smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1[nH+]ccn1CCCNS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000071909104	203146277	/nfs/dbraw/zinc/14/62/77/203146277.db2.gz	UUVYXWZIEKGTJD-UHFFFAOYSA-N	1	1	338.389	1.777	50	5		EDBAMO
C[NH+]1CCN(c2nc(N)c([N+](=O)[O-])c(Nc3cccc(F)c3)n2)CC1	ZINC000005025312	440935950	/nfs/dbraw/zinc/93/59/50/440935950.db2.gz	ZDCXUOHWOXGDNF-UHFFFAOYSA-N	1	1	347.354	1.602	50	5		EDBAMO
CC(C)NC(=O)C[NH+]1CCC(NC(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000047342444	441177645	/nfs/dbraw/zinc/17/76/45/441177645.db2.gz	XPDIPBCBJRNGSQ-UHFFFAOYSA-N	1	1	348.403	1.314	50	5		EDBAMO
Cc1cc(S(=O)(=O)N(C)[C@H]2CC[N@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000110625573	441519448	/nfs/dbraw/zinc/51/94/48/441519448.db2.gz	JAFOOYAQBSZXKN-OCCSQVGLSA-N	1	1	341.433	1.864	50	5		EDBAMO
Cc1[nH+]ccn1C[C@@H]1CCCN1c1ccc2ncc([N+](=O)[O-])n2n1	ZINC000225597322	443115141	/nfs/dbraw/zinc/11/51/41/443115141.db2.gz	HQESYUIWBTULNV-LBPRGKRZSA-N	1	1	327.348	1.811	50	5		EDBAMO
C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000025127619	202126840	/nfs/dbraw/zinc/12/68/40/202126840.db2.gz	UZBIZWUEEMUNPD-MELADBBJSA-N	1	1	335.404	1.751	50	5		EDBAMO
C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000025127619	202126842	/nfs/dbraw/zinc/12/68/42/202126842.db2.gz	UZBIZWUEEMUNPD-MELADBBJSA-N	1	1	335.404	1.751	50	5		EDBAMO
CC[NH+]1CCN(c2cc(N3CCOCC3)c(F)cc2[N+](=O)[O-])CC1	ZINC000004168657	273666153	/nfs/dbraw/zinc/66/61/53/273666153.db2.gz	MRNPPYYGIPYPJD-UHFFFAOYSA-N	1	1	338.383	1.712	50	5		EDBAMO
C[NH+](C)[C@H](CNC(=O)COc1ccccc1[N+](=O)[O-])c1ccco1	ZINC000008917186	441101806	/nfs/dbraw/zinc/10/18/06/441101806.db2.gz	HVGVLZCJURTTPO-CYBMUJFWSA-N	1	1	333.344	1.986	50	5		EDBAMO
CC[N@H+]1CCC[C@@H]1CNc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000015164203	441197119	/nfs/dbraw/zinc/19/71/19/441197119.db2.gz	GUAYITUENNUSDH-LLVKDONJSA-N	1	1	342.421	1.399	50	5		EDBAMO
Nc1ccc(N2CCN(c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC2)c[nH+]1	ZINC000069810087	442046337	/nfs/dbraw/zinc/04/63/37/442046337.db2.gz	KNLOURUWSXFGBO-UHFFFAOYSA-N	1	1	344.331	1.807	50	5		EDBAMO
CCN(CC)C(=O)C[NH+]1CCC(Nc2ncccc2[N+](=O)[O-])CC1	ZINC000585092239	448673976	/nfs/dbraw/zinc/67/39/76/448673976.db2.gz	KUNJHMWHESZRKC-UHFFFAOYSA-N	1	1	335.408	1.735	50	5		EDBAMO
Cc1cc(N2CCC(NC(=O)c3[nH]ncc3[N+](=O)[O-])CC2)nc(C)[nH+]1	ZINC000133157977	205357768	/nfs/dbraw/zinc/35/77/68/205357768.db2.gz	SBCKOHSSDVKZHW-UHFFFAOYSA-N	1	1	345.363	1.124	50	5		EDBAMO
COCC[N@@H+]1[C@H](C)CN(c2ccc3ncc([N+](=O)[O-])n3n2)C[C@@H]1C	ZINC000096489047	218865509	/nfs/dbraw/zinc/86/55/09/218865509.db2.gz	LDSKALOQSTZQDA-TXEJJXNPSA-N	1	1	334.380	1.183	50	5		EDBAMO
CC[N@H+]1CCCC[C@H]1CNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000095433784	441926795	/nfs/dbraw/zinc/92/67/95/441926795.db2.gz	RKDQPJLYUIYFPW-HNNXBMFYSA-N	1	1	341.433	1.889	50	5		EDBAMO
C[N@H+]1CCC[C@@H](CNS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000096001960	441976340	/nfs/dbraw/zinc/97/63/40/441976340.db2.gz	IBMZBJYQPHFAOF-AWEZNQCLSA-N	1	1	341.433	1.399	50	5		EDBAMO
CC[N@H+]1CCCC[C@@H]1CNc1cc(S(N)(=O)=O)ccc1[N+](=O)[O-]	ZINC000585092883	448674186	/nfs/dbraw/zinc/67/41/86/448674186.db2.gz	SEXNMVBZERXSHL-LLVKDONJSA-N	1	1	342.421	1.529	50	5		EDBAMO
COCC[N@H+]1CC[C@@H](CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000069663424	203034302	/nfs/dbraw/zinc/03/43/02/203034302.db2.gz	QOHAMZVVASRBAU-NSHDSACASA-N	1	1	341.795	1.946	50	5		EDBAMO
O=[N+]([O-])c1cccc(CS(=O)(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)c1	ZINC000095433781	218376876	/nfs/dbraw/zinc/37/68/76/218376876.db2.gz	NKXGFJCFTRSUJH-AWEZNQCLSA-N	1	1	339.417	1.499	50	5		EDBAMO
C[C@H]1C[C@H](C)CN(c2nc(N3CC[NH+](C)CC3)nc(N)c2[N+](=O)[O-])C1	ZINC000005219748	300485009	/nfs/dbraw/zinc/48/50/09/300485009.db2.gz	UGEPCMWXDNYWHF-RYUDHWBXSA-N	1	1	349.439	1.201	50	5		EDBAMO
CN(c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C)C1	ZINC000072296175	441224995	/nfs/dbraw/zinc/22/49/95/441224995.db2.gz	LQWOJFZJDWAWEV-GFCCVEGCSA-N	1	1	327.406	1.529	50	5		EDBAMO
CN(c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C)C1	ZINC000072296175	441225000	/nfs/dbraw/zinc/22/50/00/441225000.db2.gz	LQWOJFZJDWAWEV-GFCCVEGCSA-N	1	1	327.406	1.529	50	5		EDBAMO
CN1CC[NH+](C(C)(C)CNC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000025055626	202125789	/nfs/dbraw/zinc/12/57/89/202125789.db2.gz	QRGOELOATXARKV-UHFFFAOYSA-N	1	1	335.408	1.742	50	5		EDBAMO
O=[N+]([O-])c1cccnc1NCCC[NH+]1CCN(c2ncccn2)CC1	ZINC000012770079	207245818	/nfs/dbraw/zinc/24/58/18/207245818.db2.gz	CUOXTKPLHWSMAM-UHFFFAOYSA-N	1	1	343.391	1.404	50	5		EDBAMO
Cc1cc(C(=O)NC[C@@H](C(C)C)[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC000013007609	441151723	/nfs/dbraw/zinc/15/17/23/441151723.db2.gz	JWVONEKAHAPNKH-INIZCTEOSA-N	1	1	335.404	1.990	50	5		EDBAMO
O=c1ccc([N+](=O)[O-])cn1C[C@@H](O)C[N@H+]1CCc2ccccc2C1	ZINC000089861153	441587170	/nfs/dbraw/zinc/58/71/70/441587170.db2.gz	OKHSUXOCFOUWTP-INIZCTEOSA-N	1	1	329.356	1.176	50	5		EDBAMO
Cn1cc[nH+]c1N1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000078939518	441996395	/nfs/dbraw/zinc/99/63/95/441996395.db2.gz	DBVBJRSUOTXYFF-UHFFFAOYSA-N	1	1	329.360	1.220	50	5		EDBAMO
Cc1cc(N2C[C@H]3OCCN(C)[C@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1	ZINC000097083940	442163878	/nfs/dbraw/zinc/16/38/78/442163878.db2.gz	HYENLCWJSNXJAY-DLBZAZTESA-N	1	1	328.372	1.971	50	5		EDBAMO
Cc1cc(S(=O)(=O)N(C)[C@@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000076062413	203333735	/nfs/dbraw/zinc/33/37/35/203333735.db2.gz	QTFWGLCKFBVVQF-GFCCVEGCSA-N	1	1	327.406	1.618	50	5		EDBAMO
Cc1cc(S(=O)(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000076062413	203333737	/nfs/dbraw/zinc/33/37/37/203333737.db2.gz	QTFWGLCKFBVVQF-GFCCVEGCSA-N	1	1	327.406	1.618	50	5		EDBAMO
COc1cc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])cc1OC	ZINC000069538114	203017326	/nfs/dbraw/zinc/01/73/26/203017326.db2.gz	JVXGYENOXAKMBE-QWHCGFSZSA-N	1	1	349.387	1.969	50	5		EDBAMO
COCCCNC(=O)C[N@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000036395414	441607826	/nfs/dbraw/zinc/60/78/26/441607826.db2.gz	KOFPNZXVZVBYAS-UHFFFAOYSA-N	1	1	325.365	1.058	50	5		EDBAMO
COCCCNC(=O)C[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000036395414	441607828	/nfs/dbraw/zinc/60/78/28/441607828.db2.gz	KOFPNZXVZVBYAS-UHFFFAOYSA-N	1	1	325.365	1.058	50	5		EDBAMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CC2CC[NH2+]CC2)CC1	ZINC000178974792	442542890	/nfs/dbraw/zinc/54/28/90/442542890.db2.gz	OMLJCWLMNSCBJE-UHFFFAOYSA-N	1	1	332.404	1.352	50	5		EDBAMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000194029844	442833078	/nfs/dbraw/zinc/83/30/78/442833078.db2.gz	NMPONSJJDVXSFO-WDEREUQCSA-N	1	1	341.795	1.775	50	5		EDBAMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000194029844	442833083	/nfs/dbraw/zinc/83/30/83/442833083.db2.gz	NMPONSJJDVXSFO-WDEREUQCSA-N	1	1	341.795	1.775	50	5		EDBAMO
C[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H]1N1CCOCC1	ZINC000241644669	443208036	/nfs/dbraw/zinc/20/80/36/443208036.db2.gz	PSPHKHMIVKOPMK-WMLDXEAASA-N	1	1	335.404	1.626	50	5		EDBAMO
C[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[C@@H]1O	ZINC000189655334	533921655	/nfs/dbraw/zinc/92/16/55/533921655.db2.gz	IFWDOHONBGLFSX-HZMBPMFUSA-N	1	1	325.340	1.765	50	5		EDBAMO
O=[N+]([O-])c1cnc(N2CC[C@H](C[NH+]3CCOCC3)C2)c(Cl)c1	ZINC000078404285	202390498	/nfs/dbraw/zinc/39/04/98/202390498.db2.gz	WWHBGLLYKMAYBN-LLVKDONJSA-N	1	1	326.784	1.802	50	5		EDBAMO
CC[N@@H+](C)C[C@@H]1CCN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000174024616	276073086	/nfs/dbraw/zinc/07/30/86/276073086.db2.gz	YWXHJKBHHLNTGU-AWEZNQCLSA-N	1	1	341.433	1.698	50	5		EDBAMO
Cc1cc(S(=O)(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)ccc1[N+](=O)[O-]	ZINC000072286232	441221561	/nfs/dbraw/zinc/22/15/61/441221561.db2.gz	ROKCTUCHZRRAPB-ZDUSSCGKSA-N	1	1	339.417	1.666	50	5		EDBAMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](CCCn2ccnc2)CC1	ZINC000096493107	442143470	/nfs/dbraw/zinc/14/34/70/442143470.db2.gz	UXSFAXNNBWFJKK-UHFFFAOYSA-N	1	1	343.387	1.639	50	5		EDBAMO
CCCc1[nH]nc(C(=O)N2CCC[C@H]([NH+]3CCCC3)C2)c1[N+](=O)[O-]	ZINC000073108580	216350482	/nfs/dbraw/zinc/35/04/82/216350482.db2.gz	LVELWMPAGKIJAP-LBPRGKRZSA-N	1	1	335.408	1.971	50	5		EDBAMO
O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)cc1	ZINC000069845386	442055217	/nfs/dbraw/zinc/05/52/17/442055217.db2.gz	KIRSITHYQCBMCV-GFCCVEGCSA-N	1	1	325.390	1.357	50	5		EDBAMO
Cc1ccc(S(=O)(=O)N2CCC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000248009628	442877432	/nfs/dbraw/zinc/87/74/32/442877432.db2.gz	IFVQMVAUOUJKHW-ZDUSSCGKSA-N	1	1	339.417	1.762	50	5		EDBAMO
O=[N+]([O-])c1ccccc1S(=O)(=O)N1CC[NH2+]C[C@H]1c1ccccc1	ZINC000313374909	318931239	/nfs/dbraw/zinc/93/12/39/318931239.db2.gz	KUPNOQWUEBABJK-HNNXBMFYSA-N	1	1	347.396	1.930	50	5		EDBAMO
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccco1	ZINC000010330860	211164606	/nfs/dbraw/zinc/16/46/06/211164606.db2.gz	MFUUALNDLFHCNX-ZDUSSCGKSA-N	1	1	346.343	1.545	50	5		EDBAMO
C[NH+]1CCN(c2nc(N)c([N+](=O)[O-])c(N3CCCCCC3)n2)CC1	ZINC000005033204	273900793	/nfs/dbraw/zinc/90/07/93/273900793.db2.gz	WVKPMAHKHIIIDA-UHFFFAOYSA-N	1	1	335.412	1.099	50	5		EDBAMO
O=[N+]([O-])c1ccc(-c2cnn(C[C@H](O)C[NH+]3CCOCC3)c2)cc1	ZINC000095438774	218382318	/nfs/dbraw/zinc/38/23/18/218382318.db2.gz	QJLRXVTWRURAIZ-MRXNPFEDSA-N	1	1	332.360	1.151	50	5		EDBAMO
COC[C@@H](C)[NH+]1CCN(c2cc(OC)c(F)cc2[N+](=O)[O-])CC1	ZINC000096466593	274041560	/nfs/dbraw/zinc/04/15/60/274041560.db2.gz	TYPUQBSIDYEICA-LLVKDONJSA-N	1	1	327.356	1.899	50	5		EDBAMO
