smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N=c1[n-]nc(CNC(=O)c2cc([O-])cc([N+](=O)[O-])c2)o1	ZINC000354840737	356511096	/nfs/dbraw/zinc/51/10/96/356511096.db2.gz	RQHBLEWRIRTDLX-UHFFFAOYSA-N	-2	0	279.212	0.026	20	5		CCBDRL
CC(C)n1cnc(=NC(=O)c2ccc([N+](=O)[O-])[n-]2)[n-]1	ZINC000593784141	360151151	/nfs/dbraw/zinc/15/11/51/360151151.db2.gz	JCGXYMCKULNJJA-UHFFFAOYSA-N	-2	0	264.245	0.770	20	5		CCBDRL
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c([O-])c1)C(=O)[O-]	ZINC000594459467	360319570	/nfs/dbraw/zinc/31/95/70/360319570.db2.gz	AOJAJEPFSZBQCU-ZCFIWIBFSA-N	-2	0	268.225	0.751	20	5		CCBDRL
N=c1[n-]nc(CCNC(=O)c2cccc([N+](=O)[O-])c2[O-])o1	ZINC000436842136	389985856	/nfs/dbraw/zinc/98/58/56/389985856.db2.gz	VRWHVCXAZNGDRL-UHFFFAOYSA-N	-2	0	293.239	0.068	20	5		CCBDRL
Cc1nc(NCCOP(=O)([O-])[O-])ncc1[N+](=O)[O-]	ZINC001157795806	801487541	/nfs/dbraw/zinc/48/75/41/801487541.db2.gz	LVBWQBNSZBBOAL-UHFFFAOYSA-N	-2	0	278.161	0.214	20	5		CCBDRL
COc1ccnc(NCCOP(=O)([O-])[O-])c1[N+](=O)[O-]	ZINC001168587645	897698306	/nfs/dbraw/zinc/69/83/06/897698306.db2.gz	UBCMELQAYZWARF-UHFFFAOYSA-N	-2	0	293.172	0.520	20	5		CCBDRL
O=C([O-])C[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000310888782	137072898	/nfs/dbraw/zinc/07/28/98/137072898.db2.gz	XUAHONHYAXEKBO-UHFFFAOYSA-N	-2	0	278.217	0.097	20	5		CCBDRL
O=C([O-])[C@]1(NC(=O)c2ccc([O-])c([N+](=O)[O-])c2)CCOC1	ZINC000595996523	360769770	/nfs/dbraw/zinc/76/97/70/360769770.db2.gz	DBWBTTDIQKDOLH-LBPRGKRZSA-N	-2	0	296.235	0.274	20	5		CCBDRL
CC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1[O-])C(=O)[O-]	ZINC000818308171	604305170	/nfs/dbraw/zinc/30/51/70/604305170.db2.gz	LXVCIVCEDPRANF-SSDOTTSWSA-N	-2	0	268.225	0.893	20	5		CCBDRL
C[C@@H](NC(=O)c1cc([O-])ccc1[N+](=O)[O-])C(=O)[O-]	ZINC001594206531	959273303	/nfs/dbraw/zinc/27/33/03/959273303.db2.gz	HKIGTWUWVJODJH-RXMQYKEDSA-N	-2	0	254.198	0.503	20	5		CCBDRL
O=C([O-])CCCNC(=O)c1cccc([O-])c1[N+](=O)[O-]	ZINC001606179477	973426888	/nfs/dbraw/zinc/42/68/88/973426888.db2.gz	OKZHKOULSXDULV-UHFFFAOYSA-N	-2	0	268.225	0.895	20	5		CCBDRL
CN(CCC(=O)[O-])C(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000262240826	137032219	/nfs/dbraw/zinc/03/22/19/137032219.db2.gz	BKDBMMMVVIBASF-UHFFFAOYSA-N	-2	0	268.225	0.847	20	5		CCBDRL
N=c1[n-]nc(CNC(=O)c2ccc([N+](=O)[O-])c([O-])c2)o1	ZINC000356545852	144012963	/nfs/dbraw/zinc/01/29/63/144012963.db2.gz	HLBOHXYERSGRET-UHFFFAOYSA-N	-2	0	279.212	0.026	20	5		CCBDRL
O=C(Nc1ccc([O-])c([N+](=O)[O-])c1)c1cc(=O)[nH][n-]1	ZINC000776193720	582057068	/nfs/dbraw/zinc/05/70/68/582057068.db2.gz	DKUVSPORZGINPU-UHFFFAOYSA-N	-2	0	264.197	0.115	20	5		CCBDRL
O=C([O-])[C@@H]1CCCN1C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000218481876	597456169	/nfs/dbraw/zinc/45/61/69/597456169.db2.gz	DSMKNCMQGVBGMI-VIFPVBQESA-N	-2	0	280.236	0.990	20	5		CCBDRL
O=C([O-])[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2[O-])CCO1	ZINC000819324855	604995893	/nfs/dbraw/zinc/99/58/93/604995893.db2.gz	VQCCFLUYGIJNPV-SECBINFHSA-N	-2	0	296.235	0.226	20	5		CCBDRL
