1C[C@@H](C)O	ZINC000183556049	529277787	/nfs/dbraw/zinc/27/77/87/529277787.db2.gz	GZUSSPOKBKDAFB-NEPJUHHUSA-N	0	1	337.380	1.299	10	5		EDBEMN
C[C@@H]1CNC[C@@H](C)N1S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000069133656	215361674	/nfs/dbraw/zinc/36/16/74/215361674.db2.gz	NWGPYQCPYCSMAW-RKDXNWHRSA-N	0	1	333.797	1.619	10	5		EDBEMN
COc1ccc([N+](=O)[O-])cc1CN1C[C@@H](C)[C@H](N2CCOCC2)C1	ZINC000246332406	139104476	/nfs/dbraw/zinc/10/44/76/139104476.db2.gz	DULPDYREKZRRPS-CZUORRHYSA-N	0	1	335.404	1.756	10	5		EDBEMN
C[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000113305593	300316699	/nfs/dbraw/zinc/31/66/99/300316699.db2.gz	NTCJZRITWQNPRC-NWDGAFQWSA-N	0	1	325.390	1.452	10	5		EDBEMN
CC[C@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CCN1C[C@H](C)O	ZINC000247498994	442857744	/nfs/dbraw/zinc/85/77/44/442857744.db2.gz	LNNPPABRTPXMPM-JSGCOSHPSA-N	0	1	336.392	1.904	10	5		EDBEMN
CC[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2[O-])CC[N@H+]1C[C@H](C)O	ZINC000246100517	443267313	/nfs/dbraw/zinc/26/73/13/443267313.db2.gz	LIBAXEDQWCRLPB-NWDGAFQWSA-N	0	1	337.376	1.218	10	5		EDBEMN
O=C(Nc1cc([N+](=O)[O-])ccc1Br)[C@H]1CNCCO1	ZINC000159454343	225219843	/nfs/dbraw/zinc/21/98/43/225219843.db2.gz	BCAQLJOZLRUWRI-SNVBAGLBSA-N	0	1	330.138	1.284	10	5		EDBEMN
Cc1nc([C@H]2CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000173529307	441781004	/nfs/dbraw/zinc/78/10/04/441781004.db2.gz	KCIYUBGCETYOAM-CYBMUJFWSA-N	0	1	331.332	1.164	10	5		EDBEMN
Cc1nc([C@H]2CN(CCOc3cccc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000173683216	441824307	/nfs/dbraw/zinc/82/43/07/441824307.db2.gz	GGOMJYIREOTKDM-CQSZACIVSA-N	0	1	333.348	1.474	10	5		EDBEMN
CCN1CCC[C@H]1CN(C)c1ccc([N+](=O)[O-])c(S(C)(=O)=O)c1	ZINC000125738172	442044652	/nfs/dbraw/zinc/04/46/52/442044652.db2.gz	JTAHZRSICHDFNA-ZDUSSCGKSA-N	0	1	341.433	1.919	10	5		EDBEMN
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000247500894	442857489	/nfs/dbraw/zinc/85/74/89/442857489.db2.gz	VAXPHXHOOVIRMM-TZMCWYRMSA-N	0	1	339.417	1.760	10	5		EDBEMN
C[C@H]1CNC[C@H](C)N1S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl	ZINC000069133688	215362419	/nfs/dbraw/zinc/36/24/19/215362419.db2.gz	BYBRFZDOFXWCTL-IUCAKERBSA-N	0	1	333.797	1.619	10	5		EDBEMN
Cc1nc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)n[nH]1	ZINC000173603550	441802293	/nfs/dbraw/zinc/80/22/93/441802293.db2.gz	AXDLWDZKDQNNFD-GFCCVEGCSA-N	0	1	335.295	1.374	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)NCc3cccc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000175456914	442066678	/nfs/dbraw/zinc/06/66/78/442066678.db2.gz	QMFYPJJKZUDBHT-ZDUSSCGKSA-N	0	1	346.347	1.304	10	5		EDBEMN
CC[C@H](NCC(=O)N[C@H](C)C(=O)N(C)C)c1cccc([N+](=O)[O-])c1	ZINC000181532255	442702425	/nfs/dbraw/zinc/70/24/25/442702425.db2.gz	CELKPHQHMNQYKU-RISCZKNCSA-N	0	1	336.392	1.228	10	5		EDBEMN
CCc1nn(C)c(N2CCN(CCOC)[C@@H](CC)C2)c1[N+](=O)[O-]	ZINC000245574336	139079747	/nfs/dbraw/zinc/07/97/47/139079747.db2.gz	ZKEWKNHGYXPKBQ-LBPRGKRZSA-N	0	1	325.413	1.438	10	5		EDBEMN
C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1cccc(-n2ccnc2)c1	ZINC000123101103	222215627	/nfs/dbraw/zinc/21/56/27/222215627.db2.gz	CNEUBKKIJYFEFH-JTQLQIEISA-N	0	1	326.316	1.995	10	5		EDBEMN
C[C@H](NC(=O)c1[n-]ncc1[N+](=O)[O-])c1cccc(-n2cc[nH+]c2)c1	ZINC000123101103	222215629	/nfs/dbraw/zinc/21/56/29/222215629.db2.gz	CNEUBKKIJYFEFH-JTQLQIEISA-N	0	1	326.316	1.995	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3C)CCO2)n[nH]1	ZINC000173533317	441782084	/nfs/dbraw/zinc/78/20/84/441782084.db2.gz	CIGUAYHRQNUYCO-ZDUSSCGKSA-N	0	1	331.332	1.543	10	5		EDBEMN
CC(C)(C)OC(=O)NC[C@H]1CCCN1CCn1cc([N+](=O)[O-])cn1	ZINC000174879807	441978222	/nfs/dbraw/zinc/97/82/22/441978222.db2.gz	NGMBWLRQGWAGKZ-GFCCVEGCSA-N	0	1	339.396	1.780	10	5		EDBEMN
CCc1nc([C@H]2CN(c3c([N+](=O)[O-])c(C)nn3CC)CCO2)n[nH]1	ZINC000192693263	442677499	/nfs/dbraw/zinc/67/74/99/442677499.db2.gz	SSWMROGQUNQTGE-SNVBAGLBSA-N	0	1	335.368	1.378	10	5		EDBEMN
Cn1cc([C@H]2CCCN2C[C@@H](O)COc2ccccc2[N+](=O)[O-])cn1	ZINC000248373130	139161074	/nfs/dbraw/zinc/16/10/74/139161074.db2.gz	GNJGWUSGBIRRHT-HUUCEWRRSA-N	0	1	346.387	1.905	10	5		EDBEMN
O=C(Nc1cc([N+](=O)[O-])ccc1Br)[C@@H]1CNCCO1	ZINC000159454217	225219789	/nfs/dbraw/zinc/21/97/89/225219789.db2.gz	BCAQLJOZLRUWRI-JTQLQIEISA-N	0	1	330.138	1.284	10	5		EDBEMN
Cc1nc([C@@H]2CN(CCCOc3ccc([N+](=O)[O-])cc3)CCO2)n[nH]1	ZINC000173664738	441819604	/nfs/dbraw/zinc/81/96/04/441819604.db2.gz	FDCHRPNUHUHPGP-HNNXBMFYSA-N	0	1	347.375	1.864	10	5		EDBEMN
CC(C)N1C[C@@H](C)[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000173882500	441855079	/nfs/dbraw/zinc/85/50/79/441855079.db2.gz	NLCYZTPUCOWNQU-RISCZKNCSA-N	0	1	327.406	1.602	10	5		EDBEMN
C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000190107031	443057730	/nfs/dbraw/zinc/05/77/30/443057730.db2.gz	SPWCMEFUBZZOBW-SMDDNHRTSA-N	0	1	332.360	1.228	10	5		EDBEMN
O=[N+]([O-])c1ccc(CNC[C@H]2COCCO2)c(Br)c1	ZINC000038061651	202096565	/nfs/dbraw/zinc/09/65/65/202096565.db2.gz	CPHISEZDNSSPQK-NSHDSACASA-N	0	1	331.166	1.862	10	5		EDBEMN
COc1cccc(CN[C@H](CO)[C@@H](O)c2ccc([N+](=O)[O-])cc2)n1	ZINC000237237153	139045331	/nfs/dbraw/zinc/04/53/31/139045331.db2.gz	BFCBBWQIAGSLAK-ZBFHGGJFSA-N	0	1	333.344	1.183	10	5		EDBEMN
C[C@@H](O)CN1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C[C@@H]1C	ZINC000105790655	274270833	/nfs/dbraw/zinc/27/08/33/274270833.db2.gz	IAVGTNAKMDODFE-NWDGAFQWSA-N	0	1	348.403	1.371	10	5		EDBEMN
CCc1nc([C@H]2CN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000173610044	441803703	/nfs/dbraw/zinc/80/37/03/441803703.db2.gz	QPRBCONUJZWQMH-GFCCVEGCSA-N	0	1	346.347	1.071	10	5		EDBEMN
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCN2CCC[C@@H]2C1	ZINC000175111656	442006472	/nfs/dbraw/zinc/00/64/72/442006472.db2.gz	GXFLUMBZXUQBBG-CYBMUJFWSA-N	0	1	339.417	1.680	10	5		EDBEMN
CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC[N@@H+]1CCOC	ZINC000186632978	442578788	/nfs/dbraw/zinc/57/87/88/442578788.db2.gz	DEDABUDVXVHFFR-GFCCVEGCSA-N	0	1	337.376	1.483	10	5		EDBEMN
CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC[N@H+]1CCOC	ZINC000186632978	442578790	/nfs/dbraw/zinc/57/87/90/442578790.db2.gz	DEDABUDVXVHFFR-GFCCVEGCSA-N	0	1	337.376	1.483	10	5		EDBEMN
Cc1cc(C)c(S(=O)(=O)N2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000249134001	442955943	/nfs/dbraw/zinc/95/59/43/442955943.db2.gz	YKYMGEWXFNMYFE-ZDUSSCGKSA-N	0	1	339.417	1.680	10	5		EDBEMN
Cc1cc(C)c(S(=O)(=O)N2CCN3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000249134001	442955946	/nfs/dbraw/zinc/95/59/46/442955946.db2.gz	YKYMGEWXFNMYFE-ZDUSSCGKSA-N	0	1	339.417	1.680	10	5		EDBEMN
CC[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CCN1C[C@H](C)O	ZINC000246929297	139127312	/nfs/dbraw/zinc/12/73/12/139127312.db2.gz	RCZACWNVBJAPND-DZGCQCFKSA-N	0	1	335.404	1.441	10	5		EDBEMN
CC[C@@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CCN1C[C@@H](C)O	ZINC000174639182	207040184	/nfs/dbraw/zinc/04/01/84/207040184.db2.gz	SKTGSYOCHJNIER-UKRRQHHQSA-N	0	1	335.404	1.441	10	5		EDBEMN
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000173884896	441855421	/nfs/dbraw/zinc/85/54/21/441855421.db2.gz	JUTSUEBCTQGKJD-AAEUAGOBSA-N	0	1	341.433	1.910	10	5		EDBEMN
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCN2CCC[C@@H]2C1	ZINC000171770766	442380158	/nfs/dbraw/zinc/38/01/58/442380158.db2.gz	WXTWTSROKWZTCW-GFCCVEGCSA-N	0	1	325.390	1.372	10	5		EDBEMN
CC[C@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CCN1C[C@@H](C)O	ZINC000173271532	442637581	/nfs/dbraw/zinc/63/75/81/442637581.db2.gz	LNNPPABRTPXMPM-OCCSQVGLSA-N	0	1	336.392	1.904	10	5		EDBEMN
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000246135362	139096012	/nfs/dbraw/zinc/09/60/12/139096012.db2.gz	JUTSUEBCTQGKJD-YPMHNXCESA-N	0	1	341.433	1.910	10	5		EDBEMN