O=[N+]([O-])c1cccc(-c2ncn(C[NH+]3CCC4(CC3)OCCO4)n2)c1	ZINC000048343130	441295136	/nfs/dbraw/zinc/29/51/36/441295136.db2.gz	LRYSVRUOVNZKTA-UHFFFAOYSA-N	1	1	345.359	1.650	50	5		EDBAMO
C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@@H](C)O[C@H](C)C1	ZINC000025127624	441331249	/nfs/dbraw/zinc/33/12/49/441331249.db2.gz	UZBIZWUEEMUNPD-MGPQQGTHSA-N	1	1	335.404	1.751	50	5		EDBAMO
NC(=O)c1c[nH+]ccc1N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000097140629	442173901	/nfs/dbraw/zinc/17/39/01/442173901.db2.gz	UIWJEPYMZBQLPP-UHFFFAOYSA-N	1	1	327.344	1.415	50	5		EDBAMO
Cn1cc[nH+]c1N1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000072292884	216128575	/nfs/dbraw/zinc/12/85/75/216128575.db2.gz	BPIWJJUIHCVRHK-UHFFFAOYSA-N	1	1	345.359	1.056	50	5		EDBAMO
[NH3+][C@@H](CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-])c1ccccc1	ZINC000095432047	218374473	/nfs/dbraw/zinc/37/44/73/218374473.db2.gz	KGNFWGIERDMBFO-LBPRGKRZSA-N	1	1	339.348	1.712	50	5		EDBAMO
CC(C)[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])C(=O)N1CCOCC1	ZINC000095985496	218491942	/nfs/dbraw/zinc/49/19/42/218491942.db2.gz	HPJWRZFJHSIDGJ-OAHLLOKOSA-N	1	1	339.367	1.707	50	5		EDBAMO
CC[C@@H](CO)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1	ZINC000097095531	442166114	/nfs/dbraw/zinc/16/61/14/442166114.db2.gz	WOGFGJHHTIPNEF-LBPRGKRZSA-N	1	1	341.795	1.777	50	5		EDBAMO
C[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H]1N1CCOCC1	ZINC000241644668	443207824	/nfs/dbraw/zinc/20/78/24/443207824.db2.gz	PSPHKHMIVKOPMK-RHSMWYFYSA-N	1	1	335.404	1.626	50	5		EDBAMO
O=C(NC[C@H]1C[C@@H](O)C[N@@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])o1	ZINC000095446283	218389864	/nfs/dbraw/zinc/38/98/64/218389864.db2.gz	RZRRWLSCYUVFGX-ZIAGYGMSSA-N	1	1	345.355	1.553	50	5		EDBAMO
CC[NH+]1CCN(c2cc(N3CCOCC3)c([N+](=O)[O-])cc2F)CC1	ZINC000004168625	440912510	/nfs/dbraw/zinc/91/25/10/440912510.db2.gz	WDQLWXRGHBMZLM-UHFFFAOYSA-N	1	1	338.383	1.712	50	5		EDBAMO
CC[NH+]1CCN(c2nc(N3CCCCC3)nc(N)c2[N+](=O)[O-])CC1	ZINC000005100953	440937422	/nfs/dbraw/zinc/93/74/22/440937422.db2.gz	OLDJIXPRPMIAPK-UHFFFAOYSA-N	1	1	335.412	1.099	50	5		EDBAMO
COCC[N@H+]1CC[C@H](CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000069663421	442006287	/nfs/dbraw/zinc/00/62/87/442006287.db2.gz	QOHAMZVVASRBAU-LLVKDONJSA-N	1	1	341.795	1.946	50	5		EDBAMO
COc1ccc(NC(=O)C[N@@H+]2CCCC[C@H]2CCO)c([N+](=O)[O-])c1	ZINC000069872280	442062723	/nfs/dbraw/zinc/06/27/23/442062723.db2.gz	KTMYCXIWQSRKBZ-LBPRGKRZSA-N	1	1	337.376	1.779	50	5		EDBAMO
COc1ccc(NC(=O)C[N@H+]2CCCC[C@H]2CCO)c([N+](=O)[O-])c1	ZINC000069872280	442062729	/nfs/dbraw/zinc/06/27/29/442062729.db2.gz	KTMYCXIWQSRKBZ-LBPRGKRZSA-N	1	1	337.376	1.779	50	5		EDBAMO
COC[C@H](C)[NH+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])CC1	ZINC000069901167	442072139	/nfs/dbraw/zinc/07/21/39/442072139.db2.gz	UADJJBDMSDBKCI-ZDUSSCGKSA-N	1	1	336.392	1.186	50	5		EDBAMO
O=[N+]([O-])c1cncc(Br)c1NCCC[NH+]1CCOCC1	ZINC000096487527	442142037	/nfs/dbraw/zinc/14/20/37/442142037.db2.gz	XFLRLEFQPGMJBK-UHFFFAOYSA-N	1	1	345.197	1.887	50	5		EDBAMO
O=[N+]([O-])c1ccc(OCCC[NH+]2CCN(c3cnccn3)CC2)cc1	ZINC000055900881	214347233	/nfs/dbraw/zinc/34/72/33/214347233.db2.gz	PUVWMCMEHFYPAG-UHFFFAOYSA-N	1	1	343.387	1.976	50	5		EDBAMO
CCc1n[nH]c(C(=O)N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000171804318	529468695	/nfs/dbraw/zinc/46/86/95/529468695.db2.gz	MDCNOGQQMWETDP-GRYCIOLGSA-N	1	1	337.424	1.977	50	5		EDBAMO
O=C(c1cc([N+](=O)[O-])cc2c1OCCO2)N1CCC[N@H+]2CCC[C@H]2C1	ZINC000066643226	215062242	/nfs/dbraw/zinc/06/22/42/215062242.db2.gz	QOGALHOBAZRSBJ-LBPRGKRZSA-N	1	1	347.371	1.676	50	5		EDBAMO
Cc1cccc(NCCNC(=O)COc2cccc([N+](=O)[O-])c2)[nH+]1	ZINC000071914197	441195693	/nfs/dbraw/zinc/19/56/93/441195693.db2.gz	MEUCMYPFULPYJW-UHFFFAOYSA-N	1	1	330.344	1.905	50	5		EDBAMO
Cc1cc(S(=O)(=O)NC[C@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000072286234	441221549	/nfs/dbraw/zinc/22/15/49/441221549.db2.gz	IVLHAMCOTVQALD-GFCCVEGCSA-N	1	1	327.406	1.523	50	5		EDBAMO
C[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)[N@@H+]1CCc2sccc2C1	ZINC000032429618	441556323	/nfs/dbraw/zinc/55/63/23/441556323.db2.gz	ARPSWNAUOOBCNU-LLVKDONJSA-N	1	1	349.416	1.416	50	5		EDBAMO
C[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)[N@H+]1CCc2sccc2C1	ZINC000032429618	441556325	/nfs/dbraw/zinc/55/63/25/441556325.db2.gz	ARPSWNAUOOBCNU-LLVKDONJSA-N	1	1	349.416	1.416	50	5		EDBAMO
COc1cc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])cc1OC	ZINC000069538112	441971445	/nfs/dbraw/zinc/97/14/45/441971445.db2.gz	JVXGYENOXAKMBE-CHWSQXEVSA-N	1	1	349.387	1.969	50	5		EDBAMO
Cc1cccc(N2CC[N@H+](CCn3cc([N+](=O)[O-])cn3)[C@H](C)C2)n1	ZINC000096445730	442134362	/nfs/dbraw/zinc/13/43/62/442134362.db2.gz	YMZMJGKWIDZUEN-CQSZACIVSA-N	1	1	330.392	1.705	50	5		EDBAMO
Cc1cccc(N2CC[N@@H+](CCn3cc([N+](=O)[O-])cn3)[C@H](C)C2)n1	ZINC000096445730	442134365	/nfs/dbraw/zinc/13/43/65/442134365.db2.gz	YMZMJGKWIDZUEN-CQSZACIVSA-N	1	1	330.392	1.705	50	5		EDBAMO
C[NH+](C)[C@H](CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccco1	ZINC000010330866	211165868	/nfs/dbraw/zinc/16/58/68/211165868.db2.gz	MFUUALNDLFHCNX-CYBMUJFWSA-N	1	1	346.343	1.545	50	5		EDBAMO
CN(C)c1nc(N2CCN(c3cc(N)ccc3[N+](=O)[O-])CC2)cc[nH+]1	ZINC000408515944	257982120	/nfs/dbraw/zinc/98/21/20/257982120.db2.gz	BONUORUBSQLWJN-UHFFFAOYSA-N	1	1	343.391	1.360	50	5		EDBAMO
C[N@@H+](Cc1ccccc1)C1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000288357719	258012413	/nfs/dbraw/zinc/01/24/13/258012413.db2.gz	KMJLPDXOAIJJQH-UHFFFAOYSA-N	1	1	329.360	1.134	50	5		EDBAMO
O=C(CC[NH+]1CCN(C(=O)C2CC2)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000024595870	441314739	/nfs/dbraw/zinc/31/47/39/441314739.db2.gz	JBZWUQDOKBMHFX-UHFFFAOYSA-N	1	1	346.387	1.478	50	5		EDBAMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc([N+](=O)[O-])c(Cl)c1	ZINC000095977816	441967403	/nfs/dbraw/zinc/96/74/03/441967403.db2.gz	LBQPFPGXNANSOS-VXGBXAGGSA-N	1	1	339.779	1.841	50	5		EDBAMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[C@@H]1O	ZINC000189655315	237109911	/nfs/dbraw/zinc/10/99/11/237109911.db2.gz	IFWDOHONBGLFSX-YGRLFVJLSA-N	1	1	325.340	1.765	50	5		EDBAMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1C[C@H](C)[N@@H+](C2CC2)C1	ZINC000079092502	217190012	/nfs/dbraw/zinc/19/00/12/217190012.db2.gz	VLLFUTIIVIKTFY-RYUDHWBXSA-N	1	1	339.417	1.807	50	5		EDBAMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1C[C@H](C)[N@H+](C2CC2)C1	ZINC000079092502	217190015	/nfs/dbraw/zinc/19/00/15/217190015.db2.gz	VLLFUTIIVIKTFY-RYUDHWBXSA-N	1	1	339.417	1.807	50	5		EDBAMO
C[N@@H+](Cc1ccccc1)C1CN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000286362124	443698461	/nfs/dbraw/zinc/69/84/61/443698461.db2.gz	NGZHSAOCUYJHKH-UHFFFAOYSA-N	1	1	341.371	1.409	50	5		EDBAMO
C[C@H]1CN(C(=O)c2ccc(N3CC[NH+](C)CC3)c([N+](=O)[O-])c2)CCO1	ZINC000008726289	441099082	/nfs/dbraw/zinc/09/90/82/441099082.db2.gz	ZJKZVIWMXQOOPK-ZDUSSCGKSA-N	1	1	348.403	1.208	50	5		EDBAMO
C[C@H](O)C[NH+]1CCN(c2ccc(Br)cc2[N+](=O)[O-])CC1	ZINC000069587193	441982063	/nfs/dbraw/zinc/98/20/63/441982063.db2.gz	QVNSMIJRYQPSOP-JTQLQIEISA-N	1	1	344.209	1.860	50	5		EDBAMO
COCC[N@H+]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000069456145	215427812	/nfs/dbraw/zinc/42/78/12/215427812.db2.gz	KFWBNEYYNYZCJL-LLVKDONJSA-N	1	1	341.795	1.946	50	5		EDBAMO
O=C(NCCC[NH+]1CCOCC1)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000019850968	212076560	/nfs/dbraw/zinc/07/65/60/212076560.db2.gz	AAZQIRSLSBHXGV-UHFFFAOYSA-N	1	1	327.768	1.700	50	5		EDBAMO
CC[C@@H](CO)[NH+]1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1	ZINC000072313526	258064844	/nfs/dbraw/zinc/06/48/44/258064844.db2.gz	GXOBHTPXIYMWKB-ZDUSSCGKSA-N	1	1	336.392	1.824	50	5		EDBAMO
Cc1cc([N+](=O)[O-])cnc1NC[C@@H]([C@@H]1CCOC1)[NH+]1CCOCC1	ZINC000058424557	441193720	/nfs/dbraw/zinc/19/37/20/441193720.db2.gz	CYIFFNTZSLRGTN-HIFRSBDPSA-N	1	1	336.392	1.447	50	5		EDBAMO
C[C@@H]1c2cc(F)ccc2CC[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000075745288	441554049	/nfs/dbraw/zinc/55/40/49/441554049.db2.gz	OZDZGEKIDAEYTI-ABAIWWIYSA-N	1	1	334.351	1.911	50	5		EDBAMO
CN(C[C@H](O)C[NH+]1CCN(C)CC1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000069619225	441991819	/nfs/dbraw/zinc/99/18/19/441991819.db2.gz	MFJSYGLXALXBPL-ZDUSSCGKSA-N	1	1	342.827	1.293	50	5		EDBAMO
CN(C)C(=O)C[N@@H+]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])CC1	ZINC000069707021	442019393	/nfs/dbraw/zinc/01/93/93/442019393.db2.gz	WMBGVSNJLUUYTD-UHFFFAOYSA-N	1	1	338.383	1.330	50	5		EDBAMO
CN(C)C(=O)C[N@H+]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])CC1	ZINC000069707021	442019398	/nfs/dbraw/zinc/01/93/98/442019398.db2.gz	WMBGVSNJLUUYTD-UHFFFAOYSA-N	1	1	338.383	1.330	50	5		EDBAMO
Cc1noc([C@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CCN2C)n1	ZINC000285038353	443832027	/nfs/dbraw/zinc/83/20/27/443832027.db2.gz	WAKUTOYIBFBPRX-OAHLLOKOSA-N	1	1	331.376	1.817	50	5		EDBAMO
Cc1noc([C@H]2C[N@H+](CCc3ccc([N+](=O)[O-])cc3)CCN2C)n1	ZINC000285038353	443832033	/nfs/dbraw/zinc/83/20/33/443832033.db2.gz	WAKUTOYIBFBPRX-OAHLLOKOSA-N	1	1	331.376	1.817	50	5		EDBAMO
CC[C@H](CO)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1	ZINC000097095532	442165992	/nfs/dbraw/zinc/16/59/92/442165992.db2.gz	WOGFGJHHTIPNEF-GFCCVEGCSA-N	1	1	341.795	1.777	50	5		EDBAMO
CCc1n[nH]c(C(=O)N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000171804316	529468234	/nfs/dbraw/zinc/46/82/34/529468234.db2.gz	MDCNOGQQMWETDP-TUAOUCFPSA-N	1	1	337.424	1.977	50	5		EDBAMO
NC(=O)c1ccc(C[NH2+][C@]2(CO)CCc3ccccc32)c([N+](=O)[O-])c1	ZINC000095980391	283377612	/nfs/dbraw/zinc/37/76/12/283377612.db2.gz	OFLLHXCRIHDBEZ-SFHVURJKSA-N	1	1	341.367	1.617	50	5		EDBAMO