O=C([O-])[C@@]1(F)CCN(C(=O)c2cc([O-])cc([N+](=O)[O-])c2)C1	ZINC000833785573	605716540	/nfs/dbraw/zinc/71/65/40/605716540.db2.gz	FAVDBKPDUUEEQB-GFCCVEGCSA-N	-2	0	298.226	0.939	20	5		CCBDRL
O=C([O-])N1CC(CNC(=O)c2cccc([N+](=O)[O-])c2[O-])C1	ZINC000834037794	605786472	/nfs/dbraw/zinc/78/64/72/605786472.db2.gz	GJDARJTWCIHZIS-UHFFFAOYSA-N	-2	0	295.251	0.640	20	5		CCBDRL
O=C([O-])C[C@@H](O)C(=O)Oc1cccc([O-])c1[N+](=O)[O-]	ZINC001225620665	805144212	/nfs/dbraw/zinc/14/42/12/805144212.db2.gz	SCUJQGYPLTUKRZ-ZCFIWIBFSA-N	-2	0	271.181	0.041	20	5		CCBDRL
CC[C@@H](NC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)C(=O)[O-]	ZINC001597288264	987369074	/nfs/dbraw/zinc/36/90/74/987369074.db2.gz	AFOUCYNHQHGFTF-SECBINFHSA-N	-2	0	296.235	0.886	20	5		CCBDRL
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c([O-])c1)C(=O)[O-]	ZINC000343982032	137171707	/nfs/dbraw/zinc/17/17/07/137171707.db2.gz	KNHXAERADOEYOT-RXMQYKEDSA-N	-2	0	254.198	0.503	20	5		CCBDRL
C[C@H](NS(=O)(=O)c1ccc([O-])c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000021812839	171330135	/nfs/dbraw/zinc/33/01/35/171330135.db2.gz	UAZDVMNEDMGHPS-YFKPBYRVSA-N	-2	0	290.253	0.052	20	5		CCBDRL
O=C([O-])CCCNC(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000821525785	604366053	/nfs/dbraw/zinc/36/60/53/604366053.db2.gz	PKVWRLRWECCSOL-UHFFFAOYSA-N	-2	0	268.225	0.895	20	5		CCBDRL
O=C([O-])N1CC[C@@H](NC(=O)c2cc([O-])cc([N+](=O)[O-])c2)C1	ZINC000831590706	605231834	/nfs/dbraw/zinc/23/18/34/605231834.db2.gz	FXUPCQAUMOCHPQ-MRVPVSSYSA-N	-2	0	295.251	0.783	20	5		CCBDRL
CN(CC(=O)[O-])C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000202573376	616049868	/nfs/dbraw/zinc/04/98/68/616049868.db2.gz	LXLHFQPNISTYOX-UHFFFAOYSA-N	-2	0	254.198	0.457	20	5		CCBDRL
CN(CC(=O)[O-])c1nccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC001598417737	991743587	/nfs/dbraw/zinc/74/35/87/991743587.db2.gz	BIZWQRXBHXJWAX-UHFFFAOYSA-N	-2	0	255.186	0.209	20	5		CCBDRL
O=C([O-])CCNC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000819498837	597265206	/nfs/dbraw/zinc/26/52/06/597265206.db2.gz	GSYYKRRLDPRMMJ-UHFFFAOYSA-N	-2	0	254.198	0.505	20	5		CCBDRL
O=C([O-])CCNC(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000821525435	597650788	/nfs/dbraw/zinc/65/07/88/597650788.db2.gz	TVDRNKDFIXWGOX-UHFFFAOYSA-N	-2	0	254.198	0.505	20	5		CCBDRL
O=C([O-])C1CN(C(=O)c2cccc([O-])c2[N+](=O)[O-])C1	ZINC001611396870	971026599	/nfs/dbraw/zinc/02/65/99/971026599.db2.gz	YGGFSRRLFZRTKK-UHFFFAOYSA-N	-2	0	266.209	0.457	20	5		CCBDRL
C[C@@H](C(=O)[O-])C(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000235072950	949844717	/nfs/dbraw/zinc/84/47/17/949844717.db2.gz	VROZTWNGIFRABF-RXMQYKEDSA-N	-2	0	254.198	0.960	20	5		CCBDRL
CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1[O-])C(=O)[O-]	ZINC001593605480	953431899	/nfs/dbraw/zinc/43/18/99/953431899.db2.gz	WSLWUPBYWCTDAX-MRVPVSSYSA-N	-2	0	268.225	0.893	20	5		CCBDRL