O=C(CN1CCN2CCCC[C@@H]2C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000177753571	207388569	/nfs/dbraw/zinc/38/85/69/207388569.db2.gz	GMGRYRMLADNLHK-MRXNPFEDSA-N	0	1	344.415	1.654	10	5		EDBEMN
CCc1nc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3)CCO2)n[nH]1	ZINC000173610950	441803806	/nfs/dbraw/zinc/80/38/06/441803806.db2.gz	HZYFUMAGEUFNOJ-GFCCVEGCSA-N	0	1	331.332	1.489	10	5		EDBEMN
COc1ccc(S(=O)(=O)N2CCN3CCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000171771134	442380145	/nfs/dbraw/zinc/38/01/45/442380145.db2.gz	VRFXYWGJUAXNJS-LLVKDONJSA-N	0	1	341.389	1.072	10	5		EDBEMN
O=Cc1ccc(OCC(=O)N2CCN3CCCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000171922374	442390895	/nfs/dbraw/zinc/39/08/95/442390895.db2.gz	MSJAXDGAEPLIHJ-AWEZNQCLSA-N	0	1	347.371	1.483	10	5		EDBEMN
Cc1cc(S(=O)(=O)N2C[C@@H]3CCCN3C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000172021586	442400593	/nfs/dbraw/zinc/40/05/93/442400593.db2.gz	JJHKULKRDFVANN-STQMWFEESA-N	0	1	339.417	1.760	10	5		EDBEMN
CCc1[nH]nc(C(=O)N2CCC(Cn3cccn3)CC2)c1[N+](=O)[O-]	ZINC000172411601	442456503	/nfs/dbraw/zinc/45/65/03/442456503.db2.gz	HYYCTMDTPJEQMN-UHFFFAOYSA-N	0	1	332.364	1.629	10	5		EDBEMN
C[N@H+](Cc1cccnc1)C[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000190670889	443161479	/nfs/dbraw/zinc/16/14/79/443161479.db2.gz	YAEHXWVLGKMRSQ-ZDUSSCGKSA-N	0	1	344.375	1.307	10	5		EDBEMN
C[C@@H]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1nnn[n-]1	ZINC000044925953	204312054	/nfs/dbraw/zinc/31/20/54/204312054.db2.gz	IRUSPVKTQSHDKM-ZCFIWIBFSA-N	0	1	327.142	1.721	10	5		EDBEMN
C[C@@H](NCc1ccc(Br)c([N+](=O)[O-])c1)c1nn[nH]n1	ZINC000044925953	204312056	/nfs/dbraw/zinc/31/20/56/204312056.db2.gz	IRUSPVKTQSHDKM-ZCFIWIBFSA-N	0	1	327.142	1.721	10	5		EDBEMN
CN(C(=O)CN1CCN2CCCC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000177758731	207391439	/nfs/dbraw/zinc/39/14/39/207391439.db2.gz	OZHRXHMDLJNGLN-MRXNPFEDSA-N	0	1	332.404	1.728	10	5		EDBEMN
Cc1cc(Br)c(NC(=O)[C@]2(N)CCOC2)cc1[N+](=O)[O-]	ZINC000169235076	226234743	/nfs/dbraw/zinc/23/47/43/226234743.db2.gz	AAQUULZVGPVGPN-LBPRGKRZSA-N	0	1	344.165	1.722	10	5		EDBEMN
C[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000113305199	297096771	/nfs/dbraw/zinc/09/67/71/297096771.db2.gz	RYUKHZRNBRSELH-GHMZBOCLSA-N	0	1	343.380	1.591	10	5		EDBEMN
C[C@@H](O)CN1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000120676542	442116098	/nfs/dbraw/zinc/11/60/98/442116098.db2.gz	HYESYHXSUIVXMW-UONOGXRCSA-N	0	1	335.404	1.441	10	5		EDBEMN
CC(C)C[C@H](CN(C)C)NS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000189141824	442885034	/nfs/dbraw/zinc/88/50/34/442885034.db2.gz	AQOVNDLFFBZDJZ-GFCCVEGCSA-N	0	1	329.422	1.849	10	5		EDBEMN
C[C@H]1CNC[C@H](C)N1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000069133691	202268575	/nfs/dbraw/zinc/26/85/75/202268575.db2.gz	ICXSEFCKZMGDHE-IUCAKERBSA-N	0	1	333.797	1.619	10	5		EDBEMN
C[C@@H]1CNC[C@H](C)N1S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000069133654	202268629	/nfs/dbraw/zinc/26/86/29/202268629.db2.gz	NWGPYQCPYCSMAW-DTORHVGOSA-N	0	1	333.797	1.619	10	5		EDBEMN
CCc1nc([C@H]2CN(c3ncc([N+](=O)[O-])cc3Cl)CCO2)n[nH]1	ZINC000131685201	205298866	/nfs/dbraw/zinc/29/88/66/205298866.db2.gz	RRMBPIBMNOOZGB-SNVBAGLBSA-N	0	1	338.755	1.902	10	5		EDBEMN
CCOCCN1CCN(c2c([N+](=O)[O-])c(CC)nn2C)C[C@@H]1CC	ZINC000245571683	139079947	/nfs/dbraw/zinc/07/99/47/139079947.db2.gz	XSXRJZKYJLYZON-ZDUSSCGKSA-N	0	1	339.440	1.828	10	5		EDBEMN
Cc1c(NC(=O)[C@H](C)NC[C@@H]2CN(C)CCO2)cccc1[N+](=O)[O-]	ZINC000112548883	441550778	/nfs/dbraw/zinc/55/07/78/441550778.db2.gz	CVJDDJRVFRCDKF-QWHCGFSZSA-N	0	1	336.392	1.150	10	5		EDBEMN
CCc1nc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3C)CCO2)n[nH]1	ZINC000173567425	441794170	/nfs/dbraw/zinc/79/41/70/441794170.db2.gz	AZPCVFFWOBSWKO-ZDUSSCGKSA-N	0	1	345.359	1.797	10	5		EDBEMN
CC[C@H]1CN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C[C@@H](C)O	ZINC000121076808	442174511	/nfs/dbraw/zinc/17/45/11/442174511.db2.gz	SAXHBWYCPKVIHH-ZBFHGGJFSA-N	0	1	349.431	1.831	10	5		EDBEMN
CC[C@H]1CN(C(=O)CCc2cccc([N+](=O)[O-])c2)CCN1C[C@@H](C)O	ZINC000121076808	442174514	/nfs/dbraw/zinc/17/45/14/442174514.db2.gz	SAXHBWYCPKVIHH-ZBFHGGJFSA-N	0	1	349.431	1.831	10	5		EDBEMN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCCNC(=O)[C@H]1C	ZINC000189263590	442908183	/nfs/dbraw/zinc/90/81/83/442908183.db2.gz	WORMRIGCWBVRPE-GFCCVEGCSA-N	0	1	334.376	1.442	10	5		EDBEMN
CC[C@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CCN1C[C@H](C)O	ZINC000246954620	536112936	/nfs/dbraw/zinc/11/29/36/536112936.db2.gz	SKTGSYOCHJNIER-ZFWWWQNUSA-N	0	1	335.404	1.441	10	5		EDBEMN
O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H]1CNCCO1	ZINC000043709019	204288722	/nfs/dbraw/zinc/28/87/22/204288722.db2.gz	LSVQXKBGDLUSFO-JTQLQIEISA-N	0	1	330.138	1.284	10	5		EDBEMN
C[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000113305799	441602017	/nfs/dbraw/zinc/60/20/17/441602017.db2.gz	WPWPCXKNYFDCLS-WDEREUQCSA-N	0	1	343.380	1.591	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3C)CCO2)n[nH]1	ZINC000173515081	441774840	/nfs/dbraw/zinc/77/48/40/441774840.db2.gz	WUSDDUFNUFSUAN-ZDUSSCGKSA-N	0	1	331.332	1.543	10	5		EDBEMN
CCCC(=O)N[C@H]1CCCN(C(=O)c2n[nH]c(CC)c2[N+](=O)[O-])C1	ZINC000171807115	442382524	/nfs/dbraw/zinc/38/25/24/442382524.db2.gz	GVBJQDBSPDSFRW-JTQLQIEISA-N	0	1	337.380	1.401	10	5		EDBEMN
CCc1[nH]nc(C(=O)N2CCC(c3ccnn3C)CC2)c1[N+](=O)[O-]	ZINC000172411277	442456259	/nfs/dbraw/zinc/45/62/59/442456259.db2.gz	GPTXKQVDZYCURJ-UHFFFAOYSA-N	0	1	332.364	1.634	10	5		EDBEMN
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCCNC(=O)[C@H]1C	ZINC000189327008	442922058	/nfs/dbraw/zinc/92/20/58/442922058.db2.gz	XUVRBJYGFLYDQQ-GFCCVEGCSA-N	0	1	334.376	1.442	10	5		EDBEMN
CC[C@H](O)CN1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC1	ZINC000255188337	443089130	/nfs/dbraw/zinc/08/91/30/443089130.db2.gz	OACXCTADQSQTBQ-SBSDFTTDSA-N	0	1	333.388	1.523	10	5		EDBEMN
C[C@@H]1CNCCN1C(=O)c1cc([N+](=O)[O-])ccc1Br	ZINC000054369523	214234580	/nfs/dbraw/zinc/23/45/80/214234580.db2.gz	PAJVQRUIOHGDNE-MRVPVSSYSA-N	0	1	328.166	1.791	10	5		EDBEMN
NC(=O)[C@@](N)(COc1c(Cl)cc([N+](=O)[O-])cc1Cl)C1CC1	ZINC000069198306	202272644	/nfs/dbraw/zinc/27/26/44/202272644.db2.gz	AKIGJZORXGPYNN-GFCCVEGCSA-N	0	1	334.159	1.873	10	5		EDBEMN
NCc1nc(CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)cs1	ZINC000071697326	203103130	/nfs/dbraw/zinc/10/31/30/203103130.db2.gz	HBZQZOMQCTZHOI-UHFFFAOYSA-N	0	1	336.329	1.420	10	5		EDBEMN
O=[N+]([O-])c1ccccc1OCCN1CCCN(c2cccnn2)CC1	ZINC000105800146	204159624	/nfs/dbraw/zinc/15/96/24/204159624.db2.gz	LXWRDISTTZBHHL-UHFFFAOYSA-N	0	1	343.387	1.976	10	5		EDBEMN
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000246190893	139098507	/nfs/dbraw/zinc/09/85/07/139098507.db2.gz	NZCLSMWGEROMSK-OLZOCXBDSA-N	0	1	341.433	1.910	10	5		EDBEMN
COc1ccc(NC(=O)CN2CCN3CCCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000172800992	442545051	/nfs/dbraw/zinc/54/50/51/442545051.db2.gz	JOOSXURSJXFIES-CYBMUJFWSA-N	0	1	348.403	1.712	10	5		EDBEMN
CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC[N@@H+]1CCOC	ZINC000186632998	442578772	/nfs/dbraw/zinc/57/87/72/442578772.db2.gz	DEDABUDVXVHFFR-LBPRGKRZSA-N	0	1	337.376	1.483	10	5		EDBEMN
CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC[N@H+]1CCOC	ZINC000186632998	442578774	/nfs/dbraw/zinc/57/87/74/442578774.db2.gz	DEDABUDVXVHFFR-LBPRGKRZSA-N	0	1	337.376	1.483	10	5		EDBEMN
COC(=O)c1cc(N[C@@H](C)CN2CCN(C)CC2)ccc1[N+](=O)[O-]	ZINC000078543422	536568765	/nfs/dbraw/zinc/56/87/65/536568765.db2.gz	GIGCUZFVJHQNSC-LBPRGKRZSA-N	0	1	336.392	1.429	10	5		EDBEMN