O=[N+]([O-])c1cnc(N2CC[C@@H](C[NH+]3CCOCC3)C2)c(Cl)c1	ZINC000078404293	217048916	/nfs/dbraw/zinc/04/89/16/217048916.db2.gz	WWHBGLLYKMAYBN-NSHDSACASA-N	1	1	326.784	1.802	50	5		EDBAMO
[NH3+][C@H](CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-])c1ccccc1	ZINC000095432046	218374632	/nfs/dbraw/zinc/37/46/32/218374632.db2.gz	KGNFWGIERDMBFO-GFCCVEGCSA-N	1	1	339.348	1.712	50	5		EDBAMO
Cc1nc(C2CC[NH+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)n[nH]1	ZINC000095432622	218374642	/nfs/dbraw/zinc/37/46/42/218374642.db2.gz	WHVDEEJYVJJBCC-OAHLLOKOSA-N	1	1	331.376	1.934	50	5		EDBAMO
Cc1nnc(C2CC[NH+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)[nH]1	ZINC000095432622	218374645	/nfs/dbraw/zinc/37/46/45/218374645.db2.gz	WHVDEEJYVJJBCC-OAHLLOKOSA-N	1	1	331.376	1.934	50	5		EDBAMO
O=[N+]([O-])c1cc(F)ccc1NC[C@H]([C@H]1CCOC1)[NH+]1CCOCC1	ZINC000058427885	441193742	/nfs/dbraw/zinc/19/37/42/441193742.db2.gz	RZQQFHLTXRPPDW-BLLLJJGKSA-N	1	1	339.367	1.883	50	5		EDBAMO
O=[N+]([O-])c1cc(F)ccc1NC[C@H]([C@@H]1CCOC1)[NH+]1CCOCC1	ZINC000058427878	441193840	/nfs/dbraw/zinc/19/38/40/441193840.db2.gz	RZQQFHLTXRPPDW-MLGOLLRUSA-N	1	1	339.367	1.883	50	5		EDBAMO
CNC(=O)[C@H]1CCC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000071920499	441197050	/nfs/dbraw/zinc/19/70/50/441197050.db2.gz	SKNACVCYCRAWDN-ZDUSSCGKSA-N	1	1	344.375	1.269	50	5		EDBAMO
Cc1cc(S(=O)(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)ccc1[N+](=O)[O-]	ZINC000072286231	441221446	/nfs/dbraw/zinc/22/14/46/441221446.db2.gz	ROKCTUCHZRRAPB-CYBMUJFWSA-N	1	1	339.417	1.666	50	5		EDBAMO
O=C(NCCC[NH+]1CCOCC1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000020081890	441261889	/nfs/dbraw/zinc/26/18/89/441261889.db2.gz	GAQVDWOSWHZLIX-UHFFFAOYSA-N	1	1	327.768	1.700	50	5		EDBAMO
COCC[N@H+]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000069700510	442013005	/nfs/dbraw/zinc/01/30/05/442013005.db2.gz	SXXFYNWTLKYTLB-NSHDSACASA-N	1	1	325.340	1.432	50	5		EDBAMO
CC[N@H+]1CCC[C@H]1CNc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000015164205	441197292	/nfs/dbraw/zinc/19/72/92/441197292.db2.gz	GUAYITUENNUSDH-NSHDSACASA-N	1	1	342.421	1.399	50	5		EDBAMO
O=C(C[C@@H]1[NH2+][C@H]2CCCC[C@H]2NC1=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000004702816	210253356	/nfs/dbraw/zinc/25/33/56/210253356.db2.gz	PDUFJMZIZWSOSY-MJBXVCDLSA-N	1	1	332.360	1.323	50	5		EDBAMO
CC[N@H+](CCn1cc([N+](=O)[O-])cn1)CC(=O)Nc1ccccc1OC	ZINC000072296278	216134180	/nfs/dbraw/zinc/13/41/80/216134180.db2.gz	AUPMXMBHXXLUOW-UHFFFAOYSA-N	1	1	347.375	1.761	50	5		EDBAMO
CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC(=O)Nc1ccccc1OC	ZINC000072296278	216134183	/nfs/dbraw/zinc/13/41/83/216134183.db2.gz	AUPMXMBHXXLUOW-UHFFFAOYSA-N	1	1	347.375	1.761	50	5		EDBAMO
CN1CC[NH+](C(C)(C)CNC(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000023042588	212344531	/nfs/dbraw/zinc/34/45/31/212344531.db2.gz	MVVGNKLYSNAEKV-UHFFFAOYSA-N	1	1	335.408	1.742	50	5		EDBAMO
CN(CC[N@@H+](C)C1CCN(C)CC1)C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000079050337	217181835	/nfs/dbraw/zinc/18/18/35/217181835.db2.gz	VYSCHNLVHZZYBS-UHFFFAOYSA-N	1	1	348.447	1.622	50	5		EDBAMO
CN(CCN(C)C1CC[NH+](C)CC1)C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000079050337	217181837	/nfs/dbraw/zinc/18/18/37/217181837.db2.gz	VYSCHNLVHZZYBS-UHFFFAOYSA-N	1	1	348.447	1.622	50	5		EDBAMO
CC(=O)c1cccc(NC(=O)c2c(C)[nH]n3c([N+](=O)[O-])c(C)n[n+]23)c1	ZINC000012372000	211358822	/nfs/dbraw/zinc/35/88/22/211358822.db2.gz	CQKFQTSSYRXPKQ-UHFFFAOYSA-O	1	1	343.323	1.228	50	5		EDBAMO
COC(=O)[C@]1(C)C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1C	ZINC000281899567	258013734	/nfs/dbraw/zinc/01/37/34/258013734.db2.gz	AEJACDGKFNDFAM-QLJPJBMISA-N	1	1	335.360	1.325	50	5		EDBAMO
C[NH+]1CCN(c2nc(N)c([N+](=O)[O-])c(NCc3ccccc3)n2)CC1	ZINC000005164181	440938939	/nfs/dbraw/zinc/93/89/39/440938939.db2.gz	KGTDYPROYKAOMN-UHFFFAOYSA-N	1	1	343.391	1.331	50	5		EDBAMO
C[NH+]1CCN(CCCn2cc(Br)c([N+](=O)[O-])n2)CC1	ZINC000170599535	442233763	/nfs/dbraw/zinc/23/37/63/442233763.db2.gz	QLQSMURDQAQWBI-UHFFFAOYSA-N	1	1	332.202	1.191	50	5		EDBAMO
C[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1C[N@H+](C)CCO1	ZINC000095443505	218388127	/nfs/dbraw/zinc/38/81/27/218388127.db2.gz	QOJXZXGLNMSFKM-BZNIZROVSA-N	1	1	346.387	1.454	50	5		EDBAMO
C[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1C[N@@H+](C)CCO1	ZINC000095443505	218388129	/nfs/dbraw/zinc/38/81/29/218388129.db2.gz	QOJXZXGLNMSFKM-BZNIZROVSA-N	1	1	346.387	1.454	50	5		EDBAMO
C[NH+]1CCN(c2ccc(C(=O)N3CCCCC3)cc2[N+](=O)[O-])CC1	ZINC000008723562	290057451	/nfs/dbraw/zinc/05/74/51/290057451.db2.gz	KOXDQVCXJKXCPZ-UHFFFAOYSA-N	1	1	332.404	1.973	50	5		EDBAMO
CC[NH+]1CCN(c2nc(N)c([N+](=O)[O-])c(Nc3ccccc3)n2)CC1	ZINC000004306306	440915700	/nfs/dbraw/zinc/91/57/00/440915700.db2.gz	FAOARJDFZYNNDQ-UHFFFAOYSA-N	1	1	343.391	1.853	50	5		EDBAMO
CS(=O)(=O)c1ccc(NCCC[NH+]2CC=CC2)c([N+](=O)[O-])c1	ZINC000101419273	441155721	/nfs/dbraw/zinc/15/57/21/441155721.db2.gz	LPHDNDHHUCOLNB-UHFFFAOYSA-N	1	1	325.390	1.672	50	5		EDBAMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	ZINC000041761480	441672043	/nfs/dbraw/zinc/67/20/43/441672043.db2.gz	GOQLAQPTCXQXKP-OAHLLOKOSA-N	1	1	343.387	1.995	50	5		EDBAMO
C[N@H+]1CCCC[C@@H]1CN1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000069562293	441974929	/nfs/dbraw/zinc/97/49/29/441974929.db2.gz	LWMJVVVKSCEAGG-QGZVFWFLSA-N	1	1	346.431	1.837	50	5		EDBAMO
O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)cc1	ZINC000069845387	442054611	/nfs/dbraw/zinc/05/46/11/442054611.db2.gz	KIRSITHYQCBMCV-LBPRGKRZSA-N	1	1	325.390	1.357	50	5		EDBAMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCOC[C@@H]3CCCO3)CC2)cc1	ZINC000096421050	442123344	/nfs/dbraw/zinc/12/33/44/442123344.db2.gz	SICPNLKMEGAEHX-KRWDZBQOSA-N	1	1	335.404	1.912	50	5		EDBAMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@H](C)C1	ZINC000194016112	442828882	/nfs/dbraw/zinc/82/88/82/442828882.db2.gz	VGKOUZLEGLJKDC-GHMZBOCLSA-N	1	1	325.340	1.261	50	5		EDBAMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@H](C)C1	ZINC000194016112	442828884	/nfs/dbraw/zinc/82/88/84/442828884.db2.gz	VGKOUZLEGLJKDC-GHMZBOCLSA-N	1	1	325.340	1.261	50	5		EDBAMO
Cn1cc(N2CC[C@H]([N@H+](C)CCc3ccccc3[N+](=O)[O-])C2=O)cn1	ZINC000253417310	443061736	/nfs/dbraw/zinc/06/17/36/443061736.db2.gz	RFCONUUHVUEUQL-INIZCTEOSA-N	1	1	343.387	1.608	50	5		EDBAMO
Cn1cc(N2CC[C@H]([N@@H+](C)CCc3ccccc3[N+](=O)[O-])C2=O)cn1	ZINC000253417310	443061740	/nfs/dbraw/zinc/06/17/40/443061740.db2.gz	RFCONUUHVUEUQL-INIZCTEOSA-N	1	1	343.387	1.608	50	5		EDBAMO
O=C(C[C@@H]1[NH2+][C@@H]2CCCC[C@H]2NC1=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000239174030	443199231	/nfs/dbraw/zinc/19/92/31/443199231.db2.gz	PDUFJMZIZWSOSY-MCIONIFRSA-N	1	1	332.360	1.323	50	5		EDBAMO
CC[NH+]1CCN(C(=O)[C@@H](C)Oc2ccc(OC)cc2[N+](=O)[O-])CC1	ZINC000023990143	212401455	/nfs/dbraw/zinc/40/14/55/212401455.db2.gz	RBOQJPMSPURGRO-GFCCVEGCSA-N	1	1	337.376	1.535	50	5		EDBAMO
CC[NH+]1CCN(c2nc(N3CCC(C)CC3)nc(N)c2[N+](=O)[O-])CC1	ZINC000005033524	273666914	/nfs/dbraw/zinc/66/69/14/273666914.db2.gz	MRWZNKYRZBWBMZ-UHFFFAOYSA-N	1	1	349.439	1.345	50	5		EDBAMO
O=C(CC[NH+]1CCN(C(=O)C2CC2)CC1)Nc1cccc([N+](=O)[O-])c1	ZINC000024595861	441314942	/nfs/dbraw/zinc/31/49/42/441314942.db2.gz	AZVYCXOMJXTKCD-UHFFFAOYSA-N	1	1	346.387	1.478	50	5		EDBAMO
O=C(CC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2F)CC1)NC1CC1	ZINC000089773157	441577460	/nfs/dbraw/zinc/57/74/60/441577460.db2.gz	PYRUTOMGIYHDJO-UHFFFAOYSA-N	1	1	336.367	1.525	50	5		EDBAMO
CC(C)NC(=O)C[N@@H+]1CCCN(c2cccc(F)c2[N+](=O)[O-])CC1	ZINC000057137653	441789861	/nfs/dbraw/zinc/78/98/61/441789861.db2.gz	PBRUJHUTXHDMHI-UHFFFAOYSA-N	1	1	338.383	1.771	50	5		EDBAMO
CC(C)NC(=O)C[N@H+]1CCCN(c2cccc(F)c2[N+](=O)[O-])CC1	ZINC000057137653	441789870	/nfs/dbraw/zinc/78/98/70/441789870.db2.gz	PBRUJHUTXHDMHI-UHFFFAOYSA-N	1	1	338.383	1.771	50	5		EDBAMO
O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[NH+](CCO)CC2)o1	ZINC000004985576	210350290	/nfs/dbraw/zinc/35/02/90/210350290.db2.gz	HGIFHLLNXIQDKU-UHFFFAOYSA-N	1	1	331.372	1.965	50	5		EDBAMO
C[NH+]1CCN(c2nc(N)c([N+](=O)[O-])c(Nc3ccc(F)cc3)n2)CC1	ZINC000004306341	440915838	/nfs/dbraw/zinc/91/58/38/440915838.db2.gz	HELOANUHQXVLQU-UHFFFAOYSA-N	1	1	347.354	1.602	50	5		EDBAMO
Cc1cc([N+](=O)[O-])ccc1N1CCC(C(=O)N2CC[NH+](C)CC2)CC1	ZINC000080572897	441179908	/nfs/dbraw/zinc/17/99/08/441179908.db2.gz	MSQUOEBMVHGBSL-UHFFFAOYSA-N	1	1	346.431	1.894	50	5		EDBAMO
Nc1ccc(NC(=S)NCCC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000016238339	441218266	/nfs/dbraw/zinc/21/82/66/441218266.db2.gz	LBEQMPAYCAISJD-UHFFFAOYSA-N	1	1	339.421	1.186	50	5		EDBAMO
C[N@H+](Cc1ccc(F)c(F)c1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000076082269	441595201	/nfs/dbraw/zinc/59/52/01/441595201.db2.gz	WSVMBXFBAAKFGM-LBPRGKRZSA-N	1	1	326.303	1.562	50	5		EDBAMO
C[NH+]1CCN(C(=O)Cn2ccc(Nc3ccccc3[N+](=O)[O-])n2)CC1	ZINC000095399064	218331929	/nfs/dbraw/zinc/33/19/29/218331929.db2.gz	MYDDPSDJDOSFPM-UHFFFAOYSA-N	1	1	344.375	1.309	50	5		EDBAMO
C[C@@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)N1CC[NH+](C)CC1	ZINC000097112902	218960631	/nfs/dbraw/zinc/96/06/31/218960631.db2.gz	BUFNNFBEXQSWQY-AWEZNQCLSA-N	1	1	346.431	1.722	50	5		EDBAMO
C[N@H+](CCCNS(C)(=O)=O)Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000058225148	441162295	/nfs/dbraw/zinc/16/22/95/441162295.db2.gz	BBUMWGSQAVSRGF-UHFFFAOYSA-N	1	1	335.813	1.619	50	5		EDBAMO
C[N@@H+](CCCNS(C)(=O)=O)Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000058225148	441162297	/nfs/dbraw/zinc/16/22/97/441162297.db2.gz	BBUMWGSQAVSRGF-UHFFFAOYSA-N	1	1	335.813	1.619	50	5		EDBAMO