CO[C@@](C)(C(=O)[O-])C(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000595984144	360759919	/nfs/dbraw/zinc/75/99/19/360759919.db2.gz	AAZIIOMZMCTQOT-LLVKDONJSA-N	-2	0	284.224	0.729	20	5		CCBDRL
O=C([O-])[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000262271507	304186682	/nfs/dbraw/zinc/18/66/82/304186682.db2.gz	ILHXAGAOWYEJKW-SECBINFHSA-N	-2	0	280.236	0.990	20	5		CCBDRL
O=C([O-])[C@]1(F)CCN(C(=O)c2cc([O-])cc([N+](=O)[O-])c2)C1	ZINC000833785574	605717042	/nfs/dbraw/zinc/71/70/42/605717042.db2.gz	FAVDBKPDUUEEQB-LBPRGKRZSA-N	-2	0	298.226	0.939	20	5		CCBDRL
CN(CCNC(=O)c1ccc([O-])c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000833872666	616095617	/nfs/dbraw/zinc/09/56/17/616095617.db2.gz	NPCDHUDSNVZDBR-UHFFFAOYSA-N	-2	0	283.240	0.640	20	5		CCBDRL
O=C([O-])[C@@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC001594957332	954988644	/nfs/dbraw/zinc/98/86/44/954988644.db2.gz	GRPHOEVXSRMUBX-VIFPVBQESA-N	-2	0	296.235	0.226	20	5		CCBDRL
C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1[O-])C(=O)[O-]	ZINC001592694304	979147241	/nfs/dbraw/zinc/14/72/41/979147241.db2.gz	QKMPZCBYHKSTTO-ZCFIWIBFSA-N	-2	0	268.225	0.751	20	5		CCBDRL
CCN(CC(=O)[O-])C(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC001596219852	983610902	/nfs/dbraw/zinc/61/09/02/983610902.db2.gz	GGLVKPLLSOPTGT-UHFFFAOYSA-N	-2	0	268.225	0.847	20	5		CCBDRL
O=C([O-])[C@@H]1CCCN1C(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000262788913	137053552	/nfs/dbraw/zinc/05/35/52/137053552.db2.gz	KIPNYUBAZSPRDW-QMMMGPOBSA-N	-2	0	280.236	0.990	20	5		CCBDRL
O=C([O-])[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000821510867	598221208	/nfs/dbraw/zinc/22/12/08/598221208.db2.gz	QMKDAFRWKSNIQH-SSDOTTSWSA-N	-2	0	280.236	0.847	20	5		CCBDRL
O=C([O-])NCC(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000833777585	605568753	/nfs/dbraw/zinc/56/87/53/605568753.db2.gz	XNOWVEMTKQUJBJ-UHFFFAOYSA-N	-2	0	255.186	0.507	20	5		CCBDRL
CC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1[O-])C(=O)[O-]	ZINC000833643248	615811154	/nfs/dbraw/zinc/81/11/54/615811154.db2.gz	PRSFJFZHVXRXTO-QMMMGPOBSA-N	-2	0	268.225	0.893	20	5		CCBDRL
O=[N+]([O-])c1cccc(NCCOP(=O)([O-])[O-])n1	ZINC001157787259	801483594	/nfs/dbraw/zinc/48/35/94/801483594.db2.gz	GJEGHLSSKVKRTD-UHFFFAOYSA-N	-2	0	263.146	0.511	20	5		CCBDRL
COc1ncc([N+](=O)[O-])cc1NCCOP(=O)([O-])[O-]	ZINC001168591814	897718523	/nfs/dbraw/zinc/71/85/23/897718523.db2.gz	YWHJOOAKJIORFZ-UHFFFAOYSA-N	-2	0	293.172	0.520	20	5		CCBDRL
O=C(N[C@H]1C[C@@H](C(=O)[O-])C1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC001594794744	953706469	/nfs/dbraw/zinc/70/64/69/953706469.db2.gz	ULZRUQCPFFLKSQ-KNVOCYPGSA-N	-2	0	280.236	0.893	20	5		CCBDRL
COCC[C@H](NC(=O)c1ccc([N+](=O)[O-])c([O-])c1)C(=O)[O-]	ZINC001599217452	997606889	/nfs/dbraw/zinc/60/68/89/997606889.db2.gz	OYVSWJVWMVKBLX-QMMMGPOBSA-N	-2	0	298.251	0.520	20	5		CCBDRL
COc1cc(CN=c2[n-]nc(CO)o2)cc([N+](=O)[O-])c1[O-]	ZINC000356066953	356696474	/nfs/dbraw/zinc/69/64/74/356696474.db2.gz	YCQOTPJTZFOUSF-UHFFFAOYSA-N	-2	0	296.239	0.218	20	5		CCBDRL