C[C@@H]1CNC[C@H](C)N1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000069133690	202269288	/nfs/dbraw/zinc/26/92/88/202269288.db2.gz	ICXSEFCKZMGDHE-DTORHVGOSA-N	0	1	333.797	1.619	10	5		EDBEMN
Cc1nc(N)sc1S(=O)(=O)Nc1ccc([N+](=O)[O-])cc1F	ZINC000069366406	202274910	/nfs/dbraw/zinc/27/49/10/202274910.db2.gz	UYHRGVCHEWUIPF-UHFFFAOYSA-N	0	1	332.338	1.882	10	5		EDBEMN
O=c1ccc([N+](=O)[O-])cn1CCN1CCC(Nc2cccnn2)CC1	ZINC000131797226	205303217	/nfs/dbraw/zinc/30/32/17/205303217.db2.gz	RGULNKFYWDVGCP-UHFFFAOYSA-N	0	1	344.375	1.123	10	5		EDBEMN
COCCNCC(=O)Nc1cc([N+](=O)[O-])c(C)cc1Br	ZINC000169225015	533019126	/nfs/dbraw/zinc/01/91/26/533019126.db2.gz	BICXVSBMAHGQSV-UHFFFAOYSA-N	0	1	346.181	1.840	10	5		EDBEMN
CCc1nc([C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3C)CCO2)n[nH]1	ZINC000173567440	441793806	/nfs/dbraw/zinc/79/38/06/441793806.db2.gz	AZPCVFFWOBSWKO-CYBMUJFWSA-N	0	1	345.359	1.797	10	5		EDBEMN
Cn1cc([C@H]2CCN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)cn1	ZINC000116318098	441811884	/nfs/dbraw/zinc/81/18/84/441811884.db2.gz	JXOVQLVQSBJPGS-LBPRGKRZSA-N	0	1	329.360	1.417	10	5		EDBEMN
COc1ccc(OCCN2CCC[C@@H](n3cncn3)C2)c([N+](=O)[O-])c1	ZINC000173652050	441815064	/nfs/dbraw/zinc/81/50/64/441815064.db2.gz	OVJDUMAQRRVIJR-CYBMUJFWSA-N	0	1	347.375	1.911	10	5		EDBEMN
CCNCc1nnnn1-c1cc([N+](=O)[O-])c(C)cc1Br	ZINC000169259502	528360204	/nfs/dbraw/zinc/36/02/04/528360204.db2.gz	AFZWVJNUBDXBAM-UHFFFAOYSA-N	0	1	341.169	1.751	10	5		EDBEMN
O=C(COc1c(Cl)cc([N+](=O)[O-])cc1Cl)N1CCNCC1	ZINC000050440434	214056995	/nfs/dbraw/zinc/05/69/95/214056995.db2.gz	UQTIBMRBBPCYNK-UHFFFAOYSA-N	0	1	334.159	1.712	10	5		EDBEMN
O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCC[C@@H](n3cncn3)C2)c1	ZINC000247157539	139138051	/nfs/dbraw/zinc/13/80/51/139138051.db2.gz	LZFHJGJTYMZTFM-CABCVRRESA-N	0	1	347.375	1.263	10	5		EDBEMN
O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCC[C@H](n3cncn3)C2)c1	ZINC000171617998	227174573	/nfs/dbraw/zinc/17/45/73/227174573.db2.gz	LZFHJGJTYMZTFM-GJZGRUSLSA-N	0	1	347.375	1.263	10	5		EDBEMN
C[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000113305201	300316316	/nfs/dbraw/zinc/31/63/16/300316316.db2.gz	RYUKHZRNBRSELH-WDEREUQCSA-N	0	1	343.380	1.591	10	5		EDBEMN
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000247252442	302046481	/nfs/dbraw/zinc/04/64/81/302046481.db2.gz	NPKSJDBPLDSAIY-OLZOCXBDSA-N	0	1	339.417	1.760	10	5		EDBEMN
CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])CC[N@@H+]1CCOC	ZINC000182026946	442729536	/nfs/dbraw/zinc/72/95/36/442729536.db2.gz	FSNFZWPWEFPRAL-GFCCVEGCSA-N	0	1	337.376	1.483	10	5		EDBEMN
CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])CC[N@H+]1CCOC	ZINC000182026946	442729540	/nfs/dbraw/zinc/72/95/40/442729540.db2.gz	FSNFZWPWEFPRAL-GFCCVEGCSA-N	0	1	337.376	1.483	10	5		EDBEMN
CCCc1[nH]nc(C(=O)N2CCC[C@@H](n3cncn3)C2)c1[N+](=O)[O-]	ZINC000171822552	528543853	/nfs/dbraw/zinc/54/38/53/528543853.db2.gz	FVJXRMYJXLVFCV-SNVBAGLBSA-N	0	1	333.352	1.339	10	5		EDBEMN
COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCN2CCCC[C@H]2C1	ZINC000246179909	139098047	/nfs/dbraw/zinc/09/80/47/139098047.db2.gz	KJUAIUMTYCYPQM-AWEZNQCLSA-N	0	1	348.403	1.712	10	5		EDBEMN
C[C@@H]1CN(S(=O)(=O)c2cc([N+](=O)[O-])c(Cl)s2)[C@@H](C)CN1	ZINC000168438608	226214857	/nfs/dbraw/zinc/21/48/57/226214857.db2.gz	YKWFIYZBIYRVJR-RQJHMYQMSA-N	0	1	339.826	1.681	10	5		EDBEMN
C[C@@H]1[NH2+]CCC[C@H]1[N-]S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000193455589	288856812	/nfs/dbraw/zinc/85/68/12/288856812.db2.gz	CDRSIHNAEBBKML-WCBMZHEXSA-N	0	1	333.797	1.667	10	5		EDBEMN
O=[N+]([O-])c1cccc([C@H](O)CN2CCCN(c3cccnn3)CC2)c1	ZINC000137038956	441742098	/nfs/dbraw/zinc/74/20/98/441742098.db2.gz	GOAXBVYCONKAHK-MRXNPFEDSA-N	0	1	343.387	1.631	10	5		EDBEMN
Cc1nc([C@H]2CN(C(=O)NCc3cccc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000175456928	442066539	/nfs/dbraw/zinc/06/65/39/442066539.db2.gz	QMFYPJJKZUDBHT-CYBMUJFWSA-N	0	1	346.347	1.304	10	5		EDBEMN
O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCN2CCC[C@H]2C1	ZINC000247600523	442863230	/nfs/dbraw/zinc/86/32/30/442863230.db2.gz	UIJKPLOOMQFWQN-JTQLQIEISA-N	0	1	345.808	1.717	10	5		EDBEMN
O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)[N-]CC[C@@H]1CCC[NH2+]C1	ZINC000237752009	139059650	/nfs/dbraw/zinc/05/96/50/139059650.db2.gz	FTERBNPASSBJSF-JTQLQIEISA-N	0	1	347.824	1.916	10	5		EDBEMN
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000247120473	139136517	/nfs/dbraw/zinc/13/65/17/139136517.db2.gz	JASQQIKSUVIAFJ-YPMHNXCESA-N	0	1	339.417	1.760	10	5		EDBEMN
O=C(CNc1ccc(Br)cc1[N+](=O)[O-])N1CCNCC1	ZINC000037716318	441613759	/nfs/dbraw/zinc/61/37/59/441613759.db2.gz	AOJJRIQGRSPLMI-UHFFFAOYSA-N	0	1	343.181	1.201	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)C=Cc3ccc([N+](=O)[O-])cc3)CCO2)n[nH]1	ZINC000173604609	441802443	/nfs/dbraw/zinc/80/24/43/441802443.db2.gz	SENMTCQZFCCNBK-GBXSZLQWSA-N	0	1	343.343	1.635	10	5		EDBEMN
Cc1nc([C@H]2CN(C(=O)Nc3cccc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000176937744	442275754	/nfs/dbraw/zinc/27/57/54/442275754.db2.gz	GUZHXVGHTGLJEF-GFCCVEGCSA-N	0	1	332.320	1.627	10	5		EDBEMN
CC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N)CCN1C[C@@H](C)O	ZINC000187868898	529281625	/nfs/dbraw/zinc/28/16/25/529281625.db2.gz	BCCVIQAYFMEFNP-NEPJUHHUSA-N	0	1	336.392	1.094	10	5		EDBEMN
Cc1cccc(Nc2[nH]cnc(=NN3CCN(C)CC3)c2[N+](=O)[O-])n1	ZINC000040584634	213355761	/nfs/dbraw/zinc/35/57/61/213355761.db2.gz	AVDWOTADYAWEBY-UHFFFAOYSA-N	0	1	344.379	1.406	10	5		EDBEMN
C[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000248725810	139173332	/nfs/dbraw/zinc/17/33/32/139173332.db2.gz	JYVZBVJXJAWKAF-AAEUAGOBSA-N	0	1	325.390	1.452	10	5		EDBEMN
Cc1ccc(S(=O)(=O)N2CCN3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000171771125	227273046	/nfs/dbraw/zinc/27/30/46/227273046.db2.gz	UHCUWEKWUNBREW-GFCCVEGCSA-N	0	1	325.390	1.372	10	5		EDBEMN
C[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000247255675	300320536	/nfs/dbraw/zinc/32/05/36/300320536.db2.gz	NTCJZRITWQNPRC-RYUDHWBXSA-N	0	1	325.390	1.452	10	5		EDBEMN
CCc1nc([C@H]2CN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000173575150	441797518	/nfs/dbraw/zinc/79/75/18/441797518.db2.gz	JWVXJABPXQGTQW-CYBMUJFWSA-N	0	1	345.359	1.797	10	5		EDBEMN
CCc1nc([C@@H]2CN(C(=O)c3cccc(C)c3[N+](=O)[O-])CCO2)n[nH]1	ZINC000173609593	441803513	/nfs/dbraw/zinc/80/35/13/441803513.db2.gz	FOMZUDVMIODNSP-LBPRGKRZSA-N	0	1	345.359	1.797	10	5		EDBEMN
CC(C)NCc1nnnn1-c1cc([N+](=O)[O-])ccc1Br	ZINC000159522601	527734593	/nfs/dbraw/zinc/73/45/93/527734593.db2.gz	STQSXEHNEGKDCN-UHFFFAOYSA-N	0	1	341.169	1.831	10	5		EDBEMN
CNc1cc([N+](=O)[O-])cc(F)c1S(=O)(=O)NCC(F)(F)F	ZINC000050634413	214062445	/nfs/dbraw/zinc/06/24/45/214062445.db2.gz	KLNLYTQNFYQVFU-UHFFFAOYSA-N	0	1	331.247	1.616	10	5		EDBEMN
Cc1cc(N2CCC[C@H](NCc3cccc([N+](=O)[O-])c3)C2=O)n(C)n1	ZINC000173852129	231051203	/nfs/dbraw/zinc/05/12/03/231051203.db2.gz	OLLPEUXIXOCWKC-HNNXBMFYSA-N	0	1	343.387	1.922	10	5		EDBEMN
C[NH+](C)C[C@@H](NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)c1ccccc1	ZINC000186798609	236023254	/nfs/dbraw/zinc/02/32/54/236023254.db2.gz	BRZPRCUXFLVBQM-CYBMUJFWSA-N	0	1	330.344	1.728	10	5		EDBEMN
O=C(C[C@@H]1COCCN1)Nc1cc([N+](=O)[O-])ccc1Br	ZINC000159445529	225218047	/nfs/dbraw/zinc/21/80/47/225218047.db2.gz	SJYGNWJNHSOITE-MRVPVSSYSA-N	0	1	344.165	1.674	10	5		EDBEMN
Cc1nc([C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3C)CCO2)n[nH]1	ZINC000173533332	441782179	/nfs/dbraw/zinc/78/21/79/441782179.db2.gz	CIGUAYHRQNUYCO-CYBMUJFWSA-N	0	1	331.332	1.543	10	5		EDBEMN
O=c1ccc([N+](=O)[O-])cn1CCN1CC[C@@H](Oc2cccnc2)C1	ZINC000090552743	138279630	/nfs/dbraw/zinc/27/96/30/138279630.db2.gz	VITLGVLCLKDSMA-OAHLLOKOSA-N	0	1	330.344	1.305	10	5		EDBEMN