CN(CC[N@@H+](C)C1CCCCC1)C(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000097113567	442171231	/nfs/dbraw/zinc/17/12/31/442171231.db2.gz	ZAEHXPWJPFAFKB-UHFFFAOYSA-N	1	1	335.408	1.909	50	5		EDBAMO
Cc1[nH+]c2c(n1CCO)CC[C@H](Nc1nccc(C)c1[N+](=O)[O-])C2	ZINC000585092467	448674736	/nfs/dbraw/zinc/67/47/36/448674736.db2.gz	YKTFDBUNLISWEC-LBPRGKRZSA-N	1	1	331.376	1.765	50	5		EDBAMO
CC[C@H](CO)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC)CC1	ZINC000084733794	486281222	/nfs/dbraw/zinc/28/12/22/486281222.db2.gz	HIAFTRAVDHGOGN-GFCCVEGCSA-N	1	1	337.376	1.132	50	5		EDBAMO
CS(=O)(=O)NC[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000069322483	215377926	/nfs/dbraw/zinc/37/79/26/215377926.db2.gz	SXDMJGPKXBHNDD-CQSZACIVSA-N	1	1	327.406	1.499	50	5		EDBAMO
CS(=O)(=O)NC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000069322483	215377929	/nfs/dbraw/zinc/37/79/29/215377929.db2.gz	SXDMJGPKXBHNDD-CQSZACIVSA-N	1	1	327.406	1.499	50	5		EDBAMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000585136334	448706390	/nfs/dbraw/zinc/70/63/90/448706390.db2.gz	ASTXJYNVJDQBHM-TXEJJXNPSA-N	1	1	338.795	1.965	50	5		EDBAMO
O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000071922470	275042065	/nfs/dbraw/zinc/04/20/65/275042065.db2.gz	XCAPGOPDRHMAOB-UHFFFAOYSA-N	1	1	346.347	1.522	50	5		EDBAMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H](C(C)C)[NH+]1CCN(C)CC1	ZINC000042580359	441754681	/nfs/dbraw/zinc/75/46/81/441754681.db2.gz	WQJHLNIMFMPKCT-MRXNPFEDSA-N	1	1	349.435	1.300	50	5		EDBAMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])C1	ZINC000069779796	442040437	/nfs/dbraw/zinc/04/04/37/442040437.db2.gz	NSYCWGAMNKAMNS-NSHDSACASA-N	1	1	337.376	1.778	50	5		EDBAMO
C[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@H]1N1CCOCC1	ZINC000177262637	442321659	/nfs/dbraw/zinc/32/16/59/442321659.db2.gz	PSPHKHMIVKOPMK-YOEHRIQHSA-N	1	1	335.404	1.626	50	5		EDBAMO
[NH3+]C[C@H]1CCCC[C@H]1NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000195544602	295268499	/nfs/dbraw/zinc/26/84/99/295268499.db2.gz	FHBHYDSQHFDVHG-MWLCHTKSSA-N	1	1	331.369	1.530	50	5		EDBAMO
O=C(C[C@@H]1[NH2+][C@@H]2CCCC[C@@H]2NC1=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000013776766	441166880	/nfs/dbraw/zinc/16/68/80/441166880.db2.gz	PDUFJMZIZWSOSY-RDBSUJKOSA-N	1	1	332.360	1.323	50	5		EDBAMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCOC[C@H]3CCCO3)CC2)cc1	ZINC000096421051	442123156	/nfs/dbraw/zinc/12/31/56/442123156.db2.gz	SICPNLKMEGAEHX-QGZVFWFLSA-N	1	1	335.404	1.912	50	5		EDBAMO
C[NH+]1CCN(c2nc(NCc3ccccc3)nc(N)c2[N+](=O)[O-])CC1	ZINC000005163300	440939079	/nfs/dbraw/zinc/93/90/79/440939079.db2.gz	PWGCVFVVVGKUIJ-UHFFFAOYSA-N	1	1	343.391	1.331	50	5		EDBAMO
O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc([N+](=O)[O-])c(Cl)c1	ZINC000108364802	441448372	/nfs/dbraw/zinc/44/83/72/441448372.db2.gz	LBQPFPGXNANSOS-RYUDHWBXSA-N	1	1	339.779	1.841	50	5		EDBAMO
Cc1cccc(N2CCC(Nc3ncc([N+](=O)[O-])c(N)n3)CC2)[nH+]1	ZINC000075140291	441501919	/nfs/dbraw/zinc/50/19/19/441501919.db2.gz	MPJZKTLGAHFRGQ-UHFFFAOYSA-N	1	1	329.364	1.751	50	5		EDBAMO
Cc1ccc(S(=O)(=O)N2CCC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000069444404	441938730	/nfs/dbraw/zinc/93/87/30/441938730.db2.gz	IFVQMVAUOUJKHW-CYBMUJFWSA-N	1	1	339.417	1.762	50	5		EDBAMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CC[N@H+]2CCCC[C@@H]2C1	ZINC000096009814	441980229	/nfs/dbraw/zinc/98/02/29/441980229.db2.gz	VRUARNYJDULMHC-CABCVRRESA-N	1	1	335.404	1.505	50	5		EDBAMO
O=C([C@@H]1CC1[N+](=O)[O-])N(Cc1ccccc1)[C@H]1C[NH+]2CCC1CC2	ZINC000069901097	442070540	/nfs/dbraw/zinc/07/05/40/442070540.db2.gz	GNCJUJRHRTWKAO-IKGGRYGDSA-N	1	1	329.400	1.775	50	5		EDBAMO
COc1cc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])cc1OC	ZINC000229605227	536508230	/nfs/dbraw/zinc/50/82/30/536508230.db2.gz	JVXGYENOXAKMBE-OLZOCXBDSA-N	1	1	349.387	1.969	50	5		EDBAMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[NH+]([C@H]2CCOC2)CC1	ZINC000089574023	441560775	/nfs/dbraw/zinc/56/07/75/441560775.db2.gz	APSYJVGGXJJNED-KBPBESRZSA-N	1	1	348.403	1.328	50	5		EDBAMO
C[C@@H]1C[N@H+]2CCC[C@@H]2CN1S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000097115476	442171601	/nfs/dbraw/zinc/17/16/01/442171601.db2.gz	XMSKODKLTRZLCD-TZMCWYRMSA-N	1	1	339.417	1.593	50	5		EDBAMO
O=c1oc2ccccc2c(NCCC[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC000019535621	202011050	/nfs/dbraw/zinc/01/10/50/202011050.db2.gz	OAURYGLBIZQWFI-UHFFFAOYSA-N	1	1	333.344	1.835	50	5		EDBAMO
CS(=O)(=O)NC[C@@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000069322478	441918117	/nfs/dbraw/zinc/91/81/17/441918117.db2.gz	SXDMJGPKXBHNDD-AWEZNQCLSA-N	1	1	327.406	1.499	50	5		EDBAMO
CS(=O)(=O)NC[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000069322478	441918122	/nfs/dbraw/zinc/91/81/22/441918122.db2.gz	SXDMJGPKXBHNDD-AWEZNQCLSA-N	1	1	327.406	1.499	50	5		EDBAMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN(c3[nH+]ccn3C)CC2)c1	ZINC000096436910	442130025	/nfs/dbraw/zinc/13/00/25/442130025.db2.gz	QBXLHHSDHFDVSY-UHFFFAOYSA-N	1	1	329.360	1.599	50	5		EDBAMO
Cc1nccn1C[C@@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000178750436	442474080	/nfs/dbraw/zinc/47/40/80/442474080.db2.gz	FVAVZQTZWHXICM-HNNXBMFYSA-N	1	1	343.387	1.863	50	5		EDBAMO
C[N@H+]1CCCC[C@H]1CN1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000069562295	203018502	/nfs/dbraw/zinc/01/85/02/203018502.db2.gz	LWMJVVVKSCEAGG-KRWDZBQOSA-N	1	1	346.431	1.837	50	5		EDBAMO
O=C([C@@H]1CC1[N+](=O)[O-])N(Cc1ccccc1)[C@H]1C[NH+]2CCC1CC2	ZINC000247368375	442850198	/nfs/dbraw/zinc/85/01/98/442850198.db2.gz	GNCJUJRHRTWKAO-ZACQAIPSSA-N	1	1	329.400	1.775	50	5		EDBAMO
C[C@@H]1CN(C(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])C[C@H](C)O1	ZINC000240551531	443203483	/nfs/dbraw/zinc/20/34/83/443203483.db2.gz	GUKMMGVTGKWVOI-OKILXGFUSA-N	1	1	335.404	1.705	50	5		EDBAMO
C[C@@H]1CN(C(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])C[C@H](C)O1	ZINC000240551531	443203484	/nfs/dbraw/zinc/20/34/84/443203484.db2.gz	GUKMMGVTGKWVOI-OKILXGFUSA-N	1	1	335.404	1.705	50	5		EDBAMO
CNS(=O)(=O)c1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)c1	ZINC000066988888	215101560	/nfs/dbraw/zinc/10/15/60/215101560.db2.gz	MEBXNTWGQJQDBF-UHFFFAOYSA-N	1	1	335.385	1.793	50	5		EDBAMO
CNS(=O)(=O)c1ccc(N(C)[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000072296179	203196348	/nfs/dbraw/zinc/19/63/48/203196348.db2.gz	WLSNENXNXPZEBY-NSHDSACASA-N	1	1	342.421	1.033	50	5		EDBAMO
Cc1c(F)cc(S(=O)(=O)N(C)[C@@H]2CCC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000170598917	442233785	/nfs/dbraw/zinc/23/37/85/442233785.db2.gz	LHPAIMILFCLDHF-LLVKDONJSA-N	1	1	345.396	1.757	50	5		EDBAMO
Cc1c(F)cc(S(=O)(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000170598917	442233787	/nfs/dbraw/zinc/23/37/87/442233787.db2.gz	LHPAIMILFCLDHF-LLVKDONJSA-N	1	1	345.396	1.757	50	5		EDBAMO
C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000025127630	202127445	/nfs/dbraw/zinc/12/74/45/202127445.db2.gz	UZBIZWUEEMUNPD-MCIONIFRSA-N	1	1	335.404	1.751	50	5		EDBAMO
C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000025127630	202127448	/nfs/dbraw/zinc/12/74/48/202127448.db2.gz	UZBIZWUEEMUNPD-MCIONIFRSA-N	1	1	335.404	1.751	50	5		EDBAMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)Cn1nc(C)c([N+](=O)[O-])c1C	ZINC000069845285	203056936	/nfs/dbraw/zinc/05/69/36/203056936.db2.gz	MEMJLWAOJSDQHT-AWEZNQCLSA-N	1	1	337.424	1.789	50	5		EDBAMO
C[NH+]1CCN(CCCNc2c3ccccc3oc(=O)c2[N+](=O)[O-])CC1	ZINC000003896376	440908355	/nfs/dbraw/zinc/90/83/55/440908355.db2.gz	JKTMNPGWRZOVJZ-UHFFFAOYSA-N	1	1	346.387	1.751	50	5		EDBAMO
C[NH+](C)[C@@H](CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccco1	ZINC000010331201	441113556	/nfs/dbraw/zinc/11/35/56/441113556.db2.gz	VTYYBXPPXDUQDM-ZDUSSCGKSA-N	1	1	346.343	1.545	50	5		EDBAMO
CC(C)[C@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[NH+](C)CC1	ZINC000012918270	441147877	/nfs/dbraw/zinc/14/78/77/441147877.db2.gz	ZHQBMFLAKNWHIU-INIZCTEOSA-N	1	1	349.435	1.988	50	5		EDBAMO
Cc1nn(C)c(NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-]	ZINC000079353717	442041332	/nfs/dbraw/zinc/04/13/32/442041332.db2.gz	TXRAJWXJRHMIDQ-OAHLLOKOSA-N	1	1	345.403	1.468	50	5		EDBAMO
C[NH+]1CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC1	ZINC000050079793	282889276	/nfs/dbraw/zinc/88/92/76/282889276.db2.gz	ASNWFOQWNCVUKX-UHFFFAOYSA-N	1	1	332.404	1.585	50	5		EDBAMO
CN(C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1)S(C)(=O)=O	ZINC000253417321	243941853	/nfs/dbraw/zinc/94/18/53/243941853.db2.gz	SLIBIRKEBOQJEB-CQSZACIVSA-N	1	1	341.433	1.698	50	5		EDBAMO
CC[N@@H+](CCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)C1CC1	ZINC000071185870	203087153	/nfs/dbraw/zinc/08/71/53/203087153.db2.gz	SLIBWNGUQYMKIJ-UHFFFAOYSA-N	1	1	343.387	1.995	50	5		EDBAMO
C[C@@H](CO)[NH+]1CCN(c2ncc(Br)cc2[N+](=O)[O-])CC1	ZINC000095416517	274228457	/nfs/dbraw/zinc/22/84/57/274228457.db2.gz	RZUKNEMBHMNETD-VIFPVBQESA-N	1	1	345.197	1.255	50	5		EDBAMO
C[C@H]1C[C@H](C)CN(c2nc(N)c([N+](=O)[O-])c(N3CC[NH+](C)CC3)n2)C1	ZINC000005050563	274619157	/nfs/dbraw/zinc/61/91/57/274619157.db2.gz	HFYLUMZDQLOWSC-RYUDHWBXSA-N	1	1	349.439	1.201	50	5		EDBAMO
C[C@@H]1CN(C(=O)c2ccc(N3CC[NH+](C)CC3)c([N+](=O)[O-])c2)CCO1	ZINC000008726285	288033700	/nfs/dbraw/zinc/03/37/00/288033700.db2.gz	ZJKZVIWMXQOOPK-CYBMUJFWSA-N	1	1	348.403	1.208	50	5		EDBAMO
CC[N@@H+]1CCC[C@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000006507352	440996211	/nfs/dbraw/zinc/99/62/11/440996211.db2.gz	DTDNYDJECIOMLL-NSHDSACASA-N	1	1	327.406	1.895	50	5		EDBAMO
CC[N@H+]1CCC[C@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000006507352	440996217	/nfs/dbraw/zinc/99/62/17/440996217.db2.gz	DTDNYDJECIOMLL-NSHDSACASA-N	1	1	327.406	1.895	50	5		EDBAMO