COCCN(CC(=O)[O-])C(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000588960852	359352484	/nfs/dbraw/zinc/35/24/84/359352484.db2.gz	LTQKOCMPHIRNID-UHFFFAOYSA-N	-2	0	298.251	0.474	20	5		CCBDRL
O=C([O-])[C@@H]1CCN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)C1	ZINC000262832285	190063516	/nfs/dbraw/zinc/06/35/16/190063516.db2.gz	RTDAYRJMNDKMGW-MRVPVSSYSA-N	-2	0	280.236	0.847	20	5		CCBDRL
O=C([O-])CCCNC(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000821525738	598221201	/nfs/dbraw/zinc/22/12/01/598221201.db2.gz	LCJVPWZQWZCXAS-UHFFFAOYSA-N	-2	0	268.225	0.895	20	5		CCBDRL
O=C([O-])[C@@]1(F)CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000833785803	604788488	/nfs/dbraw/zinc/78/84/88/604788488.db2.gz	YHDWRRCVAPXOOU-GFCCVEGCSA-N	-2	0	298.226	0.939	20	5		CCBDRL
O=C([N-]n1c(=O)[n-][nH]c1=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000820289608	641494364	/nfs/dbraw/zinc/49/43/64/641494364.db2.gz	ZPNYJHOUPWRFPB-UHFFFAOYSA-N	-2	0	299.630	0.635	20	5		CCBDRL
Nc1cc([N+](=O)[O-])cnc1NCCOP(=O)([O-])[O-]	ZINC001157796138	801487997	/nfs/dbraw/zinc/48/79/97/801487997.db2.gz	XQPMGDRZWCAEEQ-UHFFFAOYSA-N	-2	0	278.161	0.093	20	5		CCBDRL
O=[N+]([O-])c1cc(NCCOP(=O)([O-])[O-])cnc1F	ZINC001168591558	897717828	/nfs/dbraw/zinc/71/78/28/897717828.db2.gz	BFNDSQLRJFBLDG-UHFFFAOYSA-N	-2	0	281.136	0.650	20	5		CCBDRL
O=C([O-])CCCNC(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000262839816	137054354	/nfs/dbraw/zinc/05/43/54/137054354.db2.gz	UDCNXGMNPYJRLQ-UHFFFAOYSA-N	-2	0	268.225	0.895	20	5		CCBDRL
O=C(Nc1nnn[n-]1)c1cc([O-])ccc1[N+](=O)[O-]	ZINC000352978189	356126054	/nfs/dbraw/zinc/12/60/54/356126054.db2.gz	UIKGEJKEOGAWSB-UHFFFAOYSA-N	-2	0	250.174	0.066	20	5		CCBDRL
O=C([O-])N1CC[C@H](NC(=O)c2cc([O-])cc([N+](=O)[O-])c2)C1	ZINC000831590707	605232056	/nfs/dbraw/zinc/23/20/56/605232056.db2.gz	FXUPCQAUMOCHPQ-QMMMGPOBSA-N	-2	0	295.251	0.783	20	5		CCBDRL
CN(CC(=O)[O-])C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000820562929	616049902	/nfs/dbraw/zinc/04/99/02/616049902.db2.gz	ZTSOGCBQLKIBRL-UHFFFAOYSA-N	-2	0	254.198	0.457	20	5		CCBDRL
O=C([N-]n1c(=O)[n-][nH]c1=O)c1ccc(F)cc1[N+](=O)[O-]	ZINC000820282018	641492239	/nfs/dbraw/zinc/49/22/39/641492239.db2.gz	HUPMOISQONLJMO-UHFFFAOYSA-N	-2	0	283.175	0.121	20	5		CCBDRL
O=C([O-])[C@H]1CCCN1C(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000262788911	131261328	/nfs/dbraw/zinc/26/13/28/131261328.db2.gz	KIPNYUBAZSPRDW-MRVPVSSYSA-N	-2	0	280.236	0.990	20	5		CCBDRL
CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c([O-])c1)C(=O)[O-]	ZINC000565563186	334574634	/nfs/dbraw/zinc/57/46/34/334574634.db2.gz	LTLJSGRJKVZOLQ-SSDOTTSWSA-N	-2	0	268.225	0.893	20	5		CCBDRL
CN(CCC(=O)[O-])C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000818447806	616068959	/nfs/dbraw/zinc/06/89/59/616068959.db2.gz	OOXOHKMLMWXNLF-UHFFFAOYSA-N	-2	0	268.225	0.847	20	5		CCBDRL