CCOc1ccc([N+](=O)[O-])cc1CN1CCN(C[C@@H](C)O)[C@@H](C)C1	ZINC000245467777	139076288	/nfs/dbraw/zinc/07/62/88/139076288.db2.gz	KDCYYMYRCRSBOD-UONOGXRCSA-N	0	1	337.420	1.880	10	5		EDBEMN
CN1CCC(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1	ZINC000037248208	213136428	/nfs/dbraw/zinc/13/64/28/213136428.db2.gz	MUWALMAYNSJQEF-UHFFFAOYSA-N	0	1	333.797	1.621	10	5		EDBEMN
O=[N+]([O-])c1cccc(CS(=O)(=O)N2CC[N@H+]3CCC[C@H]3C2)c1	ZINC000246829873	139123435	/nfs/dbraw/zinc/12/34/35/139123435.db2.gz	UTDHPMJWNWCYGO-AWEZNQCLSA-N	0	1	325.390	1.205	10	5		EDBEMN
O=[N+]([O-])c1cccc(CS(=O)(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000246829873	139123436	/nfs/dbraw/zinc/12/34/36/139123436.db2.gz	UTDHPMJWNWCYGO-AWEZNQCLSA-N	0	1	325.390	1.205	10	5		EDBEMN
CCCc1[nH]nc(C(=O)N2CC[C@H](c3cnn(C)c3)C2)c1[N+](=O)[O-]	ZINC000116466629	441824904	/nfs/dbraw/zinc/82/49/04/441824904.db2.gz	JTWPRCQYTPQSQU-JTQLQIEISA-N	0	1	332.364	1.634	10	5		EDBEMN
CC(C)N1C[C@@H](C)[C@@H](NS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1	ZINC000174002499	441876899	/nfs/dbraw/zinc/87/68/99/441876899.db2.gz	VDRCYOUPISGHDZ-PWSUYJOCSA-N	0	1	345.396	1.741	10	5		EDBEMN
CC(C)[N@@H+]1C[C@@H](C)[C@@H]([N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1	ZINC000174002499	441876902	/nfs/dbraw/zinc/87/69/02/441876902.db2.gz	VDRCYOUPISGHDZ-PWSUYJOCSA-N	0	1	345.396	1.741	10	5		EDBEMN
CC(C)[N@H+]1C[C@@H](C)[C@@H]([N-]S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1	ZINC000174002499	441876905	/nfs/dbraw/zinc/87/69/05/441876905.db2.gz	VDRCYOUPISGHDZ-PWSUYJOCSA-N	0	1	345.396	1.741	10	5		EDBEMN
CCc1[nH]nc(C(=O)N(C)[C@H](C)C(=O)OC(C)(C)C)c1[N+](=O)[O-]	ZINC000175862302	442136363	/nfs/dbraw/zinc/13/63/63/442136363.db2.gz	CMTKPMHUZZAUPU-MRVPVSSYSA-N	0	1	326.353	1.683	10	5		EDBEMN
C[C@H](O)CN1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1C	ZINC000246540606	442791429	/nfs/dbraw/zinc/79/14/29/442791429.db2.gz	SRJBMINLAYHEOX-RYUDHWBXSA-N	0	1	334.376	1.623	10	5		EDBEMN
C[C@@H](O)CN1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000185774320	443255049	/nfs/dbraw/zinc/25/50/49/443255049.db2.gz	RFGGXVWWHYFOBI-CHWSQXEVSA-N	0	1	336.392	1.191	10	5		EDBEMN
CCCNCc1nnnn1-c1cc([N+](=O)[O-])ccc1Br	ZINC000159522317	528518573	/nfs/dbraw/zinc/51/85/73/528518573.db2.gz	IIFNHRGWFQYXOV-UHFFFAOYSA-N	0	1	341.169	1.833	10	5		EDBEMN
CCOCCN1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)C[C@H]1CC	ZINC000123666094	138320371	/nfs/dbraw/zinc/32/03/71/138320371.db2.gz	FTIHIZZFUJJFFR-CYBMUJFWSA-N	0	1	348.407	1.575	10	5		EDBEMN
O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N1CCN2CCC[C@H]2C1	ZINC000247647584	280364984	/nfs/dbraw/zinc/36/49/84/280364984.db2.gz	VQXJEBDQDQOQEA-NSHDSACASA-N	0	1	345.808	1.717	10	5		EDBEMN
CN1CCC[C@H](CNc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)C1	ZINC000091482918	441706227	/nfs/dbraw/zinc/70/62/27/441706227.db2.gz	ZQHOOMRIEWTPTN-LLVKDONJSA-N	0	1	327.406	1.752	10	5		EDBEMN
C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1	ZINC000179108649	442574470	/nfs/dbraw/zinc/57/44/70/442574470.db2.gz	MNIAWCDYMMSRGC-QMMMGPOBSA-N	0	1	338.345	1.212	10	5		EDBEMN
CC(C)C[C@@H](CN(C)C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000193882502	442805281	/nfs/dbraw/zinc/80/52/81/442805281.db2.gz	ORGVOJDVCDCNRC-NSHDSACASA-N	0	1	347.412	1.989	10	5		EDBEMN
C[C@H](O)CN1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000255536779	443101761	/nfs/dbraw/zinc/10/17/61/443101761.db2.gz	ZCYQVBQWKMFAJL-GMOCCLDISA-N	0	1	333.388	1.522	10	5		EDBEMN
O=C(NCc1nnc[nH]1)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000037920602	213173860	/nfs/dbraw/zinc/17/38/60/213173860.db2.gz	OILMPIDVBNVSFA-UHFFFAOYSA-N	0	1	326.110	1.405	10	5		EDBEMN
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN2CCC[C@H]2C1	ZINC000247489114	139150378	/nfs/dbraw/zinc/15/03/78/139150378.db2.gz	LHUHEROEOXRRET-ZDUSSCGKSA-N	0	1	325.390	1.372	10	5		EDBEMN
Cc1ccc(NC(=O)C(=O)N2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000177686364	442370465	/nfs/dbraw/zinc/37/04/65/442370465.db2.gz	VRATVFICQJAXCJ-CYBMUJFWSA-N	0	1	332.360	1.148	10	5		EDBEMN
Cc1nc(C[C@@H]2CCCN(CCn3cc([N+](=O)[O-])ccc3=O)C2)no1	ZINC000090525861	441632520	/nfs/dbraw/zinc/63/25/20/441632520.db2.gz	KHJACFZBABUQFQ-ZDUSSCGKSA-N	0	1	347.375	1.403	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)Nc3cc([N+](=O)[O-])ccc3C)CCO2)n[nH]1	ZINC000176939347	442276206	/nfs/dbraw/zinc/27/62/06/442276206.db2.gz	DIAMGMQXLRKNBD-ZDUSSCGKSA-N	0	1	346.347	1.935	10	5		EDBEMN
COc1cc(S(=O)(=O)N2CCN3CCC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000177056270	442291183	/nfs/dbraw/zinc/29/11/83/442291183.db2.gz	PEBHKEJIZYNQQU-LLVKDONJSA-N	0	1	341.389	1.072	10	5		EDBEMN
Cc1ccc(NC(=O)C(=O)N2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000177686379	442370754	/nfs/dbraw/zinc/37/07/54/442370754.db2.gz	VRATVFICQJAXCJ-ZDUSSCGKSA-N	0	1	332.360	1.148	10	5		EDBEMN
C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000247520147	442860291	/nfs/dbraw/zinc/86/02/91/442860291.db2.gz	WPWPCXKNYFDCLS-MNOVXSKESA-N	0	1	343.380	1.591	10	5		EDBEMN
C[C@H](O)CN1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000255536780	443101666	/nfs/dbraw/zinc/10/16/66/443101666.db2.gz	ZCYQVBQWKMFAJL-QDDHOEGMSA-N	0	1	333.388	1.522	10	5		EDBEMN
C[C@@H]1CNC[C@@H](C)N1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000069133988	215363444	/nfs/dbraw/zinc/36/34/44/215363444.db2.gz	NVQRZDBKXUDIOJ-RKDXNWHRSA-N	0	1	333.797	1.619	10	5		EDBEMN
COc1ccc([N+](=O)[O-])cc1CN1C[C@H](C)[C@H](N2CCOCC2)C1	ZINC000246332427	139104464	/nfs/dbraw/zinc/10/44/64/139104464.db2.gz	DULPDYREKZRRPS-XJKSGUPXSA-N	0	1	335.404	1.756	10	5		EDBEMN
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000247120457	139136411	/nfs/dbraw/zinc/13/64/11/139136411.db2.gz	JASQQIKSUVIAFJ-DGCLKSJQSA-N	0	1	339.417	1.760	10	5		EDBEMN
CC[C@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])CCN1C[C@@H](C)O	ZINC000174597093	281133139	/nfs/dbraw/zinc/13/31/39/281133139.db2.gz	NCKAXSWFHXOVIS-HIFRSBDPSA-N	0	1	335.404	1.441	10	5		EDBEMN
CCc1nc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])s3)CCO2)n[nH]1	ZINC000173559754	441791008	/nfs/dbraw/zinc/79/10/08/441791008.db2.gz	FGYGAEDPLZBQKI-MRVPVSSYSA-N	0	1	337.361	1.551	10	5		EDBEMN
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000173885902	441855473	/nfs/dbraw/zinc/85/54/73/441855473.db2.gz	KJAQPXMHFMHBSR-JSGCOSHPSA-N	0	1	341.433	1.910	10	5		EDBEMN
Cc1cc(Cl)c(S(=O)(=O)N2CC[C@@H](N(C)C)C2)cc1[N+](=O)[O-]	ZINC000176692731	442247499	/nfs/dbraw/zinc/24/74/99/442247499.db2.gz	BNXJYENETCIDAL-SNVBAGLBSA-N	0	1	347.824	1.881	10	5		EDBEMN
CC[C@@H](NCC(=O)N1CCN(C(C)=O)CC1)c1cccc([N+](=O)[O-])c1	ZINC000181530727	442702164	/nfs/dbraw/zinc/70/21/64/442702164.db2.gz	KTUUKRHLXBAHLS-MRXNPFEDSA-N	0	1	348.403	1.326	10	5		EDBEMN
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCN3CCC[C@H]3C2)c1C	ZINC000247010108	442827493	/nfs/dbraw/zinc/82/74/93/442827493.db2.gz	LDAYTJVSNSLESA-ZDUSSCGKSA-N	0	1	339.417	1.680	10	5		EDBEMN
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCN2CCC[C@H]2C1	ZINC000247651877	442864137	/nfs/dbraw/zinc/86/41/37/442864137.db2.gz	WXTWTSROKWZTCW-LBPRGKRZSA-N	0	1	325.390	1.372	10	5		EDBEMN
O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCN2CCC[C@@H]2C1	ZINC000184464777	443024358	/nfs/dbraw/zinc/02/43/58/443024358.db2.gz	DANJVVBXOSORSN-CYBMUJFWSA-N	0	1	325.390	1.205	10	5		EDBEMN
Cc1cc(S(=O)(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000173882945	231059697	/nfs/dbraw/zinc/05/96/97/231059697.db2.gz	HBSCUIKIGSMCER-GXTWGEPZSA-N	0	1	341.433	1.910	10	5		EDBEMN
CCN(CCO)c1ncnc(Nc2cccnc2Cl)c1[N+](=O)[O-]	ZINC000040617874	213359442	/nfs/dbraw/zinc/35/94/42/213359442.db2.gz	KLWAXPHUBXSCIS-UHFFFAOYSA-N	0	1	338.755	1.995	10	5		EDBEMN