CN(C)C(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1	ZINC000016046968	441215825	/nfs/dbraw/zinc/21/58/25/441215825.db2.gz	GPGSVMQJXSKMGU-UHFFFAOYSA-N	1	1	349.387	1.762	50	5		EDBAMO
CC[N@H+]1CCC[C@H](Nc2ccc(S(=O)(=O)NC)cc2[N+](=O)[O-])C1	ZINC000078680187	441961984	/nfs/dbraw/zinc/96/19/84/441961984.db2.gz	SGHZERHHVPAUQY-NSHDSACASA-N	1	1	342.421	1.399	50	5		EDBAMO
Cc1cc(N2CCC(NC(=O)c3ccc([N+](=O)[O-])o3)CC2)nc(C)[nH+]1	ZINC000096454884	442137184	/nfs/dbraw/zinc/13/71/84/442137184.db2.gz	GUDIFILOJIKZAN-UHFFFAOYSA-N	1	1	345.359	1.993	50	5		EDBAMO
CC[NH+]1CCN(CCCCNC(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000069897972	203062677	/nfs/dbraw/zinc/06/26/77/203062677.db2.gz	WUVLAOKSLPFQFA-UHFFFAOYSA-N	1	1	340.449	1.804	50	5		EDBAMO
CC(C)NC(=O)C[NH+]1CCC(NC(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000047342337	441177634	/nfs/dbraw/zinc/17/76/34/441177634.db2.gz	RBZISBPRMFTJPT-UHFFFAOYSA-N	1	1	348.403	1.314	50	5		EDBAMO
O=[N+]([O-])c1cc(F)ccc1NC[C@@H]([C@H]1CCOC1)[NH+]1CCOCC1	ZINC000058427880	441193390	/nfs/dbraw/zinc/19/33/90/441193390.db2.gz	RZQQFHLTXRPPDW-LRDDRELGSA-N	1	1	339.367	1.883	50	5		EDBAMO
O=[N+]([O-])c1ccccc1Nc1cnn(C[C@@H](O)C[NH+]2CCOCC2)c1	ZINC000065604840	441468297	/nfs/dbraw/zinc/46/82/97/441468297.db2.gz	QTTSHGJTAFORTN-AWEZNQCLSA-N	1	1	347.375	1.228	50	5		EDBAMO
O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[NH+](C3CCCC3)CC2)cc1	ZINC000054991738	441610134	/nfs/dbraw/zinc/61/01/34/441610134.db2.gz	LZCHXDNSHIFDGA-UHFFFAOYSA-N	1	1	339.417	1.844	50	5		EDBAMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1C[C@@H](C)[N@@H+](C2CC2)C1	ZINC000079092509	442018152	/nfs/dbraw/zinc/01/81/52/442018152.db2.gz	VLLFUTIIVIKTFY-NEPJUHHUSA-N	1	1	339.417	1.807	50	5		EDBAMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1C[C@@H](C)[N@H+](C2CC2)C1	ZINC000079092509	442018158	/nfs/dbraw/zinc/01/81/58/442018158.db2.gz	VLLFUTIIVIKTFY-NEPJUHHUSA-N	1	1	339.417	1.807	50	5		EDBAMO
O=[N+]([O-])c1ccc(N[C@H]2CCN(c3[nH+]cnc4[nH]ccc43)C2)nc1	ZINC000095433690	203741316	/nfs/dbraw/zinc/74/13/16/203741316.db2.gz	QQWFZLILHAQEOE-JTQLQIEISA-N	1	1	325.332	1.952	50	5		EDBAMO
CNC(=O)[C@@H]1CCC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000071920498	441197005	/nfs/dbraw/zinc/19/70/05/441197005.db2.gz	SKNACVCYCRAWDN-CYBMUJFWSA-N	1	1	344.375	1.269	50	5		EDBAMO
CC(C)[C@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])N1CC[NH+](C)CC1	ZINC000032760681	441569759	/nfs/dbraw/zinc/56/97/59/441569759.db2.gz	XUSVFLSTNSEQSV-INIZCTEOSA-N	1	1	349.435	1.378	50	5		EDBAMO
C[C@@H]1C[C@@H](C)CN(c2nc(N)c([N+](=O)[O-])c(N3CC[NH+](C)CC3)n2)C1	ZINC000005050576	278884985	/nfs/dbraw/zinc/88/49/85/278884985.db2.gz	HFYLUMZDQLOWSC-VXGBXAGGSA-N	1	1	349.439	1.201	50	5		EDBAMO
COc1ccc(S(=O)(=O)NC[C@H](C)[N@@H+](C)C2CC2)c([N+](=O)[O-])c1	ZINC000065541845	441455274	/nfs/dbraw/zinc/45/52/74/441455274.db2.gz	CKKYFYRAIIGENI-JTQLQIEISA-N	1	1	343.405	1.364	50	5		EDBAMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[NH+]([C@@H]2CCOC2)CC1	ZINC000089574020	441560943	/nfs/dbraw/zinc/56/09/43/441560943.db2.gz	APSYJVGGXJJNED-ZIAGYGMSSA-N	1	1	348.403	1.328	50	5		EDBAMO
O=C(c1cc(F)ccc1[N+](=O)[O-])N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000076041688	441581124	/nfs/dbraw/zinc/58/11/24/441581124.db2.gz	BMRJNGKENIUAOI-LBPRGKRZSA-N	1	1	337.351	1.528	50	5		EDBAMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000194029830	442833150	/nfs/dbraw/zinc/83/31/50/442833150.db2.gz	NMPONSJJDVXSFO-GHMZBOCLSA-N	1	1	341.795	1.775	50	5		EDBAMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000194029830	442833152	/nfs/dbraw/zinc/83/31/52/442833152.db2.gz	NMPONSJJDVXSFO-GHMZBOCLSA-N	1	1	341.795	1.775	50	5		EDBAMO
CN(C[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1)S(C)(=O)=O	ZINC000253417317	443061977	/nfs/dbraw/zinc/06/19/77/443061977.db2.gz	SLIBIRKEBOQJEB-AWEZNQCLSA-N	1	1	341.433	1.698	50	5		EDBAMO
C[C@@H]1CN(C(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])C[C@@H](C)O1	ZINC000240551532	443202941	/nfs/dbraw/zinc/20/29/41/443202941.db2.gz	GUKMMGVTGKWVOI-ZIAGYGMSSA-N	1	1	335.404	1.705	50	5		EDBAMO
C[C@@H]1CN(C(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])C[C@@H](C)O1	ZINC000240551532	443202944	/nfs/dbraw/zinc/20/29/44/443202944.db2.gz	GUKMMGVTGKWVOI-ZIAGYGMSSA-N	1	1	335.404	1.705	50	5		EDBAMO
CS(=O)(=O)c1ccc(N2CC[N@@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000024659553	278119728	/nfs/dbraw/zinc/11/97/28/278119728.db2.gz	UPXJQCVAHGCRAQ-LLVKDONJSA-N	1	1	325.390	1.283	50	5		EDBAMO
CS(=O)(=O)c1ccc(N2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000024659553	278119729	/nfs/dbraw/zinc/11/97/29/278119729.db2.gz	UPXJQCVAHGCRAQ-LLVKDONJSA-N	1	1	325.390	1.283	50	5		EDBAMO
Cc1nn(C[C@H](O)C[N@H+]2CCc3ccccc3C2)c(C)c1[N+](=O)[O-]	ZINC000058181309	441156800	/nfs/dbraw/zinc/15/68/00/441156800.db2.gz	FJRHKJIFLGMKLH-MRXNPFEDSA-N	1	1	330.388	1.827	50	5		EDBAMO
COC[C@H](O)C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000019300913	441255878	/nfs/dbraw/zinc/25/58/78/441255878.db2.gz	USCJKDUSKMNBTO-GFCCVEGCSA-N	1	1	329.784	1.378	50	5		EDBAMO
C[C@H]1C[C@H](NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000097115525	442171476	/nfs/dbraw/zinc/17/14/76/442171476.db2.gz	ABVCDVLXEXEMOA-AAEUAGOBSA-N	1	1	339.417	1.639	50	5		EDBAMO
O=[N+]([O-])c1cc(F)ccc1NC[C@@H]([C@@H]1CCOC1)[NH+]1CCOCC1	ZINC000058427876	441194088	/nfs/dbraw/zinc/19/40/88/441194088.db2.gz	RZQQFHLTXRPPDW-WBMJQRKESA-N	1	1	339.367	1.883	50	5		EDBAMO
CCC(=O)NC1CC[NH+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1	ZINC000048272288	441282105	/nfs/dbraw/zinc/28/21/05/441282105.db2.gz	NVQLMSIIAMYGGQ-UHFFFAOYSA-N	1	1	331.376	1.893	50	5		EDBAMO
C[C@H]1c2ccc(F)cc2CC[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000075752778	441554739	/nfs/dbraw/zinc/55/47/39/441554739.db2.gz	BRMMOJZKJOWNNC-NHYWBVRUSA-N	1	1	334.351	1.911	50	5		EDBAMO
C[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)[N@@H+]1CCc2sccc2C1	ZINC000032429617	441556385	/nfs/dbraw/zinc/55/63/85/441556385.db2.gz	ARPSWNAUOOBCNU-NSHDSACASA-N	1	1	349.416	1.416	50	5		EDBAMO
C[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)[N@H+]1CCc2sccc2C1	ZINC000032429617	441556386	/nfs/dbraw/zinc/55/63/86/441556386.db2.gz	ARPSWNAUOOBCNU-NSHDSACASA-N	1	1	349.416	1.416	50	5		EDBAMO
Cn1cc(N2CC[C@@H]([N@H+](C)CCc3ccccc3[N+](=O)[O-])C2=O)cn1	ZINC000253417313	443061778	/nfs/dbraw/zinc/06/17/78/443061778.db2.gz	RFCONUUHVUEUQL-MRXNPFEDSA-N	1	1	343.387	1.608	50	5		EDBAMO
Cn1cc(N2CC[C@@H]([N@@H+](C)CCc3ccccc3[N+](=O)[O-])C2=O)cn1	ZINC000253417313	443061781	/nfs/dbraw/zinc/06/17/81/443061781.db2.gz	RFCONUUHVUEUQL-MRXNPFEDSA-N	1	1	343.387	1.608	50	5		EDBAMO
COc1cc([N+](=O)[O-])cnc1N1CCC[C@H](C[NH+]2CCOCC2)C1	ZINC000863949093	596725430	/nfs/dbraw/zinc/72/54/30/596725430.db2.gz	GQWCCFSIIZJKMQ-CYBMUJFWSA-N	1	1	336.392	1.547	50	5		EDBAMO
Cn1c2ccccc2nc1C[N@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000083243177	441357163	/nfs/dbraw/zinc/35/71/63/441357163.db2.gz	YMPJUYYEBSGGQP-ZDUSSCGKSA-N	1	1	344.375	1.171	50	5		EDBAMO
Cn1c2ccccc2nc1C[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000083243177	441357166	/nfs/dbraw/zinc/35/71/66/441357166.db2.gz	YMPJUYYEBSGGQP-ZDUSSCGKSA-N	1	1	344.375	1.171	50	5		EDBAMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	ZINC000041761483	441671935	/nfs/dbraw/zinc/67/19/35/441671935.db2.gz	GOQLAQPTCXQXKP-HNNXBMFYSA-N	1	1	343.387	1.995	50	5		EDBAMO
O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000069975141	441099237	/nfs/dbraw/zinc/09/92/37/441099237.db2.gz	YLDBNFHCTOGVCM-LBPRGKRZSA-N	1	1	325.390	1.357	50	5		EDBAMO
O=C(Cn1cc([N+](=O)[O-])cn1)NCCC[N@H+]1CCc2ccccc2C1	ZINC000032401403	441555867	/nfs/dbraw/zinc/55/58/67/441555867.db2.gz	CTFOPHNCPVSYEN-UHFFFAOYSA-N	1	1	343.387	1.356	50	5		EDBAMO
COC(=O)c1cc([N+](=O)[O-])cn(CC[N@@H+](C)Cc2ccccc2)c1=O	ZINC000408521674	447672987	/nfs/dbraw/zinc/67/29/87/447672987.db2.gz	QYIBTNRUQRLGIA-UHFFFAOYSA-N	1	1	345.355	1.675	50	5		EDBAMO
O=[N+]([O-])c1cnc(N2CCC[C@H](C[N@@H+]3CC[C@@H](O)C3)C2)c(Cl)c1	ZINC000585132691	448704317	/nfs/dbraw/zinc/70/43/17/448704317.db2.gz	MOPXAEVCTRPOKJ-DGCLKSJQSA-N	1	1	340.811	1.926	50	5		EDBAMO
O=C(NCCC[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000020242091	212114053	/nfs/dbraw/zinc/11/40/53/212114053.db2.gz	LPKGSCGFNUPHHI-UHFFFAOYSA-N	1	1	327.768	1.700	50	5		EDBAMO
C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCCCC2)CC1	ZINC000004881941	440930364	/nfs/dbraw/zinc/93/03/64/440930364.db2.gz	MBRXEOWIRYGQIH-UHFFFAOYSA-N	1	1	332.404	1.973	50	5		EDBAMO
CC[N@@H+]1CCC[C@@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000006507351	440996240	/nfs/dbraw/zinc/99/62/40/440996240.db2.gz	DTDNYDJECIOMLL-LLVKDONJSA-N	1	1	327.406	1.895	50	5		EDBAMO
CC[N@H+]1CCC[C@@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000006507351	440996248	/nfs/dbraw/zinc/99/62/48/440996248.db2.gz	DTDNYDJECIOMLL-LLVKDONJSA-N	1	1	327.406	1.895	50	5		EDBAMO
CN(c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C)C1	ZINC000072296174	441224950	/nfs/dbraw/zinc/22/49/50/441224950.db2.gz	LQWOJFZJDWAWEV-LBPRGKRZSA-N	1	1	327.406	1.529	50	5		EDBAMO
CN(c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](C)C1	ZINC000072296174	441224956	/nfs/dbraw/zinc/22/49/56/441224956.db2.gz	LQWOJFZJDWAWEV-LBPRGKRZSA-N	1	1	327.406	1.529	50	5		EDBAMO
C[C@@H]1C[N@H+](CC2CCN(c3c([N+](=O)[O-])ncn3C)CC2)C[C@H](C)O1	ZINC000069420890	441932660	/nfs/dbraw/zinc/93/26/60/441932660.db2.gz	MRAKRAWBZRVBBM-BETUJISGSA-N	1	1	337.424	1.654	50	5		EDBAMO
C[N@H+]1CCC[C@H](CNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000095939961	441954968	/nfs/dbraw/zinc/95/49/68/441954968.db2.gz	KKVJXSCIJVLKDS-GFCCVEGCSA-N	1	1	327.406	1.356	50	5		EDBAMO