CN(CCC(=O)[O-])C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000820586343	616068962	/nfs/dbraw/zinc/06/89/62/616068962.db2.gz	ULORBVPFBMKRFQ-UHFFFAOYSA-N	-2	0	296.235	0.840	20	5		CCBDRL
CN(CCNC(=O)c1cc([N+](=O)[O-])ccc1[O-])C(=O)[O-]	ZINC000833872668	616095865	/nfs/dbraw/zinc/09/58/65/616095865.db2.gz	NUDZVGBBTSATTA-UHFFFAOYSA-N	-2	0	283.240	0.640	20	5		CCBDRL
O=[N+]([O-])c1c(Cl)ncnc1NCCOP(=O)([O-])[O-]	ZINC001168586939	897697815	/nfs/dbraw/zinc/69/78/15/897697815.db2.gz	OICGAUZLWCZVFW-UHFFFAOYSA-N	-2	0	298.579	0.559	20	5		CCBDRL
O=C([O-])[C@@]1(NC(=O)c2ccc([N+](=O)[O-])cc2[O-])CCOC1	ZINC001605736615	972378848	/nfs/dbraw/zinc/37/88/48/972378848.db2.gz	VPQJEVWIGOKXEY-GFCCVEGCSA-N	-2	0	296.235	0.274	20	5		CCBDRL
C[C@H](C(=O)[O-])N(C)C(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC001599886348	984641164	/nfs/dbraw/zinc/64/11/64/984641164.db2.gz	QGZDJEXPFDXUIY-ZCFIWIBFSA-N	-2	0	268.225	0.846	20	5		CCBDRL
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O=[N+]([O-])c1cc(S(=O)(=O)[N-]c2cncnc2)ccc1[O-]	ZINC000231773524	352133855	/nfs/dbraw/zinc/13/38/55/352133855.db2.gz	VPYNWDNKYTYLCW-UHFFFAOYSA-N	-2	0	296.264	0.891	20	5		CCBDRL
O=C([O-])[C@@]1(NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)CCOC1	ZINC000595996927	360769810	/nfs/dbraw/zinc/76/98/10/360769810.db2.gz	HFEVAQBHRLISQB-GFCCVEGCSA-N	-2	0	296.235	0.274	20	5		CCBDRL
O=C([O-])[C@H]1CC[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])O1	ZINC000226254412	130821829	/nfs/dbraw/zinc/82/18/29/130821829.db2.gz	JTDFIVYTVFWQQC-VHSXEESVSA-N	-2	0	296.235	0.871	20	5		CCBDRL
CC[C@@H](NC(=O)c1ccc([O-])c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000581907212	336164345	/nfs/dbraw/zinc/16/43/45/336164345.db2.gz	GISWVEYHURKJGA-SSDOTTSWSA-N	-2	0	268.225	0.893	20	5		CCBDRL
O=C([O-])[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000821508966	605561654	/nfs/dbraw/zinc/56/16/54/605561654.db2.gz	JEASJXKNVRXMKL-VIFPVBQESA-N	-2	0	280.236	0.990	20	5		CCBDRL
O=C([O-])N1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000834018387	605690215	/nfs/dbraw/zinc/69/02/15/605690215.db2.gz	YXVJOLZPIABRDR-SSDOTTSWSA-N	-2	0	295.251	0.783	20	5		CCBDRL
CCO[N-]C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000846494039	615372175	/nfs/dbraw/zinc/37/21/75/615372175.db2.gz	MYTZASRELXAXGX-UHFFFAOYSA-N	-2	0	283.240	0.098	20	5		CCBDRL
Cc1cccc(C(=O)[N-]n2c(=O)[n-][nH]c2=O)c1[N+](=O)[O-]	ZINC000816731346	641204339	/nfs/dbraw/zinc/20/43/39/641204339.db2.gz	NMOBNQHMMGLGOE-UHFFFAOYSA-N	-2	0	279.212	0.290	20	5		CCBDRL
O=[N+]([O-])c1cnc(NCCOP(=O)([O-])[O-])c(F)c1	ZINC001157787301	801483425	/nfs/dbraw/zinc/48/34/25/801483425.db2.gz	GZIIBAZZYHXGRP-UHFFFAOYSA-N	-2	0	281.136	0.650	20	5		CCBDRL
COc1ccc(NCCOP(=O)([O-])[O-])nc1[N+](=O)[O-]	ZINC001168587138	897698703	/nfs/dbraw/zinc/69/87/03/897698703.db2.gz	OVEZHEVGNUSSLY-UHFFFAOYSA-N	-2	0	293.172	0.520	20	5		CCBDRL
O=[N+]([O-])c1cccnc1NCCOP(=O)([O-])[O-]	ZINC001168591742	897716812	/nfs/dbraw/zinc/71/68/12/897716812.db2.gz	XOVWLTCJCJBQMM-UHFFFAOYSA-N	-2	0	263.146	0.511	20	5		CCBDRL