CC[C@@H](O)CN1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1	ZINC000106397027	441338210	/nfs/dbraw/zinc/33/82/10/441338210.db2.gz	OACXCTADQSQTBQ-CDVVCGDMSA-N	0	1	333.388	1.523	10	5		EDBEMN
CCc1nc([C@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3C)CCO2)n[nH]1	ZINC000173556298	441789899	/nfs/dbraw/zinc/78/98/99/441789899.db2.gz	ZWUVDKCPDOSJCW-CYBMUJFWSA-N	0	1	345.359	1.797	10	5		EDBEMN
CCc1nc([C@@H]2CN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000173575137	441797225	/nfs/dbraw/zinc/79/72/25/441797225.db2.gz	JWVXJABPXQGTQW-ZDUSSCGKSA-N	0	1	345.359	1.797	10	5		EDBEMN
Cn1cc([C@H]2CCN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)C2)cn1	ZINC000116229902	441803329	/nfs/dbraw/zinc/80/33/29/441803329.db2.gz	LEQXBQZIDTUMPY-JTQLQIEISA-N	0	1	340.343	1.834	10	5		EDBEMN
Cc1nc([C@@H]2CN(Cc3nc4cc([N+](=O)[O-])ccc4o3)CCO2)n[nH]1	ZINC000177160577	442307545	/nfs/dbraw/zinc/30/75/45/442307545.db2.gz	IVFWPTOFQZVFPI-ZDUSSCGKSA-N	0	1	344.331	1.736	10	5		EDBEMN
CC[C@@H](O)CN1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC1	ZINC000255188335	443089297	/nfs/dbraw/zinc/08/92/97/443089297.db2.gz	OACXCTADQSQTBQ-KQQSKNTNSA-N	0	1	333.388	1.523	10	5		EDBEMN
CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])CC[N@H+]1C[C@H](C)O	ZINC000245733534	443247407	/nfs/dbraw/zinc/24/74/07/443247407.db2.gz	QOFPPEMSFKAMAX-NWDGAFQWSA-N	0	1	337.376	1.218	10	5		EDBEMN
CCc1nc([C@H]2CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000173563875	529701293	/nfs/dbraw/zinc/70/12/93/529701293.db2.gz	GOFAWSHYHBZMNG-CYBMUJFWSA-N	0	1	345.359	1.418	10	5		EDBEMN
C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1Br)c1nn[nH]n1	ZINC000159095731	225145597	/nfs/dbraw/zinc/14/55/97/225145597.db2.gz	YVZKYJDWUYDDQU-YFKPBYRVSA-N	0	1	341.125	1.361	10	5		EDBEMN
CCOc1ccc([N+](=O)[O-])cc1CN1CCO[C@H](c2n[nH]c(C)n2)C1	ZINC000175277025	442031660	/nfs/dbraw/zinc/03/16/60/442031660.db2.gz	VHVLLYIHNXVCNH-HNNXBMFYSA-N	0	1	347.375	1.994	10	5		EDBEMN
CCOCCN1CCN(C(=O)c2[nH]nc(CC)c2[N+](=O)[O-])C[C@H]1C	ZINC000172295551	442437404	/nfs/dbraw/zinc/43/74/04/442437404.db2.gz	ZNPRVUMWORESKF-LLVKDONJSA-N	0	1	339.396	1.063	10	5		EDBEMN
CC[C@@H]1CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CCN1C[C@H](C)O	ZINC000255891821	443113344	/nfs/dbraw/zinc/11/33/44/443113344.db2.gz	ZEUJQBPRFYFKHK-ZJIBPLLGSA-N	0	1	347.415	1.912	10	5		EDBEMN
CC[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CCN1C[C@H](C)O	ZINC000246929310	536113160	/nfs/dbraw/zinc/11/31/60/536113160.db2.gz	RCZACWNVBJAPND-ZFWWWQNUSA-N	0	1	335.404	1.441	10	5		EDBEMN
CC(C)N1C[C@H](C)[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000246042139	139092961	/nfs/dbraw/zinc/09/29/61/139092961.db2.gz	BJLNOFWSALRLPY-GXFFZTMASA-N	0	1	345.396	1.741	10	5		EDBEMN
CCOc1ccc([N+](=O)[O-])cc1CN1CCO[C@@H](c2n[nH]c(C)n2)C1	ZINC000175277055	442031416	/nfs/dbraw/zinc/03/14/16/442031416.db2.gz	VHVLLYIHNXVCNH-OAHLLOKOSA-N	0	1	347.375	1.994	10	5		EDBEMN
CCN1CCC[C@@H](Nc2cc([N+](=O)[O-])ccc2S(N)(=O)=O)C1	ZINC000181439781	442697584	/nfs/dbraw/zinc/69/75/84/442697584.db2.gz	NGIAJLNOIPXIIY-SNVBAGLBSA-N	0	1	328.394	1.138	10	5		EDBEMN
CC[C@H]1CN(C(=O)CCc2cccc([N+](=O)[O-])c2)CCN1C[C@H](C)O	ZINC000246208470	139099317	/nfs/dbraw/zinc/09/93/17/139099317.db2.gz	SAXHBWYCPKVIHH-HOCLYGCPSA-N	0	1	349.431	1.831	10	5		EDBEMN
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCN2CCC[C@H]2C1	ZINC000247469014	139149410	/nfs/dbraw/zinc/14/94/10/139149410.db2.gz	GOIKMQCCURMEPG-LBPRGKRZSA-N	0	1	341.389	1.072	10	5		EDBEMN
CN(CC(=O)N1CCNCC1)Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000262390106	139275581	/nfs/dbraw/zinc/27/55/81/139275581.db2.gz	ZPNJCWBKKABAOQ-UHFFFAOYSA-N	0	1	326.784	1.112	10	5		EDBEMN
CCOCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C[C@H]1C	ZINC000117424335	221061108	/nfs/dbraw/zinc/06/11/08/221061108.db2.gz	SKGDBFXCYMMZNZ-GFCCVEGCSA-N	0	1	337.376	1.483	10	5		EDBEMN
CCOCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C[C@H]1C	ZINC000117424335	221061110	/nfs/dbraw/zinc/06/11/10/221061110.db2.gz	SKGDBFXCYMMZNZ-GFCCVEGCSA-N	0	1	337.376	1.483	10	5		EDBEMN
CCc1nc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)n[nH]1	ZINC000173610775	441803442	/nfs/dbraw/zinc/80/34/42/441803442.db2.gz	RQVXZHZRHPQJOL-GFCCVEGCSA-N	0	1	349.322	1.628	10	5		EDBEMN
Cc1cc(Br)c(NC(=O)[C@H]2CNCCO2)cc1[N+](=O)[O-]	ZINC000169228344	226235639	/nfs/dbraw/zinc/23/56/39/226235639.db2.gz	CKHQWDCSAQZARH-LLVKDONJSA-N	0	1	344.165	1.593	10	5		EDBEMN
CC[C@@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CCN1CCOC	ZINC000173807745	441843424	/nfs/dbraw/zinc/84/34/24/441843424.db2.gz	KPGPYOWBFCYLDS-OAHLLOKOSA-N	0	1	335.404	1.707	10	5		EDBEMN
Cc1nc([C@H]2CN(C(=O)CCc3cccc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000121304946	442201732	/nfs/dbraw/zinc/20/17/32/442201732.db2.gz	APUDNBRGBDZPHI-CQSZACIVSA-N	0	1	345.359	1.554	10	5		EDBEMN
C[C@@H](O)C[N@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1C	ZINC000177054046	442291663	/nfs/dbraw/zinc/29/16/63/442291663.db2.gz	SRJBMINLAYHEOX-NWDGAFQWSA-N	0	1	334.376	1.623	10	5		EDBEMN
C[C@@H](O)CN1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1C	ZINC000177054046	442291666	/nfs/dbraw/zinc/29/16/66/442291666.db2.gz	SRJBMINLAYHEOX-NWDGAFQWSA-N	0	1	334.376	1.623	10	5		EDBEMN
CC[C@@H](O)CN1CCN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1	ZINC000184224304	529228955	/nfs/dbraw/zinc/22/89/55/529228955.db2.gz	AZQDAQWNISBFNB-CYBMUJFWSA-N	0	1	341.383	1.631	10	5		EDBEMN
C[C@@H]1CNC[C@@H](C)N1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000069133692	215361636	/nfs/dbraw/zinc/36/16/36/215361636.db2.gz	ICXSEFCKZMGDHE-RKDXNWHRSA-N	0	1	333.797	1.619	10	5		EDBEMN
Cc1nc([C@H]2CN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000246205041	139099139	/nfs/dbraw/zinc/09/91/39/139099139.db2.gz	BLVGQSOHCZVIRH-ZIAGYGMSSA-N	0	1	333.348	1.128	10	5		EDBEMN
C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000248725813	139173127	/nfs/dbraw/zinc/17/31/27/139173127.db2.gz	JYVZBVJXJAWKAF-YPMHNXCESA-N	0	1	325.390	1.452	10	5		EDBEMN
Cc1nc([C@H]2CN(C(=O)c3cccc(C)c3[N+](=O)[O-])CCO2)n[nH]1	ZINC000173602268	441802186	/nfs/dbraw/zinc/80/21/86/441802186.db2.gz	WXELEBHUZBHFRC-GFCCVEGCSA-N	0	1	331.332	1.543	10	5		EDBEMN
CCc1[nH]nc(C(=O)N2CCC[C@H](Cc3noc(C)n3)C2)c1[N+](=O)[O-]	ZINC000171809444	529465504	/nfs/dbraw/zinc/46/55/04/529465504.db2.gz	SCCIHSOHCARGAC-SNVBAGLBSA-N	0	1	348.363	1.667	10	5		EDBEMN
CCCc1[nH]nc(C(=O)N2CCC[C@H](Cn3cncn3)C2)c1[N+](=O)[O-]	ZINC000126600251	222722785	/nfs/dbraw/zinc/72/27/85/222722785.db2.gz	XEIUPRCLYUEMBL-NSHDSACASA-N	0	1	347.379	1.414	10	5		EDBEMN
CC(C)(C)OC[C@H](O)CN1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000047744811	138123297	/nfs/dbraw/zinc/12/32/97/138123297.db2.gz	SRAGKJBOMBOMCS-MRXNPFEDSA-N	0	1	337.420	1.893	10	5		EDBEMN
COCCN1CCN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000184202068	532967324	/nfs/dbraw/zinc/96/73/24/532967324.db2.gz	HACQAEJCLMHARY-LBPRGKRZSA-N	0	1	341.383	1.895	10	5		EDBEMN
C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1Br)c1nn[nH]n1	ZINC000159095852	533298810	/nfs/dbraw/zinc/29/88/10/533298810.db2.gz	YVZKYJDWUYDDQU-RXMQYKEDSA-N	0	1	341.125	1.361	10	5		EDBEMN
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000113305334	441602118	/nfs/dbraw/zinc/60/21/18/441602118.db2.gz	JASQQIKSUVIAFJ-AAEUAGOBSA-N	0	1	339.417	1.760	10	5		EDBEMN
CCOCCN1CCN(C(=O)c2[nH]nc(CC)c2[N+](=O)[O-])C[C@@H]1C	ZINC000172295554	442437191	/nfs/dbraw/zinc/43/71/91/442437191.db2.gz	ZNPRVUMWORESKF-NSHDSACASA-N	0	1	339.396	1.063	10	5		EDBEMN
C[NH+](C)C[C@H](NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)c1ccccc1	ZINC000186798592	236023924	/nfs/dbraw/zinc/02/39/24/236023924.db2.gz	BRZPRCUXFLVBQM-ZDUSSCGKSA-N	0	1	330.344	1.728	10	5		EDBEMN