C[C@H]1C[N@H+]2CCC[C@@H]2CN1S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000097115477	442171588	/nfs/dbraw/zinc/17/15/88/442171588.db2.gz	XMSKODKLTRZLCD-GXTWGEPZSA-N	1	1	339.417	1.593	50	5		EDBAMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000194016124	442828757	/nfs/dbraw/zinc/82/87/57/442828757.db2.gz	VGKOUZLEGLJKDC-WDEREUQCSA-N	1	1	325.340	1.261	50	5		EDBAMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000194016124	442828761	/nfs/dbraw/zinc/82/87/61/442828761.db2.gz	VGKOUZLEGLJKDC-WDEREUQCSA-N	1	1	325.340	1.261	50	5		EDBAMO
C[NH+]1CCN(CC2CN(c3ccc([N+](=O)[O-])c4cccnc43)C2)CC1	ZINC000585092323	448674651	/nfs/dbraw/zinc/67/46/51/448674651.db2.gz	PCFDBXSZIPQMBJ-UHFFFAOYSA-N	1	1	341.415	1.827	50	5		EDBAMO
CC[C@@H](CO)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC)CC1	ZINC000084733787	486281476	/nfs/dbraw/zinc/28/14/76/486281476.db2.gz	HIAFTRAVDHGOGN-LBPRGKRZSA-N	1	1	337.376	1.132	50	5		EDBAMO
Cn1cnc([N+](=O)[O-])c1NC[C@H](O)C[N@H+]1CCc2ccccc2C1	ZINC000040511145	213328155	/nfs/dbraw/zinc/32/81/55/213328155.db2.gz	VIDHQNYPMHCRKB-AWEZNQCLSA-N	1	1	331.376	1.159	50	5		EDBAMO
C[NH+](C)[C@H](CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccco1	ZINC000010331208	211165891	/nfs/dbraw/zinc/16/58/91/211165891.db2.gz	VTYYBXPPXDUQDM-CYBMUJFWSA-N	1	1	346.343	1.545	50	5		EDBAMO
O=[N+]([O-])c1ccc(N[C@@H]2CCN(c3[nH+]cnc4[nH]ccc43)C2)nc1	ZINC000095433689	218376374	/nfs/dbraw/zinc/37/63/74/218376374.db2.gz	QQWFZLILHAQEOE-SNVBAGLBSA-N	1	1	325.332	1.952	50	5		EDBAMO
COc1cc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])cc1OC	ZINC000058299134	441175604	/nfs/dbraw/zinc/17/56/04/441175604.db2.gz	JVXGYENOXAKMBE-STQMWFEESA-N	1	1	349.387	1.969	50	5		EDBAMO
Cc1cc(N2C[C@@H]3OCCN(C)[C@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1	ZINC000253369763	443050847	/nfs/dbraw/zinc/05/08/47/443050847.db2.gz	HYENLCWJSNXJAY-IRXDYDNUSA-N	1	1	328.372	1.971	50	5		EDBAMO
C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000221791341	443073674	/nfs/dbraw/zinc/07/36/74/443073674.db2.gz	BHUURPVVEPYOIA-RBSFLKMASA-N	1	1	335.404	1.503	50	5		EDBAMO
O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[NH2+]C[C@H]2c2ccccc2)cc1	ZINC000313378067	318931253	/nfs/dbraw/zinc/93/12/53/318931253.db2.gz	NANBTHLAZGIWKC-INIZCTEOSA-N	1	1	347.396	1.930	50	5		EDBAMO
C[C@@H]1CO[C@H](c2ccccc2)C[N@@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000229836562	242205623	/nfs/dbraw/zinc/20/56/23/242205623.db2.gz	RYMJVRHMDPNKHK-XYPHTWIQSA-N	1	1	346.387	1.614	50	5		EDBAMO
C[C@@H]1CO[C@H](c2ccccc2)C[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000229836562	242205625	/nfs/dbraw/zinc/20/56/25/242205625.db2.gz	RYMJVRHMDPNKHK-XYPHTWIQSA-N	1	1	346.387	1.614	50	5		EDBAMO
COC[C@H](C)[NH+]1CCN(c2cc(OC)c(F)cc2[N+](=O)[O-])CC1	ZINC000096466591	274047993	/nfs/dbraw/zinc/04/79/93/274047993.db2.gz	TYPUQBSIDYEICA-NSHDSACASA-N	1	1	327.356	1.899	50	5		EDBAMO
C[NH+]1CCN(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC1	ZINC000005569890	440959614	/nfs/dbraw/zinc/95/96/14/440959614.db2.gz	IIVRYEMBISEGQJ-UHFFFAOYSA-N	1	1	333.392	1.087	50	5		EDBAMO
CN(CC[N@@H+](C)C1CCCCC1)c1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000048290534	441287526	/nfs/dbraw/zinc/28/75/26/441287526.db2.gz	PBRLTXYRJLOIRD-UHFFFAOYSA-N	1	1	335.408	1.789	50	5		EDBAMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)c1	ZINC000089783365	441578902	/nfs/dbraw/zinc/57/89/02/441578902.db2.gz	QQJLDKHPSKQTTN-CJNGLKHVSA-N	1	1	334.351	1.781	50	5		EDBAMO
COCC[N@H+]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000069456147	441941459	/nfs/dbraw/zinc/94/14/59/441941459.db2.gz	KFWBNEYYNYZCJL-NSHDSACASA-N	1	1	341.795	1.946	50	5		EDBAMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])C1	ZINC000069779798	442041034	/nfs/dbraw/zinc/04/10/34/442041034.db2.gz	NSYCWGAMNKAMNS-LLVKDONJSA-N	1	1	337.376	1.778	50	5		EDBAMO
Cn1cc([N+](=O)[O-])c(C(=O)N2C[C@H]3CCC[N@H+]3Cc3ccccc32)n1	ZINC000240412621	443202092	/nfs/dbraw/zinc/20/20/92/443202092.db2.gz	FNKJDLUFWXWIPK-CYBMUJFWSA-N	1	1	341.371	1.953	50	5		EDBAMO
C[C@H]1c2ccc(F)cc2CC[N@@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000110640991	220051412	/nfs/dbraw/zinc/05/14/12/220051412.db2.gz	BRMMOJZKJOWNNC-XHDPSFHLSA-N	1	1	334.351	1.911	50	5		EDBAMO
CC[NH+]1CCN(c2nc(Nc3ccccc3)nc(N)c2[N+](=O)[O-])CC1	ZINC000005033520	440935333	/nfs/dbraw/zinc/93/53/33/440935333.db2.gz	LKIYWMUONIKDLS-UHFFFAOYSA-N	1	1	343.391	1.853	50	5		EDBAMO
CC[NH+]1CCN(c2nc(N)c([N+](=O)[O-])c(N3CCCCC3)n2)CC1	ZINC000005031669	440935979	/nfs/dbraw/zinc/93/59/79/440935979.db2.gz	LONJXMQVYLCGDK-UHFFFAOYSA-N	1	1	335.412	1.099	50	5		EDBAMO
COc1ccc2c(c1)CCC[N@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C2	ZINC000075713856	441550161	/nfs/dbraw/zinc/55/01/61/441550161.db2.gz	BPBWVUVLYLQSAF-MRXNPFEDSA-N	1	1	346.387	1.609	50	5		EDBAMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000249152448	442956581	/nfs/dbraw/zinc/95/65/81/442956581.db2.gz	VGKOUZLEGLJKDC-QWRGUYRKSA-N	1	1	325.340	1.261	50	5		EDBAMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000249152448	442956584	/nfs/dbraw/zinc/95/65/84/442956584.db2.gz	VGKOUZLEGLJKDC-QWRGUYRKSA-N	1	1	325.340	1.261	50	5		EDBAMO
Cc1cccc(N2CCC(NC(=O)Cn3ccc([N+](=O)[O-])n3)CC2)[nH+]1	ZINC000253426397	443066690	/nfs/dbraw/zinc/06/66/90/443066690.db2.gz	GFPLLVKTKCORNA-UHFFFAOYSA-N	1	1	344.375	1.280	50	5		EDBAMO
O=C(c1cc(F)ccc1[N+](=O)[O-])N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000076041686	441581236	/nfs/dbraw/zinc/58/12/36/441581236.db2.gz	BMRJNGKENIUAOI-GFCCVEGCSA-N	1	1	337.351	1.528	50	5		EDBAMO
C[NH+]1CCN(C(=O)CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000004819061	210286269	/nfs/dbraw/zinc/28/62/69/210286269.db2.gz	IZDRIHHIVOELII-UHFFFAOYSA-N	1	1	346.309	1.800	50	5		EDBAMO
O=[N+]([O-])c1ccccc1Nc1cnn(C[C@H](O)C[NH+]2CCOCC2)c1	ZINC000065604837	441468352	/nfs/dbraw/zinc/46/83/52/441468352.db2.gz	QTTSHGJTAFORTN-CQSZACIVSA-N	1	1	347.375	1.228	50	5		EDBAMO
COc1ccc2c(c1)CCC[N@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C2	ZINC000075713855	441550800	/nfs/dbraw/zinc/55/08/00/441550800.db2.gz	BPBWVUVLYLQSAF-INIZCTEOSA-N	1	1	346.387	1.609	50	5		EDBAMO
COC(=O)[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1	ZINC000095982691	441969599	/nfs/dbraw/zinc/96/95/99/441969599.db2.gz	SXXOUQRWCIXWNX-ZDUSSCGKSA-N	1	1	344.371	1.990	50	5		EDBAMO
O=[N+]([O-])c1cnc(N2CCC[C@@H](C[N@@H+]3CC[C@H](O)C3)C2)c(Cl)c1	ZINC000585132690	448703109	/nfs/dbraw/zinc/70/31/09/448703109.db2.gz	MOPXAEVCTRPOKJ-AAEUAGOBSA-N	1	1	340.811	1.926	50	5		EDBAMO
COC[C@H](O)C[NH+]1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000019300915	274051348	/nfs/dbraw/zinc/05/13/48/274051348.db2.gz	RQMSCGBYCPPRLN-GFCCVEGCSA-N	1	1	329.784	1.378	50	5		EDBAMO
C[NH+]1CCN(c2nc(N)c([N+](=O)[O-])c(NC3CCCCC3)n2)CC1	ZINC000006397137	440991105	/nfs/dbraw/zinc/99/11/05/440991105.db2.gz	MEVJWIUOMBODTG-UHFFFAOYSA-N	1	1	335.412	1.463	50	5		EDBAMO
O=[N+]([O-])c1cccnc1NC[C@H](O)C[N@H+]1CCc2ccccc2C1	ZINC000046479064	441111034	/nfs/dbraw/zinc/11/10/34/441111034.db2.gz	OOUONKATQKXMQK-HNNXBMFYSA-N	1	1	328.372	1.821	50	5		EDBAMO
C[C@@H]1CO[C@@H](c2ccccc2)C[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000075710995	441550479	/nfs/dbraw/zinc/55/04/79/441550479.db2.gz	RYMJVRHMDPNKHK-XOKHGSTOSA-N	1	1	346.387	1.614	50	5		EDBAMO
C[C@@H]1CO[C@@H](c2ccccc2)C[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000075710995	441550483	/nfs/dbraw/zinc/55/04/83/441550483.db2.gz	RYMJVRHMDPNKHK-XOKHGSTOSA-N	1	1	346.387	1.614	50	5		EDBAMO
O=C(NC1CCCCC1)[C@H]1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000096445683	442133903	/nfs/dbraw/zinc/13/39/03/442133903.db2.gz	RBCHFZGNKQJSFJ-AWEZNQCLSA-N	1	1	349.435	1.952	50	5		EDBAMO
O=[N+]([O-])c1cnc(N2CCC[C@H](C[N@@H+]3CC[C@H](O)C3)C2)c(Cl)c1	ZINC000585132693	448704911	/nfs/dbraw/zinc/70/49/11/448704911.db2.gz	MOPXAEVCTRPOKJ-YPMHNXCESA-N	1	1	340.811	1.926	50	5		EDBAMO
CNc1nc(N)c([N+](=O)[O-])c(N2CC[NH+](Cc3ccccc3)CC2)n1	ZINC000057463212	273976001	/nfs/dbraw/zinc/97/60/01/273976001.db2.gz	UQJHNJVFZJSWDC-UHFFFAOYSA-N	1	1	343.391	1.331	50	5		EDBAMO
CCC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)CC(=O)NC	ZINC000071911887	441194681	/nfs/dbraw/zinc/19/46/81/441194681.db2.gz	CTPSNHBIEQLDKN-UHFFFAOYSA-N	1	1	336.392	1.690	50	5		EDBAMO
COC[C@@H](O)C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000019300912	441256761	/nfs/dbraw/zinc/25/67/61/441256761.db2.gz	USCJKDUSKMNBTO-LBPRGKRZSA-N	1	1	329.784	1.378	50	5		EDBAMO
C[C@@H]1C[C@H](NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000097115524	442171749	/nfs/dbraw/zinc/17/17/49/442171749.db2.gz	ABVCDVLXEXEMOA-YPMHNXCESA-N	1	1	339.417	1.639	50	5		EDBAMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)c1	ZINC000229941208	242218162	/nfs/dbraw/zinc/21/81/62/242218162.db2.gz	QQJLDKHPSKQTTN-CZUORRHYSA-N	1	1	334.351	1.781	50	5		EDBAMO
COC(=O)c1cc([N+](=O)[O-])cn(C[C@@H]2CCCC[N@H+]2C(C)C)c1=O	ZINC000408525217	250303393	/nfs/dbraw/zinc/30/33/93/250303393.db2.gz	PPPKSTOUZVDFFO-LBPRGKRZSA-N	1	1	337.376	1.806	50	5		EDBAMO
C[NH+]1CCN(c2c3cc([N+](=O)[O-])ccc3oc(=O)c2[N+](=O)[O-])CC1	ZINC000004171173	273899284	/nfs/dbraw/zinc/89/92/84/273899284.db2.gz	LZVAAFLJHXHOLE-UHFFFAOYSA-N	1	1	334.288	1.361	50	5		EDBAMO
NC(=O)[C@H]1CCC[N@@H+](CCCNC(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000058378324	295149729	/nfs/dbraw/zinc/14/97/29/295149729.db2.gz	JPOBNUAIKQCXSV-LBPRGKRZSA-N	1	1	349.391	1.304	50	5		EDBAMO
O=C(/C=C/c1ccccc1[N+](=O)[O-])NC[C@@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000106517159	441347852	/nfs/dbraw/zinc/34/78/52/441347852.db2.gz	FLTXGHWDSNLAHH-MHKRFPNSSA-N	1	1	331.372	1.587	50	5		EDBAMO
Cc1nccc(N2CC[NH+](CCOc3cccc([N+](=O)[O-])c3)CC2)n1	ZINC000183810765	534757531	/nfs/dbraw/zinc/75/75/31/534757531.db2.gz	TWVIJCXZJFOGRD-UHFFFAOYSA-N	1	1	343.387	1.894	50	5		EDBAMO