O=[N+]([O-])c1cncc(Cl)c1NCCOP(=O)([O-])[O-]	ZINC001168592363	897722819	/nfs/dbraw/zinc/72/28/19/897722819.db2.gz	RIGRXWYLZGGMOH-UHFFFAOYSA-N	-2	0	297.591	0.586	20	5		CCBDRL
CC(C)(NC(=O)c1cccc([O-])c1[N+](=O)[O-])C(=O)[O-]	ZINC001590863955	990755642	/nfs/dbraw/zinc/75/56/42/990755642.db2.gz	JJZYHUBIJHCFBC-UHFFFAOYSA-N	-2	0	268.225	0.893	20	5		CCBDRL
O=C([O-])[C@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000590645382	359503568	/nfs/dbraw/zinc/50/35/68/359503568.db2.gz	WGUNBEOPFONOPQ-SECBINFHSA-N	-2	0	296.235	0.226	20	5		CCBDRL
C[C@@H](NS(=O)(=O)c1ccc([O-])c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000021812838	171330267	/nfs/dbraw/zinc/33/02/67/171330267.db2.gz	UAZDVMNEDMGHPS-RXMQYKEDSA-N	-2	0	290.253	0.052	20	5		CCBDRL
O=C([O-])NCCCNC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000740654593	581708106	/nfs/dbraw/zinc/70/81/06/581708106.db2.gz	CTCLACNCLFHWLJ-UHFFFAOYSA-N	-2	0	283.240	0.688	20	5		CCBDRL
O=C([O-])CNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000226600658	597027991	/nfs/dbraw/zinc/02/79/91/597027991.db2.gz	HNSNDAIRLAYUDJ-UHFFFAOYSA-N	-2	0	278.217	0.097	20	5		CCBDRL
O=C([O-])[C@H]1CN(Cc2cc([O-])ccc2[N+](=O)[O-])CCO1	ZINC000821512727	598122784	/nfs/dbraw/zinc/12/27/84/598122784.db2.gz	NGISHRRMRCCFHD-LLVKDONJSA-N	-2	0	282.252	0.586	20	5		CCBDRL
O=[N+]([O-])c1cc(F)cnc1NCCOP(=O)([O-])[O-]	ZINC001157787825	801485266	/nfs/dbraw/zinc/48/52/66/801485266.db2.gz	QDGCOKXEPVKEPA-UHFFFAOYSA-N	-2	0	281.136	0.650	20	5		CCBDRL
O=[N+]([O-])c1c([O-])cc(O)cc1OC[C@H]1COCO1	ZINC001228970199	805494287	/nfs/dbraw/zinc/49/42/87/805494287.db2.gz	HDRDMTVCNSZYNU-SSDOTTSWSA-N	-2	0	257.198	0.758	20	5		CCBDRL
COc1nc(NCCOP(=O)([O-])[O-])ccc1[N+](=O)[O-]	ZINC001157787838	837436551	/nfs/dbraw/zinc/43/65/51/837436551.db2.gz	QTSZFTBIBILROC-UHFFFAOYSA-N	-2	0	293.172	0.520	20	5		CCBDRL
CN(CCNC(=O)c1cccc([N+](=O)[O-])c1[O-])C(=O)[O-]	ZINC000828330162	616095698	/nfs/dbraw/zinc/09/56/98/616095698.db2.gz	STLWCFAIQNGOLS-UHFFFAOYSA-N	-2	0	283.240	0.640	20	5		CCBDRL
O=C([O-])C[C@H](O)C(=O)Oc1cccc([O-])c1[N+](=O)[O-]	ZINC001225620662	805144417	/nfs/dbraw/zinc/14/44/17/805144417.db2.gz	SCUJQGYPLTUKRZ-LURJTMIESA-N	-2	0	271.181	0.041	20	5		CCBDRL
O=C([O-])C[C@@H](O)C(=O)Oc1nc2ccc([N+](=O)[O-])cc2[n-]1	ZINC001227744225	805385656	/nfs/dbraw/zinc/38/56/56/805385656.db2.gz	FOCNSTFRYNPEKG-MRVPVSSYSA-N	-2	0	295.207	0.212	20	5		CCBDRL
C[C@H](C(=O)[O-])C(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000235443696	949864134	/nfs/dbraw/zinc/86/41/34/949864134.db2.gz	VROZTWNGIFRABF-YFKPBYRVSA-N	-2	0	254.198	0.960	20	5		CCBDRL
CN(CCC(=O)[O-])C(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC001604143149	972549942	/nfs/dbraw/zinc/54/99/42/972549942.db2.gz	PINYFZNKGGIDBB-UHFFFAOYSA-N	-2	0	268.225	0.847	20	5		CCBDRL
CN(CC(=O)[O-])c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC001598417752	991743650	/nfs/dbraw/zinc/74/36/50/991743650.db2.gz	CJCNXLVZUZIWNW-UHFFFAOYSA-N	-2	0	254.198	0.814	20	5		CCBDRL