CCN1CCC[C@@H]1CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000175396545	442055379	/nfs/dbraw/zinc/05/53/79/442055379.db2.gz	DLIUXAVDCILIPJ-GFCCVEGCSA-N	0	1	345.396	1.839	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)Nc3cccc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000176937050	442275530	/nfs/dbraw/zinc/27/55/30/442275530.db2.gz	GUZHXVGHTGLJEF-LBPRGKRZSA-N	0	1	332.320	1.627	10	5		EDBEMN
O=C(NC1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1)C1CCC1	ZINC000188500199	442756807	/nfs/dbraw/zinc/75/68/07/442756807.db2.gz	OGBRSDQCWNZHOE-UHFFFAOYSA-N	0	1	343.343	1.212	10	5		EDBEMN
Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@H](N(C)C)C1	ZINC000132380530	533819359	/nfs/dbraw/zinc/81/93/59/533819359.db2.gz	HAAWFRJVUJTKCU-JTQLQIEISA-N	0	1	331.369	1.367	10	5		EDBEMN
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC[C@@H](n2cncn2)C1	ZINC000171579712	227149831	/nfs/dbraw/zinc/14/98/31/227149831.db2.gz	VKTOIJLPBRICDR-LLVKDONJSA-N	0	1	341.331	1.540	10	5		EDBEMN
Cc1nc([C@@H]2CN(CCOc3ccc([N+](=O)[O-])cc3)CCO2)n[nH]1	ZINC000173654964	441816214	/nfs/dbraw/zinc/81/62/14/441816214.db2.gz	UWWLWUJRGJYZCC-AWEZNQCLSA-N	0	1	333.348	1.474	10	5		EDBEMN
Cc1cc(S(=O)(=O)N2CCN3CCC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000172021185	442400362	/nfs/dbraw/zinc/40/03/62/442400362.db2.gz	YFAWTRFHBOKGJL-GFCCVEGCSA-N	0	1	325.390	1.372	10	5		EDBEMN
CC[C@@H]1CN(c2c([N+](=O)[O-])c(C)nn2CC)CCN1CCOC	ZINC000192568444	442663909	/nfs/dbraw/zinc/66/39/09/442663909.db2.gz	UDNXTQGIESYGSQ-CYBMUJFWSA-N	0	1	325.413	1.667	10	5		EDBEMN
C[C@H](O)CN1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000248640448	442911181	/nfs/dbraw/zinc/91/11/81/442911181.db2.gz	RFGGXVWWHYFOBI-STQMWFEESA-N	0	1	336.392	1.191	10	5		EDBEMN
Cc1c(NC(=O)C(=O)N2C[C@H]3CCC[N@@H+]3C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000190107405	443057592	/nfs/dbraw/zinc/05/75/92/443057592.db2.gz	XZDBYLIKSYXVSV-WCQYABFASA-N	0	1	346.387	1.537	10	5		EDBEMN
CC[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2[O-])CC[N@H+]1C[C@H](C)O	ZINC000246100529	443267821	/nfs/dbraw/zinc/26/78/21/443267821.db2.gz	LIBAXEDQWCRLPB-RYUDHWBXSA-N	0	1	337.376	1.218	10	5		EDBEMN
CC[C@H]1CN(Cn2nc(C)c([N+](=O)[O-])c2C)CCN1CCOC	ZINC000117323788	595628554	/nfs/dbraw/zinc/62/85/54/595628554.db2.gz	FTTFUOOYECZKQY-AWEZNQCLSA-N	0	1	325.413	1.408	10	5		EDBEMN
CC(C)[C@H](NCc1ccc(Br)c([N+](=O)[O-])c1)C(N)=O	ZINC000223951253	539865627	/nfs/dbraw/zinc/86/56/27/539865627.db2.gz	RVTFOGMJHQAQRW-NSHDSACASA-N	0	1	330.182	1.957	10	5		EDBEMN
CN(C[C@@H]1CCCN(C)C1)c1ccc([N+](=O)[O-])c(S(C)(=O)=O)c1	ZINC000125203298	441997084	/nfs/dbraw/zinc/99/70/84/441997084.db2.gz	ZJEWKFCAEGXTBA-GFCCVEGCSA-N	0	1	341.433	1.776	10	5		EDBEMN
CCN1CCC[C@@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1	ZINC000194150743	442852459	/nfs/dbraw/zinc/85/24/59/442852459.db2.gz	AFYGLLPEOOHLQO-GFCCVEGCSA-N	0	1	334.376	1.442	10	5		EDBEMN
CC[C@H](NCc1cc(=O)n(C)c(=O)n1C)c1cccc([N+](=O)[O-])c1	ZINC000181537468	529623923	/nfs/dbraw/zinc/62/39/23/529623923.db2.gz	QCEVJCLYFPRPGG-AWEZNQCLSA-N	0	1	332.360	1.233	10	5		EDBEMN
COc1c(F)cc(S(=O)(=O)N2CC[C@@H](N(C)C)C2)cc1[N+](=O)[O-]	ZINC000186895783	236056911	/nfs/dbraw/zinc/05/69/11/236056911.db2.gz	WSPAFOVJONRPFQ-SECBINFHSA-N	0	1	347.368	1.067	10	5		EDBEMN
C[C@H](CN(C)C)NS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)s1	ZINC000168703164	226221518	/nfs/dbraw/zinc/22/15/18/226221518.db2.gz	QTAIYJUPGPPTJY-ZCFIWIBFSA-N	0	1	327.815	1.538	10	5		EDBEMN
CCc1nc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])cnc3C)CCO2)n[nH]1	ZINC000173565574	441794508	/nfs/dbraw/zinc/79/45/08/441794508.db2.gz	UYGCXTUDDVDPHR-LBPRGKRZSA-N	0	1	346.347	1.192	10	5		EDBEMN
CC[C@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CCN1CCOC	ZINC000173807756	441843237	/nfs/dbraw/zinc/84/32/37/441843237.db2.gz	KPGPYOWBFCYLDS-HNNXBMFYSA-N	0	1	335.404	1.707	10	5		EDBEMN
Cc1c(Br)c(N[C@@H](C)c2nn[nH]n2)ncc1[N+](=O)[O-]	ZINC000165752193	533707240	/nfs/dbraw/zinc/70/72/40/533707240.db2.gz	CRPVHVPWDAICKF-YFKPBYRVSA-N	0	1	328.130	1.747	10	5		EDBEMN
CCc1nc([C@H]2CN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000173564586	441794454	/nfs/dbraw/zinc/79/44/54/441794454.db2.gz	WZKMVUMVDMFPPT-CYBMUJFWSA-N	0	1	345.359	1.797	10	5		EDBEMN
CCOCC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2[O-])C[C@H]1C	ZINC000152218546	442183237	/nfs/dbraw/zinc/18/32/37/442183237.db2.gz	LIQSBJBMDJQIMA-GFCCVEGCSA-N	0	1	337.376	1.483	10	5		EDBEMN
CCOCC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2[O-])C[C@H]1C	ZINC000152218546	442183240	/nfs/dbraw/zinc/18/32/40/442183240.db2.gz	LIQSBJBMDJQIMA-GFCCVEGCSA-N	0	1	337.376	1.483	10	5		EDBEMN
CCOC(=O)c1cc(C(=O)N[C@@H]2CCCN(CC)C2)cc([N+](=O)[O-])c1	ZINC000194627671	442926938	/nfs/dbraw/zinc/92/69/38/442926938.db2.gz	VUDXJWIXNLCNMW-CQSZACIVSA-N	0	1	349.387	1.986	10	5		EDBEMN
COC(=O)Cc1c(C)[nH]n(-c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1=O	ZINC000536955094	448548598	/nfs/dbraw/zinc/54/85/98/448548598.db2.gz	SYNVGWZOCYFILR-UHFFFAOYSA-N	0	1	336.260	1.006	10	5		EDBEMN
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCN2CCC[C@H]2C1	ZINC000247485106	139150275	/nfs/dbraw/zinc/15/02/75/139150275.db2.gz	KMSMFTKOULLZMS-LBPRGKRZSA-N	0	1	325.390	1.372	10	5		EDBEMN
COc1ccc([N+](=O)[O-])cc1CN1CCO[C@@H](c2n[nH]c(C)n2)C1	ZINC000173672727	533218281	/nfs/dbraw/zinc/21/82/81/533218281.db2.gz	XRWTXXSYWJGGIS-CQSZACIVSA-N	0	1	333.348	1.603	10	5		EDBEMN
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000113305557	441601563	/nfs/dbraw/zinc/60/15/63/441601563.db2.gz	VAXPHXHOOVIRMM-GXTWGEPZSA-N	0	1	339.417	1.760	10	5		EDBEMN
O=C(N[C@H]1CCCn2ncnc21)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000176133516	442180477	/nfs/dbraw/zinc/18/04/77/442180477.db2.gz	OCRBHSRAVXPKHW-NSHDSACASA-N	0	1	327.304	1.328	10	5		EDBEMN
C[C@H](O)CN1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000246926487	442822280	/nfs/dbraw/zinc/82/22/80/442822280.db2.gz	ZCYQVBQWKMFAJL-NSDHSQQOSA-N	0	1	333.388	1.522	10	5		EDBEMN
CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000190357892	443091353	/nfs/dbraw/zinc/09/13/53/443091353.db2.gz	FRPBVDOODDWFRK-UKRRQHHQSA-N	0	1	346.387	1.619	10	5		EDBEMN
O=[N+]([O-])c1cc(S(=O)(=O)[N-]CC[C@H]2CCC[NH2+]2)sc1Cl	ZINC000166799231	534880808	/nfs/dbraw/zinc/88/08/08/534880808.db2.gz	SJYAQOAQSIVCKM-SSDOTTSWSA-N	0	1	339.826	1.730	10	5		EDBEMN
C[C@@H]1CNC[C@H](C)N1S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl	ZINC000069133687	202269346	/nfs/dbraw/zinc/26/93/46/202269346.db2.gz	BYBRFZDOFXWCTL-DTORHVGOSA-N	0	1	333.797	1.619	10	5		EDBEMN
COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCN2CCCC[C@H]2C1	ZINC000105168812	204136446	/nfs/dbraw/zinc/13/64/46/204136446.db2.gz	BAGHJZCMYOQOIF-HNNXBMFYSA-N	0	1	348.403	1.983	10	5		EDBEMN
Cn1cnc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2F)c1Cl	ZINC000043474394	204274773	/nfs/dbraw/zinc/27/47/73/204274773.db2.gz	QUBCOBJMTRJGMQ-UHFFFAOYSA-N	0	1	334.716	1.922	10	5		EDBEMN
COc1ccc(S(=O)(=O)N2CCN3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000247651571	139153424	/nfs/dbraw/zinc/15/34/24/139153424.db2.gz	WTHWBEKSRDCPEQ-NSHDSACASA-N	0	1	341.389	1.072	10	5		EDBEMN
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000113305657	441601255	/nfs/dbraw/zinc/60/12/55/441601255.db2.gz	NPKSJDBPLDSAIY-QWHCGFSZSA-N	0	1	339.417	1.760	10	5		EDBEMN
CCc1nc([C@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000173566154	441794618	/nfs/dbraw/zinc/79/46/18/441794618.db2.gz	LOUWVZMRZRMNOX-GFCCVEGCSA-N	0	1	331.332	1.489	10	5		EDBEMN