Cc1nn(C[C@@H](O)C[N@H+]2CCc3ccccc3C2)c(C)c1[N+](=O)[O-]	ZINC000058181312	441157166	/nfs/dbraw/zinc/15/71/66/441157166.db2.gz	FJRHKJIFLGMKLH-INIZCTEOSA-N	1	1	330.388	1.827	50	5		EDBAMO
COc1ccc(NC(=O)C[N@@H+]2CCCC[C@@H]2CCO)c([N+](=O)[O-])c1	ZINC000069872278	442062201	/nfs/dbraw/zinc/06/22/01/442062201.db2.gz	KTMYCXIWQSRKBZ-GFCCVEGCSA-N	1	1	337.376	1.779	50	5		EDBAMO
COc1ccc(NC(=O)C[N@H+]2CCCC[C@@H]2CCO)c([N+](=O)[O-])c1	ZINC000069872278	442062207	/nfs/dbraw/zinc/06/22/07/442062207.db2.gz	KTMYCXIWQSRKBZ-GFCCVEGCSA-N	1	1	337.376	1.779	50	5		EDBAMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CC=C(c3ccccc3)CC2)c1	ZINC000096435689	442129095	/nfs/dbraw/zinc/12/90/95/442129095.db2.gz	CKOOZCLBEMIUAW-QGZVFWFLSA-N	1	1	328.372	1.942	50	5		EDBAMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CC=C(c3ccccc3)CC2)c1	ZINC000096435688	442129312	/nfs/dbraw/zinc/12/93/12/442129312.db2.gz	CKOOZCLBEMIUAW-KRWDZBQOSA-N	1	1	328.372	1.942	50	5		EDBAMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NCCN1CC[N@H+](C)C(C)(C)C1	ZINC000281868621	444027589	/nfs/dbraw/zinc/02/75/89/444027589.db2.gz	WCGMBYYISCGDOU-UHFFFAOYSA-N	1	1	334.420	1.659	50	5		EDBAMO
CC(=O)c1ccc(N2CCN(c3[nH+]ccn3C)CC2)c([N+](=O)[O-])c1	ZINC000072293266	275503956	/nfs/dbraw/zinc/50/39/56/275503956.db2.gz	KFSZQYLZPCYFCN-UHFFFAOYSA-N	1	1	329.360	1.858	50	5		EDBAMO
CC[NH+]1CCN(c2nc(N)c([N+](=O)[O-])c(NCc3ccco3)n2)CC1	ZINC000005066855	440937140	/nfs/dbraw/zinc/93/71/40/440937140.db2.gz	WOVZJFGESOSDJD-UHFFFAOYSA-N	1	1	347.379	1.314	50	5		EDBAMO
CNS(=O)(=O)c1ccc(N[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000048303492	441289552	/nfs/dbraw/zinc/28/95/52/441289552.db2.gz	WABGPQYUZIWGGQ-JTQLQIEISA-N	1	1	328.394	1.009	50	5		EDBAMO
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(C)[C@H]2CCC[N@H+](C)C2)c1C	ZINC000089626589	441564786	/nfs/dbraw/zinc/56/47/86/441564786.db2.gz	JDXPVFWHJMWZCS-ZDUSSCGKSA-N	1	1	341.433	1.926	50	5		EDBAMO
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(C)[C@H]2CCC[N@@H+](C)C2)c1C	ZINC000089626589	441564789	/nfs/dbraw/zinc/56/47/89/441564789.db2.gz	JDXPVFWHJMWZCS-ZDUSSCGKSA-N	1	1	341.433	1.926	50	5		EDBAMO
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(C)C[C@H]2CC[N@@H+](C)C2)c1C	ZINC000089626598	441565370	/nfs/dbraw/zinc/56/53/70/441565370.db2.gz	ZPVKJBQJCJWPRV-ZDUSSCGKSA-N	1	1	341.433	1.784	50	5		EDBAMO
C[NH+](C)CC(C)(C)CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000095939903	441955075	/nfs/dbraw/zinc/95/50/75/441955075.db2.gz	ZQICZQPGTFCWRA-UHFFFAOYSA-N	1	1	333.385	1.600	50	5		EDBAMO
Cc1nc(C2CC[NH+](C[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)n[nH]1	ZINC000095432621	218374796	/nfs/dbraw/zinc/37/47/96/218374796.db2.gz	WHVDEEJYVJJBCC-HNNXBMFYSA-N	1	1	331.376	1.934	50	5		EDBAMO
Cc1nnc(C2CC[NH+](C[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)[nH]1	ZINC000095432621	218374797	/nfs/dbraw/zinc/37/47/97/218374797.db2.gz	WHVDEEJYVJJBCC-HNNXBMFYSA-N	1	1	331.376	1.934	50	5		EDBAMO
O=C(NC[C@H]1C[C@H](O)C[N@@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])o1	ZINC000095446284	218390336	/nfs/dbraw/zinc/39/03/36/218390336.db2.gz	RZRRWLSCYUVFGX-KGLIPLIRSA-N	1	1	345.355	1.553	50	5		EDBAMO
O=[N+]([O-])c1ccc(Br)cc1N1CC[NH+](CCO)CC1	ZINC000078870078	275035200	/nfs/dbraw/zinc/03/52/00/275035200.db2.gz	LAORTJRNYJLXAY-UHFFFAOYSA-N	1	1	330.182	1.472	50	5		EDBAMO
CC[NH+]1CCN(c2nc(NCCC(C)C)nc(N)c2[N+](=O)[O-])CC1	ZINC000004305993	440915751	/nfs/dbraw/zinc/91/57/51/440915751.db2.gz	BATUWUUVTQUAKJ-UHFFFAOYSA-N	1	1	337.428	1.567	50	5		EDBAMO
CN1CCC([N@H+]2CC[C@H](NC(=O)Nc3cccc([N+](=O)[O-])c3)C2)CC1	ZINC000070015053	441104243	/nfs/dbraw/zinc/10/42/43/441104243.db2.gz	VEQQCPJPNXVNJJ-AWEZNQCLSA-N	1	1	347.419	1.885	50	5		EDBAMO
C[NH+]1CCC(N2CC[C@H](NC(=O)Nc3cccc([N+](=O)[O-])c3)C2)CC1	ZINC000070015053	441104245	/nfs/dbraw/zinc/10/42/45/441104245.db2.gz	VEQQCPJPNXVNJJ-AWEZNQCLSA-N	1	1	347.419	1.885	50	5		EDBAMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCCN(c3cccnn3)CC2)cc1	ZINC000105800376	441273748	/nfs/dbraw/zinc/27/37/48/441273748.db2.gz	ADWWHVUBWLMPQL-UHFFFAOYSA-N	1	1	343.387	1.976	50	5		EDBAMO
O=C(C[N@H+]1CCCN(c2ccccc2[N+](=O)[O-])CC1)N1CCCC1	ZINC000026705494	441382545	/nfs/dbraw/zinc/38/25/45/441382545.db2.gz	XGPJPYHAYADAFV-UHFFFAOYSA-N	1	1	332.404	1.729	50	5		EDBAMO
O=C(C[N@@H+]1CCCN(c2ccccc2[N+](=O)[O-])CC1)N1CCCC1	ZINC000026705494	441382548	/nfs/dbraw/zinc/38/25/48/441382548.db2.gz	XGPJPYHAYADAFV-UHFFFAOYSA-N	1	1	332.404	1.729	50	5		EDBAMO
O=C(NC[C@@H]1C[C@@H](O)C[N@@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])o1	ZINC000108143988	441436778	/nfs/dbraw/zinc/43/67/78/441436778.db2.gz	RZRRWLSCYUVFGX-UONOGXRCSA-N	1	1	345.355	1.553	50	5		EDBAMO
Cc1nccn1C[C@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000178750448	442474698	/nfs/dbraw/zinc/47/46/98/442474698.db2.gz	FVAVZQTZWHXICM-OAHLLOKOSA-N	1	1	343.387	1.863	50	5		EDBAMO
CCN1CC[NH+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1	ZINC000000119870	440800706	/nfs/dbraw/zinc/80/07/06/440800706.db2.gz	LTOKIWVEJXTXCR-UHFFFAOYSA-N	1	1	336.392	1.570	50	5		EDBAMO
CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000408516534	447670130	/nfs/dbraw/zinc/67/01/30/447670130.db2.gz	CZTYHDWDMZTAGF-UHFFFAOYSA-N	1	1	346.391	1.167	50	5		EDBAMO
O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1	ZINC000069849360	285165089	/nfs/dbraw/zinc/16/50/89/285165089.db2.gz	XSLBCVFQSSSQGP-GFCCVEGCSA-N	1	1	339.417	1.890	50	5		EDBAMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N(C)CCC[NH+]1CCN(C)CC1	ZINC000071896519	441187804	/nfs/dbraw/zinc/18/78/04/441187804.db2.gz	URQLDTMIOIIXAN-UHFFFAOYSA-N	1	1	334.420	1.613	50	5		EDBAMO
CC(C)NC(=O)CN1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000026178370	441369695	/nfs/dbraw/zinc/36/96/95/441369695.db2.gz	YUMNBPMJPUKDBU-UHFFFAOYSA-N	1	1	334.420	1.627	50	5		EDBAMO
CC(C)NC(=O)CN1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000026178370	441369697	/nfs/dbraw/zinc/36/96/97/441369697.db2.gz	YUMNBPMJPUKDBU-UHFFFAOYSA-N	1	1	334.420	1.627	50	5		EDBAMO
CC(C)NC(=O)C[N@@H+]1CCCN(Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000026178370	441369701	/nfs/dbraw/zinc/36/97/01/441369701.db2.gz	YUMNBPMJPUKDBU-UHFFFAOYSA-N	1	1	334.420	1.627	50	5		EDBAMO
CC(C)NC(=O)C[N@H+]1CCCN(Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000026178370	441369703	/nfs/dbraw/zinc/36/97/03/441369703.db2.gz	YUMNBPMJPUKDBU-UHFFFAOYSA-N	1	1	334.420	1.627	50	5		EDBAMO
Cc1[nH+]ccn1C[C@H]1CCCN1c1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000192740157	442682648	/nfs/dbraw/zinc/68/26/48/442682648.db2.gz	PGXQVMGZUUETCG-CYBMUJFWSA-N	1	1	329.360	1.868	50	5		EDBAMO
C[C@@H](C[NH+]1CCOCC1)C(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1	ZINC000095453214	218396980	/nfs/dbraw/zinc/39/69/80/218396980.db2.gz	KTZJYSPJFRVCOB-ZDUSSCGKSA-N	1	1	335.404	1.914	50	5		EDBAMO
O=C(c1cc([N+](=O)[O-])cc2c1OCCO2)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000066643225	441556752	/nfs/dbraw/zinc/55/67/52/441556752.db2.gz	QOGALHOBAZRSBJ-GFCCVEGCSA-N	1	1	347.371	1.676	50	5		EDBAMO
Cc1[nH+]ccn1C[C@@H]1CCCN1c1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000192740144	442682489	/nfs/dbraw/zinc/68/24/89/442682489.db2.gz	PGXQVMGZUUETCG-ZDUSSCGKSA-N	1	1	329.360	1.868	50	5		EDBAMO
CC(C)C[N@H+]1CCO[C@@H](CNc2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000240555802	443203470	/nfs/dbraw/zinc/20/34/70/443203470.db2.gz	GXIBWEBUJPTRIR-LBPRGKRZSA-N	1	1	336.392	1.462	50	5		EDBAMO
C[NH+]1CCN(c2nc(NC3CCCCC3)nc(N)c2[N+](=O)[O-])CC1	ZINC000005158225	440938714	/nfs/dbraw/zinc/93/87/14/440938714.db2.gz	BLFXEJNJTMDPAG-UHFFFAOYSA-N	1	1	335.412	1.463	50	5		EDBAMO
O=C(CN1CC[N@H+]2CCC[C@@H]2C1)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000017071053	441236034	/nfs/dbraw/zinc/23/60/34/441236034.db2.gz	HRIZPXKGDJRAJT-GFCCVEGCSA-N	1	1	338.795	1.967	50	5		EDBAMO
COc1ccccc1[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)[NH+](C)C	ZINC000032695554	441566299	/nfs/dbraw/zinc/56/62/99/441566299.db2.gz	SAIPXBDGVCEHIF-CQSZACIVSA-N	1	1	347.375	1.219	50	5		EDBAMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)c1	ZINC000089783368	441578820	/nfs/dbraw/zinc/57/88/20/441578820.db2.gz	QQJLDKHPSKQTTN-BBRMVZONSA-N	1	1	334.351	1.781	50	5		EDBAMO
O=C(C[N@@H+]1CCC[C@@H]1CCCO)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000096424249	442124230	/nfs/dbraw/zinc/12/42/30/442124230.db2.gz	KWNALGCZDDPGRQ-CQSZACIVSA-N	1	1	333.388	1.721	50	5		EDBAMO
Cc1cc(N2C[C@H]3OCCN(C)[C@@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1	ZINC000097083939	442164420	/nfs/dbraw/zinc/16/44/20/442164420.db2.gz	HYENLCWJSNXJAY-IAGOWNOFSA-N	1	1	328.372	1.971	50	5		EDBAMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000225425968	443102569	/nfs/dbraw/zinc/10/25/69/443102569.db2.gz	NMPONSJJDVXSFO-MNOVXSKESA-N	1	1	341.795	1.775	50	5		EDBAMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000225425968	443102572	/nfs/dbraw/zinc/10/25/72/443102572.db2.gz	NMPONSJJDVXSFO-MNOVXSKESA-N	1	1	341.795	1.775	50	5		EDBAMO
C[C@@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)NCCC[NH+]1CCOCC1	ZINC000020312026	212117963	/nfs/dbraw/zinc/11/79/63/212117963.db2.gz	XJHASSMKFHLOPI-CYBMUJFWSA-N	1	1	337.376	1.201	50	5		EDBAMO
COC(=O)c1cc([N+](=O)[O-])ccc1N1CCN(c2[nH+]ccn2C)CC1	ZINC000071920518	203151596	/nfs/dbraw/zinc/15/15/96/203151596.db2.gz	QSFXQTUJWRDWJC-UHFFFAOYSA-N	1	1	345.359	1.442	50	5		EDBAMO
Cc1[nH+]ccn1C[C@H]1CCCN1c1ccc2ncc([N+](=O)[O-])n2n1	ZINC000225597288	443114383	/nfs/dbraw/zinc/11/43/83/443114383.db2.gz	HQESYUIWBTULNV-GFCCVEGCSA-N	1	1	327.348	1.811	50	5		EDBAMO