O=C([O-])[C@H]1CC[C@H](C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])O1	ZINC000226254434	352021826	/nfs/dbraw/zinc/02/18/26/352021826.db2.gz	JTDFIVYTVFWQQC-NXEZZACHSA-N	-2	0	296.235	0.871	20	5		CCBDRL
CN(Cc1n[n-]c(=O)o1)C(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000588849377	359340570	/nfs/dbraw/zinc/34/05/70/359340570.db2.gz	YQELLMLJPPCJCK-UHFFFAOYSA-N	-2	0	294.223	0.661	20	5		CCBDRL
CC[C@H](NC(=O)c1ccc([O-])c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000592379096	359828248	/nfs/dbraw/zinc/82/82/48/359828248.db2.gz	GISWVEYHURKJGA-ZETCQYMHSA-N	-2	0	268.225	0.893	20	5		CCBDRL
O=C([O-])N1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)C1	ZINC000740404988	581676986	/nfs/dbraw/zinc/67/69/86/581676986.db2.gz	YKYRDIJRAMTXGH-MRVPVSSYSA-N	-2	0	295.251	0.783	20	5		CCBDRL
C[C@H](COC(=O)c1ccc([N+](=O)[O-])[n-]1)NC(=O)[O-]	ZINC000824993745	604195240	/nfs/dbraw/zinc/19/52/40/604195240.db2.gz	BZRHVQRMROTFEF-RXMQYKEDSA-N	-2	0	257.202	0.736	20	5		CCBDRL
CC(=O)N1CC(Oc2cc(O)cc([O-])c2[N+](=O)[O-])C1	ZINC001228970117	805494136	/nfs/dbraw/zinc/49/41/36/805494136.db2.gz	GDRWTGYQXWEQQU-UHFFFAOYSA-N	-2	0	268.225	0.616	20	5		CCBDRL
CNc1cc([N+](=O)[O-])cnc1NCCOP(=O)([O-])[O-]	ZINC001168590220	897710371	/nfs/dbraw/zinc/71/03/71/897710371.db2.gz	WKDUZVRNZXCCSF-UHFFFAOYSA-N	-2	0	292.188	0.553	20	5		CCBDRL
O=C(N[C@H]1C[C@@H](C(=O)[O-])C1)c1cccc([N+](=O)[O-])c1[O-]	ZINC001601572120	971021208	/nfs/dbraw/zinc/02/12/08/971021208.db2.gz	HEFPHLVICWKDQI-KNVOCYPGSA-N	-2	0	280.236	0.893	20	5		CCBDRL
O=C([O-])N[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C1	ZINC000740584938	581373713	/nfs/dbraw/zinc/37/37/13/581373713.db2.gz	DFLQQDCDYCFOBY-QMMMGPOBSA-N	-2	0	295.251	0.783	20	5		CCBDRL
C[C@H](C(=O)[O-])N(C)C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000817762772	597265990	/nfs/dbraw/zinc/26/59/90/597265990.db2.gz	WIQLJQSTCHWYGH-ZCFIWIBFSA-N	-2	0	268.225	0.846	20	5		CCBDRL
C[C@@H](C(=O)[O-])N(C)C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000819888880	598221133	/nfs/dbraw/zinc/22/11/33/598221133.db2.gz	GBUHKKLWIDKXBC-LURJTMIESA-N	-2	0	268.225	0.846	20	5		CCBDRL
O=C([O-])[C@@H](NC(=O)c1ccc([N+](=O)[O-])c([O-])c1)C1CC1	ZINC000833125379	601758075	/nfs/dbraw/zinc/75/80/75/601758075.db2.gz	OBMANBUHFUVIKS-JTQLQIEISA-N	-2	0	280.236	0.893	20	5		CCBDRL
C[C@@H](CNC(=O)c1cccc([O-])c1[N+](=O)[O-])C(=O)[O-]	ZINC001589063037	955730101	/nfs/dbraw/zinc/73/01/01/955730101.db2.gz	PJCNKSJGKLMACU-LURJTMIESA-N	-2	0	268.225	0.751	20	5		CCBDRL
O=C(N[C@H]1C[C@H](C(=O)[O-])C1)c1ccc([N+](=O)[O-])c([O-])c1	ZINC001605839543	972575188	/nfs/dbraw/zinc/57/51/88/972575188.db2.gz	PBWDLIXEIVWHSN-ZKCHVHJHSA-N	-2	0	280.236	0.893	20	5		CCBDRL
C[C@@]1(C(=O)[O-])CCN(c2nc(C(=O)[O-])ccc2[N+](=O)[O-])C1	ZINC001593800999	996521656	/nfs/dbraw/zinc/52/16/56/996521656.db2.gz	KLUSJUFKGFVWFA-GFCCVEGCSA-N	-2	0	295.251	0.989	20	5		CCBDRL