Cc1nc([C@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])cc3)CCO2)n[nH]1	ZINC000175997170	442159673	/nfs/dbraw/zinc/15/96/73/442159673.db2.gz	ULEDUDFMZYSTSQ-GFCCVEGCSA-N	0	1	332.320	1.627	10	5		EDBEMN
CC[C@@H]1CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CCN1C[C@@H](C)O	ZINC000255891820	443112998	/nfs/dbraw/zinc/11/29/98/443112998.db2.gz	ZEUJQBPRFYFKHK-YRPJOXRESA-N	0	1	347.415	1.912	10	5		EDBEMN
CN(C)C(=O)CCNCc1ccc([N+](=O)[O-])cc1Br	ZINC000044992294	204310921	/nfs/dbraw/zinc/31/09/21/204310921.db2.gz	JRFJUFRFFUVGJH-UHFFFAOYSA-N	0	1	330.182	1.925	10	5		EDBEMN
CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC[N@@H+]1CCOC	ZINC000117425762	221062207	/nfs/dbraw/zinc/06/22/07/221062207.db2.gz	WUGFVEIPSFGXBY-CYBMUJFWSA-N	0	1	337.376	1.483	10	5		EDBEMN
CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC[N@H+]1CCOC	ZINC000117425762	221062208	/nfs/dbraw/zinc/06/22/08/221062208.db2.gz	WUGFVEIPSFGXBY-CYBMUJFWSA-N	0	1	337.376	1.483	10	5		EDBEMN
CNC(=O)CN1CCC(CN(C)c2ccc([N+](=O)[O-])cc2C)CC1	ZINC000080657168	441187635	/nfs/dbraw/zinc/18/76/35/441187635.db2.gz	QGGKOOFHLXJWKV-UHFFFAOYSA-N	0	1	334.420	1.797	10	5		EDBEMN
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NC[C@@H]1CCCC[C@@H]1O	ZINC000121352568	442206267	/nfs/dbraw/zinc/20/62/67/442206267.db2.gz	HKCVRTLQMKYFTF-CABZTGNLSA-N	0	1	332.353	1.563	10	5		EDBEMN
Cn1cc(CN2CCCN(c3cc(N)ccc3[N+](=O)[O-])CC2)cn1	ZINC000193413330	442740716	/nfs/dbraw/zinc/74/07/16/442740716.db2.gz	JYAHTHRLZLQDLR-UHFFFAOYSA-N	0	1	330.392	1.623	10	5		EDBEMN
CC(C)C[C@@H](CN(C)C)NS(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000189137171	442883918	/nfs/dbraw/zinc/88/39/18/442883918.db2.gz	GQRDQLMPZHJZNU-AWEZNQCLSA-N	0	1	343.449	1.991	10	5		EDBEMN
CCOc1c(OC)cc(C[C@@H]2[C@H](O)C3CCN2CC3)cc1[N+](=O)[O-]	ZINC000169961376	206566651	/nfs/dbraw/zinc/56/66/51/206566651.db2.gz	LOKSTQRDNSCWMQ-CZUORRHYSA-N	0	1	336.388	2.000	10	5		EDBEMN
Cc1nc([C@H]2CN(CC(=O)Nc3ccccc3[N+](=O)[O-])CCO2)n[nH]1	ZINC000173662900	441817385	/nfs/dbraw/zinc/81/73/85/441817385.db2.gz	PPMHVPIQSHPUOO-CYBMUJFWSA-N	0	1	346.347	1.033	10	5		EDBEMN
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000173885888	534347243	/nfs/dbraw/zinc/34/72/43/534347243.db2.gz	KJAQPXMHFMHBSR-GXTWGEPZSA-N	0	1	341.433	1.910	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)c3cc(C)cc([N+](=O)[O-])c3N)CCO2)n[nH]1	ZINC000173755776	231024732	/nfs/dbraw/zinc/02/47/32/231024732.db2.gz	QUTMMTKHHRWKFQ-LBPRGKRZSA-N	0	1	346.347	1.126	10	5		EDBEMN
C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000247480675	139149922	/nfs/dbraw/zinc/14/99/22/139149922.db2.gz	SPZFWMQDDLAJIS-YPMHNXCESA-N	0	1	325.390	1.452	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)Cc3ccccc3[N+](=O)[O-])CCO2)n[nH]1	ZINC000173528209	441779458	/nfs/dbraw/zinc/77/94/58/441779458.db2.gz	ZVAHTFHTZUWBPV-ZDUSSCGKSA-N	0	1	331.332	1.164	10	5		EDBEMN
Cc1nc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CCO2)n[nH]1	ZINC000173606784	441803464	/nfs/dbraw/zinc/80/34/64/441803464.db2.gz	ACKFQYPADPXUPG-CYBMUJFWSA-N	0	1	331.332	1.543	10	5		EDBEMN
CS(=O)(=O)c1cc(N2CC[C@@H](N3CCCC3)C2)ccc1[N+](=O)[O-]	ZINC000124514868	441932831	/nfs/dbraw/zinc/93/28/31/441932831.db2.gz	QFXYGGAUKYJPIR-CYBMUJFWSA-N	0	1	339.417	1.673	10	5		EDBEMN
CCOCC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])C[C@H]1C	ZINC000182026632	442729331	/nfs/dbraw/zinc/72/93/31/442729331.db2.gz	PHSDICQEPIUQFJ-GFCCVEGCSA-N	0	1	337.376	1.483	10	5		EDBEMN
CCOCC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])C[C@H]1C	ZINC000182026632	442729332	/nfs/dbraw/zinc/72/93/32/442729332.db2.gz	PHSDICQEPIUQFJ-GFCCVEGCSA-N	0	1	337.376	1.483	10	5		EDBEMN
CC(C)C[C@H](CN(C)C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000193882515	318586647	/nfs/dbraw/zinc/58/66/47/318586647.db2.gz	ORGVOJDVCDCNRC-LLVKDONJSA-N	0	1	347.412	1.989	10	5		EDBEMN
CC(C)N1C[C@H](C)[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000246182888	443276713	/nfs/dbraw/zinc/27/67/13/443276713.db2.gz	NLCYZTPUCOWNQU-SMDDNHRTSA-N	0	1	327.406	1.602	10	5		EDBEMN
O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N1CCN2CCC[C@@H]2C1	ZINC000171770464	534878932	/nfs/dbraw/zinc/87/89/32/534878932.db2.gz	UBKGGDAYLAGGHY-SNVBAGLBSA-N	0	1	329.353	1.203	10	5		EDBEMN
CN(C)[C@H]1CCN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000170873501	282264375	/nfs/dbraw/zinc/26/43/75/282264375.db2.gz	HUECCOXUAMXITH-JTQLQIEISA-N	0	1	333.797	1.573	10	5		EDBEMN
CNCc1nnnn1-c1cc([N+](=O)[O-])c(C)cc1Br	ZINC000169259330	530011361	/nfs/dbraw/zinc/01/13/61/530011361.db2.gz	QJJJZNUFVUOUAM-UHFFFAOYSA-N	0	1	327.142	1.361	10	5		EDBEMN
Cc1ccc(S(=O)(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000113305605	441601756	/nfs/dbraw/zinc/60/17/56/441601756.db2.gz	UPQZNQCJVRFIRB-STQMWFEESA-N	0	1	339.417	1.760	10	5		EDBEMN
CCOCCN1CCN(c2c([N+](=O)[O-])c(CC)nn2C)C[C@H]1CC	ZINC000129172570	442304658	/nfs/dbraw/zinc/30/46/58/442304658.db2.gz	XSXRJZKYJLYZON-CYBMUJFWSA-N	0	1	339.440	1.828	10	5		EDBEMN
O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN3CCC[C@@H]3C2)c(F)c1	ZINC000171770774	442380044	/nfs/dbraw/zinc/38/00/44/442380044.db2.gz	WASOFMDBKLUWPM-LLVKDONJSA-N	0	1	329.353	1.203	10	5		EDBEMN
CCc1nc([C@H]2CN(C(=O)Nc3cccc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000178012840	442401565	/nfs/dbraw/zinc/40/15/65/442401565.db2.gz	SAVLTAVPJCCALA-GFCCVEGCSA-N	0	1	346.347	1.881	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)c3ccc(F)cc3[N+](=O)[O-])CCO2)n[nH]1	ZINC000134427695	442481234	/nfs/dbraw/zinc/48/12/34/442481234.db2.gz	KHHBIFDQHNLDNO-LBPRGKRZSA-N	0	1	335.295	1.374	10	5		EDBEMN
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CCN3CCC[C@H]3C2)cc1C	ZINC000247501184	442857766	/nfs/dbraw/zinc/85/77/66/442857766.db2.gz	NNWVTFUABFNKLQ-ZDUSSCGKSA-N	0	1	339.417	1.680	10	5		EDBEMN
NC(=O)c1ccc(CN2CCC[C@H](Cn3cncn3)C2)c([N+](=O)[O-])c1	ZINC000105883749	204176679	/nfs/dbraw/zinc/17/66/79/204176679.db2.gz	IZBIYTPDSCVUTQ-LBPRGKRZSA-N	0	1	344.375	1.197	10	5		EDBEMN
CCCc1[nH]nc(C(=O)N2CCC[C@@H](Cn3cncn3)C2)c1[N+](=O)[O-]	ZINC000126600455	205063551	/nfs/dbraw/zinc/06/35/51/205063551.db2.gz	XEIUPRCLYUEMBL-LLVKDONJSA-N	0	1	347.379	1.414	10	5		EDBEMN
CC[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CCN1C[C@@H](C)O	ZINC000174590557	207036141	/nfs/dbraw/zinc/03/61/41/207036141.db2.gz	RCZACWNVBJAPND-UKRRQHHQSA-N	0	1	335.404	1.441	10	5		EDBEMN
CCN1CCC[C@H](NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000194148781	273000760	/nfs/dbraw/zinc/00/07/60/273000760.db2.gz	ODJKVRJEIRKBBW-ZDUSSCGKSA-N	0	1	334.376	1.442	10	5		EDBEMN
Cc1c(NC(=O)[C@@H](C)NC[C@H]2CN(C)CCO2)cccc1[N+](=O)[O-]	ZINC000112548886	441550327	/nfs/dbraw/zinc/55/03/27/441550327.db2.gz	CVJDDJRVFRCDKF-OLZOCXBDSA-N	0	1	336.392	1.150	10	5		EDBEMN
CC(C)(C)OC(=O)NC[C@@H]1CCCN1CCn1cc([N+](=O)[O-])cn1	ZINC000174879793	441978949	/nfs/dbraw/zinc/97/89/49/441978949.db2.gz	NGMBWLRQGWAGKZ-LBPRGKRZSA-N	0	1	339.396	1.780	10	5		EDBEMN
CCc1nc([C@@H]2CN(c3c([N+](=O)[O-])c(C)nn3CC)CCO2)n[nH]1	ZINC000192693244	442677657	/nfs/dbraw/zinc/67/76/57/442677657.db2.gz	SSWMROGQUNQTGE-JTQLQIEISA-N	0	1	335.368	1.378	10	5		EDBEMN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCCNC(=O)[C@@H]1C	ZINC000189263567	442908371	/nfs/dbraw/zinc/90/83/71/442908371.db2.gz	WORMRIGCWBVRPE-LBPRGKRZSA-N	0	1	334.376	1.442	10	5		EDBEMN
C[C@@H](O)CN1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000185774340	443255227	/nfs/dbraw/zinc/25/52/27/443255227.db2.gz	RFGGXVWWHYFOBI-QWHCGFSZSA-N	0	1	336.392	1.191	10	5		EDBEMN
O=C1NC(=O)c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc21	ZINC000020503334	202046900	/nfs/dbraw/zinc/04/69/00/202046900.db2.gz	SRZMPWXBGKAYDO-UHFFFAOYSA-N	0	1	347.308	1.279	10	5		EDBEMN
Cc1nc2n(n1)CCC[C@@H]2NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000176293113	207213370	/nfs/dbraw/zinc/21/33/70/207213370.db2.gz	FQVNDYQVXYFCSM-LBPRGKRZSA-N	0	1	341.331	1.636	10	5		EDBEMN