O=C(CN1CC[N@H+]2CCC[C@H]2C1)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000239309548	443199178	/nfs/dbraw/zinc/19/91/78/443199178.db2.gz	HRIZPXKGDJRAJT-LBPRGKRZSA-N	1	1	338.795	1.967	50	5		EDBAMO
O=[N+]([O-])c1ccccc1-c1cnn(C[C@H](O)C[NH+]2CCOCC2)c1	ZINC000096501882	296513640	/nfs/dbraw/zinc/51/36/40/296513640.db2.gz	NPFTWCDJVGGLMS-CQSZACIVSA-N	1	1	332.360	1.151	50	5		EDBAMO
COc1ccccc1[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)[NH+](C)C	ZINC000032695555	441565996	/nfs/dbraw/zinc/56/59/96/441565996.db2.gz	SAIPXBDGVCEHIF-AWEZNQCLSA-N	1	1	347.375	1.219	50	5		EDBAMO
O=C(C[N@@H+]1CCC[C@H]1CCCO)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000096424250	442124403	/nfs/dbraw/zinc/12/44/03/442124403.db2.gz	KWNALGCZDDPGRQ-AWEZNQCLSA-N	1	1	333.388	1.721	50	5		EDBAMO
[NH3+]CCOc1cccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000170620905	442237709	/nfs/dbraw/zinc/23/77/09/442237709.db2.gz	KAAJBCPSIYSFHB-UHFFFAOYSA-N	1	1	337.357	1.733	50	5		EDBAMO
CN(C[C@@H](O)C[NH+]1CCN(C)CC1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000069619223	203027308	/nfs/dbraw/zinc/02/73/08/203027308.db2.gz	MFJSYGLXALXBPL-CYBMUJFWSA-N	1	1	342.827	1.293	50	5		EDBAMO
COC[C@@H](O)C[NH+]1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000019300914	274045219	/nfs/dbraw/zinc/04/52/19/274045219.db2.gz	RQMSCGBYCPPRLN-LBPRGKRZSA-N	1	1	329.784	1.378	50	5		EDBAMO
C[C@@H]1C[C@H](C)CN(c2nc(N3CC[NH+](C)CC3)nc(N)c2[N+](=O)[O-])C1	ZINC000005219746	288653035	/nfs/dbraw/zinc/65/30/35/288653035.db2.gz	UGEPCMWXDNYWHF-TXEJJXNPSA-N	1	1	349.439	1.201	50	5		EDBAMO
CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000058429146	441194768	/nfs/dbraw/zinc/19/47/68/441194768.db2.gz	FQGCSLWPTRXUIX-NSHDSACASA-N	1	1	337.376	1.826	50	5		EDBAMO
Cc1c(C[N@H+]2CCC[C@H](CNS(C)(=O)=O)C2)cccc1[N+](=O)[O-]	ZINC000048363316	441299423	/nfs/dbraw/zinc/29/94/23/441299423.db2.gz	QOGIFKSHCAJLNL-CYBMUJFWSA-N	1	1	341.433	1.664	50	5		EDBAMO
O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CC[N@H+]2CCCC[C@H]2C1	ZINC000242047988	443209991	/nfs/dbraw/zinc/20/99/91/443209991.db2.gz	VRUARNYJDULMHC-LSDHHAIUSA-N	1	1	335.404	1.505	50	5		EDBAMO
O=C(CC[N@@H+]1CCn2cnnc2C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000128547677	205150012	/nfs/dbraw/zinc/15/00/12/205150012.db2.gz	OQKZWPIUHUMBLB-UHFFFAOYSA-N	1	1	334.311	1.170	50	5		EDBAMO
O=C(CC[N@H+]1CCn2cnnc2C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000128547677	205150015	/nfs/dbraw/zinc/15/00/15/205150015.db2.gz	OQKZWPIUHUMBLB-UHFFFAOYSA-N	1	1	334.311	1.170	50	5		EDBAMO
C[N@@H+](CCCO)C1CCN(CCOc2ccccc2[N+](=O)[O-])CC1	ZINC000089346041	441540261	/nfs/dbraw/zinc/54/02/61/441540261.db2.gz	JISFUBALRZTSPT-UHFFFAOYSA-N	1	1	337.420	1.752	50	5		EDBAMO
O=C([C@H]1CCCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1)N1CCOCC1	ZINC000066892408	441579280	/nfs/dbraw/zinc/57/92/80/441579280.db2.gz	OSVNLAZIPSHMKP-QGZVFWFLSA-N	1	1	347.415	1.851	50	5		EDBAMO
O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CC[N@H+]2CCCC[C@@H]2C1	ZINC000096009813	441980341	/nfs/dbraw/zinc/98/03/41/441980341.db2.gz	VRUARNYJDULMHC-HUUCEWRRSA-N	1	1	335.404	1.505	50	5		EDBAMO
CC[NH+]1CCN(c2nc(N)c([N+](=O)[O-])c(N3CCCCCC3)n2)CC1	ZINC000005050382	273666898	/nfs/dbraw/zinc/66/68/98/273666898.db2.gz	SMRJCVJKVNYBBJ-UHFFFAOYSA-N	1	1	349.439	1.489	50	5		EDBAMO
O=C(Cc1cccc([N+](=O)[O-])c1)NCC1([NH+]2CCOCC2)CCCC1	ZINC000089780812	441578211	/nfs/dbraw/zinc/57/82/11/441578211.db2.gz	PVOABXNCHMZVMN-UHFFFAOYSA-N	1	1	347.415	1.899	50	5		EDBAMO
O=[N+]([O-])c1ccccc1-c1cnn(C[C@@H](O)C[NH+]2CCOCC2)c1	ZINC000096501883	442145513	/nfs/dbraw/zinc/14/55/13/442145513.db2.gz	NPFTWCDJVGGLMS-AWEZNQCLSA-N	1	1	332.360	1.151	50	5		EDBAMO
Nc1nc(N[C@@H]2[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)ncc1[N+](=O)[O-]	ZINC000370737784	446409982	/nfs/dbraw/zinc/40/99/82/446409982.db2.gz	MDCMUXOZYYMXGX-IMRBUKKESA-N	1	1	326.360	1.509	50	5		EDBAMO
C[N@H+](Cc1ccc(F)c(F)c1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000076082272	203335671	/nfs/dbraw/zinc/33/56/71/203335671.db2.gz	WSVMBXFBAAKFGM-GFCCVEGCSA-N	1	1	326.303	1.562	50	5		EDBAMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](C2CC2)C2Cc3ccccc3C2)c1	ZINC000075714906	441551446	/nfs/dbraw/zinc/55/14/46/441551446.db2.gz	FMQVRGDEEMADMB-SFHVURJKSA-N	1	1	342.399	1.784	50	5		EDBAMO
Nc1nnc(CC[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)s1	ZINC000097373518	442192616	/nfs/dbraw/zinc/19/26/16/442192616.db2.gz	XFHZECQOBBILLQ-UHFFFAOYSA-N	1	1	334.405	1.393	50	5		EDBAMO
Cc1cc(N2C[C@@H]3[C@H](C2)OCCN3C)c2cc([N+](=O)[O-])ccc2[nH+]1	ZINC000222267965	443075496	/nfs/dbraw/zinc/07/54/96/443075496.db2.gz	HYENLCWJSNXJAY-SJORKVTESA-N	1	1	328.372	1.971	50	5		EDBAMO
O=C(C[C@@H]1[NH2+][C@H]2CCCC[C@@H]2NC1=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000004702818	210253451	/nfs/dbraw/zinc/25/34/51/210253451.db2.gz	PDUFJMZIZWSOSY-IHRRRGAJSA-N	1	1	332.360	1.323	50	5		EDBAMO
O=C(NCCC[NH+]1CCOCC1)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000019800448	212069914	/nfs/dbraw/zinc/06/99/14/212069914.db2.gz	NQKVIUQQUPIAFQ-UHFFFAOYSA-N	1	1	327.768	1.700	50	5		EDBAMO
C[C@H](C[NH+]1CCOCC1)C(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1	ZINC000095453215	218396736	/nfs/dbraw/zinc/39/67/36/218396736.db2.gz	KTZJYSPJFRVCOB-CYBMUJFWSA-N	1	1	335.404	1.914	50	5		EDBAMO
COCC[N@H+]1CC[C@@H](CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000069811708	442045697	/nfs/dbraw/zinc/04/56/97/442045697.db2.gz	ZMPLKVGUOJTSOC-NSHDSACASA-N	1	1	341.795	1.946	50	5		EDBAMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[NH+]([C@H]2CCOC2)CC1	ZINC000089574025	217814863	/nfs/dbraw/zinc/81/48/63/217814863.db2.gz	APSYJVGGXJJNED-KGLIPLIRSA-N	1	1	348.403	1.328	50	5		EDBAMO
C[NH+]1CCN(CCC(C)(C)NC(=O)c2cc([N+](=O)[O-])ccc2N)CC1	ZINC000189843409	443019361	/nfs/dbraw/zinc/01/93/61/443019361.db2.gz	PODQJZLJISUQBO-UHFFFAOYSA-N	1	1	349.435	1.323	50	5		EDBAMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](C2CC2)C2Cc3ccccc3C2)c1	ZINC000075714905	441551636	/nfs/dbraw/zinc/55/16/36/441551636.db2.gz	FMQVRGDEEMADMB-GOSISDBHSA-N	1	1	342.399	1.784	50	5		EDBAMO
CC[NH+]1CCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)CC1	ZINC000069527459	441965208	/nfs/dbraw/zinc/96/52/08/441965208.db2.gz	LQKFKGLGWUCGFT-UHFFFAOYSA-N	1	1	329.360	1.558	50	5		EDBAMO
CS(=O)(=O)c1ccc(N2CC[N@@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000247546422	442861771	/nfs/dbraw/zinc/86/17/71/442861771.db2.gz	UPXJQCVAHGCRAQ-NSHDSACASA-N	1	1	325.390	1.283	50	5		EDBAMO
CS(=O)(=O)c1ccc(N2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000247546422	442861775	/nfs/dbraw/zinc/86/17/75/442861775.db2.gz	UPXJQCVAHGCRAQ-NSHDSACASA-N	1	1	325.390	1.283	50	5		EDBAMO
Cc1noc([C@@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CCN2C)n1	ZINC000285038350	443831688	/nfs/dbraw/zinc/83/16/88/443831688.db2.gz	WAKUTOYIBFBPRX-HNNXBMFYSA-N	1	1	331.376	1.817	50	5		EDBAMO
Cc1noc([C@@H]2C[N@H+](CCc3ccc([N+](=O)[O-])cc3)CCN2C)n1	ZINC000285038350	443831692	/nfs/dbraw/zinc/83/16/92/443831692.db2.gz	WAKUTOYIBFBPRX-HNNXBMFYSA-N	1	1	331.376	1.817	50	5		EDBAMO
CNC(=O)[C@H]1CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000067978718	215265819	/nfs/dbraw/zinc/26/58/19/215265819.db2.gz	KLQCDFHDTLECJF-CQSZACIVSA-N	1	1	334.376	1.442	50	5		EDBAMO
Cn1cnc([N+](=O)[O-])c1NC[C@@H](O)C[N@H+]1CCc2ccccc2C1	ZINC000040511146	213328209	/nfs/dbraw/zinc/32/82/09/213328209.db2.gz	VIDHQNYPMHCRKB-CQSZACIVSA-N	1	1	331.376	1.159	50	5		EDBAMO
O=[N+]([O-])c1cc(Br)ccc1N1CC[NH+](CCO)CC1	ZINC000040415188	275032930	/nfs/dbraw/zinc/03/29/30/275032930.db2.gz	GPTBFBXTVLQKDE-UHFFFAOYSA-N	1	1	330.182	1.472	50	5		EDBAMO
CC[NH+]1CCN(c2nc(N)c([N+](=O)[O-])c(N3CCC(C)CC3)n2)CC1	ZINC000005111459	276203864	/nfs/dbraw/zinc/20/38/64/276203864.db2.gz	FZUMAEBPXDUENO-UHFFFAOYSA-N	1	1	349.439	1.345	50	5		EDBAMO
C[NH+]1CCN(c2nc(N3CCCCCC3)nc(N)c2[N+](=O)[O-])CC1	ZINC000004306016	440916276	/nfs/dbraw/zinc/91/62/76/440916276.db2.gz	UORAIWBWIDQJDL-UHFFFAOYSA-N	1	1	335.412	1.099	50	5		EDBAMO
Cc1cc([N+](=O)[O-])cnc1NC[C@H]([C@H]1CCOC1)[NH+]1CCOCC1	ZINC000058424565	441193643	/nfs/dbraw/zinc/19/36/43/441193643.db2.gz	CYIFFNTZSLRGTN-DZGCQCFKSA-N	1	1	336.392	1.447	50	5		EDBAMO
O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CC[C@@H]([NH+]2CC=CC2)C1	ZINC000102197538	219190751	/nfs/dbraw/zinc/19/07/51/219190751.db2.gz	NBZHIOABKKQGHY-CQSZACIVSA-N	1	1	337.401	1.371	50	5		EDBAMO
CC(C)[C@@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[NH+](C)CC1	ZINC000012918266	441148230	/nfs/dbraw/zinc/14/82/30/441148230.db2.gz	ZHQBMFLAKNWHIU-MRXNPFEDSA-N	1	1	349.435	1.988	50	5		EDBAMO
CC1CCN(C(=O)[C@@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)CC1	ZINC000078972664	442001561	/nfs/dbraw/zinc/00/15/61/442001561.db2.gz	NMJCUIXXBIFLAJ-OAHLLOKOSA-N	1	1	349.435	1.762	50	5		EDBAMO
O=[N+]([O-])c1ccc(-c2cnn(C[C@@H](O)C[NH+]3CCOCC3)c2)cc1	ZINC000095438775	218382111	/nfs/dbraw/zinc/38/21/11/218382111.db2.gz	QJLRXVTWRURAIZ-INIZCTEOSA-N	1	1	332.360	1.151	50	5		EDBAMO
C[C@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)N1CC[NH+](C)CC1	ZINC000097112903	218961061	/nfs/dbraw/zinc/96/10/61/218961061.db2.gz	BUFNNFBEXQSWQY-CQSZACIVSA-N	1	1	346.431	1.722	50	5		EDBAMO
C[NH+]1CCN(c2ccc(C(=O)Nc3ccncc3)cc2[N+](=O)[O-])CC1	ZINC000008720844	277112784	/nfs/dbraw/zinc/11/27/84/277112784.db2.gz	JDIPYGQTUBPSSQ-UHFFFAOYSA-N	1	1	341.371	1.994	50	5		EDBAMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)Cn1nc(C)c([N+](=O)[O-])c1C	ZINC000069845283	442054721	/nfs/dbraw/zinc/05/47/21/442054721.db2.gz	MEMJLWAOJSDQHT-CQSZACIVSA-N	1	1	337.424	1.789	50	5		EDBAMO
C[C@@H]1C[N@H+]2CCC[C@H]2CN1S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000248433405	442891150	/nfs/dbraw/zinc/89/11/50/442891150.db2.gz	XMSKODKLTRZLCD-OCCSQVGLSA-N	1	1	339.417	1.593	50	5		EDBAMO