COc1ccc([N+](=O)[O-])cc1CN1C[C@@H](C)[C@@H](N2CCOCC2)C1	ZINC000177281517	207315494	/nfs/dbraw/zinc/31/54/94/207315494.db2.gz	DULPDYREKZRRPS-CJNGLKHVSA-N	0	1	335.404	1.756	10	5		EDBEMN
CCc1nc([C@H]2CN(C(=O)c3ccccc3[N+](=O)[O-])CCO2)n[nH]1	ZINC000173610925	441803979	/nfs/dbraw/zinc/80/39/79/441803979.db2.gz	IYYYOTLPGFIHDU-GFCCVEGCSA-N	0	1	331.332	1.489	10	5		EDBEMN
CC(C)(C)OC(=O)NC[C@H]1CCCN1CCn1ccc([N+](=O)[O-])n1	ZINC000176271350	442202541	/nfs/dbraw/zinc/20/25/41/442202541.db2.gz	PWUTVFNLQBGWNQ-GFCCVEGCSA-N	0	1	339.396	1.780	10	5		EDBEMN
[NH3+]C[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000238018223	295255851	/nfs/dbraw/zinc/25/58/51/295255851.db2.gz	RSSPZISHHOOCMO-WPRPVWTQSA-N	0	1	333.797	1.654	10	5		EDBEMN
Cn1cc([C@@H]2CCC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])cn1	ZINC000182231756	442747968	/nfs/dbraw/zinc/74/79/68/442747968.db2.gz	GNJGWUSGBIRRHT-GJZGRUSLSA-N	0	1	346.387	1.905	10	5		EDBEMN
Cn1cc([C@@H]2CCCN2C[C@H](O)COc2ccccc2[N+](=O)[O-])cn1	ZINC000182231756	442747971	/nfs/dbraw/zinc/74/79/71/442747971.db2.gz	GNJGWUSGBIRRHT-GJZGRUSLSA-N	0	1	346.387	1.905	10	5		EDBEMN
O=C1NCCC[C@@H]1NCc1ccc(Br)c([N+](=O)[O-])c1	ZINC000050395137	214056027	/nfs/dbraw/zinc/05/60/27/214056027.db2.gz	UVVLMURABHHNCN-JTQLQIEISA-N	0	1	328.166	1.726	10	5		EDBEMN
CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000173725823	529408236	/nfs/dbraw/zinc/40/82/36/529408236.db2.gz	QDQCBCQBTRQKTQ-GHMZBOCLSA-N	0	1	345.446	1.904	10	5		EDBEMN
CCc1ccc(C(=O)N2CCO[C@H](c3n[nH]c(C)n3)C2)cc1[N+](=O)[O-]	ZINC000174341615	529599169	/nfs/dbraw/zinc/59/91/69/529599169.db2.gz	DRVOOZXVGQOQND-AWEZNQCLSA-N	0	1	345.359	1.797	10	5		EDBEMN
CCc1nn(C)c(N2CCN(CCOC)[C@H](CC)C2)c1[N+](=O)[O-]	ZINC000129171344	138624304	/nfs/dbraw/zinc/62/43/04/138624304.db2.gz	ZKEWKNHGYXPKBQ-GFCCVEGCSA-N	0	1	325.413	1.438	10	5		EDBEMN
Cc1cc(S(=O)(=O)N2CCN3CCC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000247330502	139145287	/nfs/dbraw/zinc/14/52/87/139145287.db2.gz	YFAWTRFHBOKGJL-LBPRGKRZSA-N	0	1	325.390	1.372	10	5		EDBEMN
O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N1CCN2CCC[C@@H]2C1	ZINC000171770977	285117558	/nfs/dbraw/zinc/11/75/58/285117558.db2.gz	VQXJEBDQDQOQEA-LLVKDONJSA-N	0	1	345.808	1.717	10	5		EDBEMN
CC[C@H]1CN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CCN1CCOC	ZINC000174736950	441961916	/nfs/dbraw/zinc/96/19/16/441961916.db2.gz	OGWYEAGVOMXNDK-ZDUSSCGKSA-N	0	1	336.392	1.241	10	5		EDBEMN
CC(C)N1C[C@H](C)[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000246912494	139126652	/nfs/dbraw/zinc/12/66/52/139126652.db2.gz	IJVJDEDWWBYBQK-NWDGAFQWSA-N	0	1	327.406	1.602	10	5		EDBEMN
O=[N+]([O-])c1c(F)cccc1S(=O)(=O)[N-]CC[C@@H]1CCC[NH2+]C1	ZINC000123844838	222340577	/nfs/dbraw/zinc/34/05/77/222340577.db2.gz	JZWXFTYZGNEQET-JTQLQIEISA-N	0	1	331.369	1.402	10	5		EDBEMN
C[C@@H](O)CN1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C[C@H]1C	ZINC000105790651	274270973	/nfs/dbraw/zinc/27/09/73/274270973.db2.gz	IAVGTNAKMDODFE-VXGBXAGGSA-N	0	1	348.403	1.371	10	5		EDBEMN
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CCN3CCC[C@@H]3C2)c1C	ZINC000171770582	442379999	/nfs/dbraw/zinc/37/99/99/442379999.db2.gz	YLVCZPXMFMEKAT-CYBMUJFWSA-N	0	1	339.417	1.680	10	5		EDBEMN
CC[C@@H](O)CN1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000193923770	442812997	/nfs/dbraw/zinc/81/29/97/442812997.db2.gz	ZZOOCUVPTUSYRC-CQSZACIVSA-N	0	1	338.364	1.392	10	5		EDBEMN
CC[C@@H](NCC(=O)NCC(=O)N1CCCC1)c1cccc([N+](=O)[O-])c1	ZINC000181542278	529154660	/nfs/dbraw/zinc/15/46/60/529154660.db2.gz	LTDIXZYNRCWUBC-OAHLLOKOSA-N	0	1	348.403	1.374	10	5		EDBEMN
COc1ccc(NC(=O)CN2CCN3CCCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000246173732	536767191	/nfs/dbraw/zinc/76/71/91/536767191.db2.gz	JOOSXURSJXFIES-ZDUSSCGKSA-N	0	1	348.403	1.712	10	5		EDBEMN
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000247073238	139134272	/nfs/dbraw/zinc/13/42/72/139134272.db2.gz	HOUNXIVBUKKOFR-OCCSQVGLSA-N	0	1	339.417	1.760	10	5		EDBEMN
Cc1nc([C@H]2CN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000173529953	441780620	/nfs/dbraw/zinc/78/06/20/441780620.db2.gz	RWYDQPVSWNDGAR-CYBMUJFWSA-N	0	1	331.332	1.543	10	5		EDBEMN
C[C@H]1[NH2+]CCC[C@H]1[N-]S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000193451674	291193568	/nfs/dbraw/zinc/19/35/68/291193568.db2.gz	FHUTXKFIGCKKRR-PSASIEDQSA-N	0	1	333.797	1.667	10	5		EDBEMN
CCCCOC[C@@H](O)CN1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000193372260	272991775	/nfs/dbraw/zinc/99/17/75/272991775.db2.gz	VYXFCWLHIOYLPD-KRWDZBQOSA-N	0	1	337.420	1.894	10	5		EDBEMN
O=[N+]([O-])c1cccc([C@@H](O)CN2CCC(Nc3cccnn3)CC2)c1	ZINC000137039529	441742176	/nfs/dbraw/zinc/74/21/76/441742176.db2.gz	YNDVFEZVVFVFJM-INIZCTEOSA-N	0	1	343.387	1.995	10	5		EDBEMN
CCc1nc([C@H]2CN(C(=O)c3cccc(C)c3[N+](=O)[O-])CCO2)n[nH]1	ZINC000173609605	441803274	/nfs/dbraw/zinc/80/32/74/441803274.db2.gz	FOMZUDVMIODNSP-GFCCVEGCSA-N	0	1	345.359	1.797	10	5		EDBEMN
CN(c1cccnn1)C1CCN(CCn2ccc([N+](=O)[O-])n2)CC1	ZINC000176232141	442196969	/nfs/dbraw/zinc/19/69/69/442196969.db2.gz	JHFWCFHEVBLUMU-UHFFFAOYSA-N	0	1	331.380	1.182	10	5		EDBEMN
O=C(CN1CCN2CCCC[C@@H]2C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000177780503	442383281	/nfs/dbraw/zinc/38/32/81/442383281.db2.gz	QGUCOIWEKKAATQ-MRXNPFEDSA-N	0	1	344.415	1.654	10	5		EDBEMN
COc1cccc(CN[C@@H](CO)[C@@H](O)c2ccc([N+](=O)[O-])cc2)n1	ZINC000237231462	139045195	/nfs/dbraw/zinc/04/51/95/139045195.db2.gz	BFCBBWQIAGSLAK-HOCLYGCPSA-N	0	1	333.344	1.183	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)CCc3cccc([N+](=O)[O-])c3)CCO2)n[nH]1	ZINC000121304786	221810702	/nfs/dbraw/zinc/81/07/02/221810702.db2.gz	APUDNBRGBDZPHI-AWEZNQCLSA-N	0	1	345.359	1.554	10	5		EDBEMN
C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1cccc(-n2ccnc2)c1	ZINC000123101305	222215593	/nfs/dbraw/zinc/21/55/93/222215593.db2.gz	CNEUBKKIJYFEFH-SNVBAGLBSA-N	0	1	326.316	1.995	10	5		EDBEMN
C[C@@H](NC(=O)c1[n-]ncc1[N+](=O)[O-])c1cccc(-n2cc[nH+]c2)c1	ZINC000123101305	222215594	/nfs/dbraw/zinc/21/55/94/222215594.db2.gz	CNEUBKKIJYFEFH-SNVBAGLBSA-N	0	1	326.316	1.995	10	5		EDBEMN
CCc1nc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])s3)CCO2)n[nH]1	ZINC000173559696	441791425	/nfs/dbraw/zinc/79/14/25/441791425.db2.gz	FGYGAEDPLZBQKI-QMMMGPOBSA-N	0	1	337.361	1.551	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])cc3C)CCO2)n[nH]1	ZINC000162785038	442122815	/nfs/dbraw/zinc/12/28/15/442122815.db2.gz	SSEIGJJVXNSIMB-ZDUSSCGKSA-N	0	1	346.347	1.935	10	5		EDBEMN
CC(C)(C)OC(=O)NC[C@@H]1CCCN1CCn1ccc([N+](=O)[O-])n1	ZINC000176271337	442202914	/nfs/dbraw/zinc/20/29/14/442202914.db2.gz	PWUTVFNLQBGWNQ-LBPRGKRZSA-N	0	1	339.396	1.780	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])cc3)CCO2)n[nH]1	ZINC000175997152	442159632	/nfs/dbraw/zinc/15/96/32/442159632.db2.gz	ULEDUDFMZYSTSQ-LBPRGKRZSA-N	0	1	332.320	1.627	10	5		EDBEMN
CCN1CCC[C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000194153569	442852662	/nfs/dbraw/zinc/85/26/62/442852662.db2.gz	YKGHSBSZQVZCER-LBPRGKRZSA-N	0	1	334.376	1.442	10	5		EDBEMN
COc1cccc(CN[C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)n1	ZINC000237237182	139045286	/nfs/dbraw/zinc/04/52/86/139045286.db2.gz	BFCBBWQIAGSLAK-GDBMZVCRSA-N	0	1	333.344	1.183	10	5		EDBEMN
Cc1nc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CCO2)n[nH]1	ZINC000173606773	441804176	/nfs/dbraw/zinc/80/41/76/441804176.db2.gz	ACKFQYPADPXUPG-ZDUSSCGKSA-N	0	1	331.332	1.543	10	5		EDBEMN
Cc1nc([C@H]2CN(Cc3nc4cc([N+](=O)[O-])ccc4o3)CCO2)n[nH]1	ZINC000177160593	442307215	/nfs/dbraw/zinc/30/72/15/442307215.db2.gz	IVFWPTOFQZVFPI-CYBMUJFWSA-N	0	1	344.331	1.736	10	5		EDBEMN