O=C([O-])[C@@H]1CC[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2[O-])O1	ZINC000226254445	352021927	/nfs/dbraw/zinc/02/19/27/352021927.db2.gz	UHUYSKMSTZQSAY-UWVGGRQHSA-N	-2	0	296.235	0.871	20	5		CCBDRL
O=C([O-])N[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000834180884	605737484	/nfs/dbraw/zinc/73/74/84/605737484.db2.gz	AFQVIVSJVKFIIA-ZETCQYMHSA-N	-2	0	295.251	0.783	20	5		CCBDRL
O=C([O-])N1CC(NC(=O)c2cc([O-])cc([N+](=O)[O-])c2)C1	ZINC000834018740	605782298	/nfs/dbraw/zinc/78/22/98/605782298.db2.gz	MGFASWOWNCNVGE-UHFFFAOYSA-N	-2	0	281.224	0.392	20	5		CCBDRL
O=C([N-]n1c(=O)[n-][nH]c1=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000816731095	641203211	/nfs/dbraw/zinc/20/32/11/641203211.db2.gz	ATMMVCTUIBOLIC-UHFFFAOYSA-N	-2	0	299.630	0.635	20	5		CCBDRL
O=C([O-])[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000262271512	137034205	/nfs/dbraw/zinc/03/42/05/137034205.db2.gz	ILHXAGAOWYEJKW-VIFPVBQESA-N	-2	0	280.236	0.990	20	5		CCBDRL
CN(CC(=O)[O-])C(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000343918836	137166654	/nfs/dbraw/zinc/16/66/54/137166654.db2.gz	BRDVOAMMCUMQBN-UHFFFAOYSA-N	-2	0	254.198	0.457	20	5		CCBDRL
COCCS(=O)(=O)[N-]c1cc([N+](=O)[O-])ccc1[O-]	ZINC000219465940	351967641	/nfs/dbraw/zinc/96/76/41/351967641.db2.gz	ZZTVNTZIBJGRBH-UHFFFAOYSA-N	-2	0	276.270	0.689	20	5		CCBDRL
C[C@H](CC(=O)[O-])NC(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000436847180	389986047	/nfs/dbraw/zinc/98/60/47/389986047.db2.gz	ZPESFKYACNUZHY-ZCFIWIBFSA-N	-2	0	268.225	0.893	20	5		CCBDRL
O=C([O-])N[C@@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2[O-])C1	ZINC000832382434	605763686	/nfs/dbraw/zinc/76/36/86/605763686.db2.gz	XCROFZJCHSHUTK-SSDOTTSWSA-N	-2	0	295.251	0.783	20	5		CCBDRL
O=C(N[C@H]1C[C@@H](C(=O)[O-])C1)c1cc([O-])cc([N+](=O)[O-])c1	ZINC001594794817	953705986	/nfs/dbraw/zinc/70/59/86/953705986.db2.gz	YIQUDAPIKJFUNQ-OCAPTIKFSA-N	-2	0	280.236	0.893	20	5		CCBDRL
C[C@H](NC(=O)c1cc([O-])ccc1[N+](=O)[O-])C(=O)[O-]	ZINC001610395338	970737699	/nfs/dbraw/zinc/73/76/99/970737699.db2.gz	HKIGTWUWVJODJH-YFKPBYRVSA-N	-2	0	254.198	0.503	20	5		CCBDRL
O=C([O-])[C@H]1COCCN1Cc1cc([O-])ccc1[N+](=O)[O-]	ZINC000593288448	360061076	/nfs/dbraw/zinc/06/10/76/360061076.db2.gz	KGSKCXMWTYPWJV-LLVKDONJSA-N	-2	0	282.252	0.586	20	5		CCBDRL
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c([O-])c1)C(=O)[O-]	ZINC000594459466	360319326	/nfs/dbraw/zinc/31/93/26/360319326.db2.gz	AOJAJEPFSZBQCU-LURJTMIESA-N	-2	0	268.225	0.751	20	5		CCBDRL
O=C([O-])[C@]1(NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)CCOC1	ZINC000595996928	360769775	/nfs/dbraw/zinc/76/97/75/360769775.db2.gz	HFEVAQBHRLISQB-LBPRGKRZSA-N	-2	0	296.235	0.274	20	5		CCBDRL
O=C(N=c1nc2n([n-]1)CCCC2)c1ccc([N+](=O)[O-])[n-]1	ZINC000457140125	390032799	/nfs/dbraw/zinc/03/27/99/390032799.db2.gz	GAEQRUZZLSRJLY-UHFFFAOYSA-N	-2	0	276.256	0.525	20	5		CCBDRL
N=c1[n-]nc(CCNC(=O)c2ccc([N+](=O)[O-])c([O-])c2)o1	ZINC000356759774	144030462	/nfs/dbraw/zinc/03/04/62/144030462.db2.gz	DIHLPCMOFGZIKZ-UHFFFAOYSA-N	-2	0	293.239	0.068	20	5		CCBDRL
O=C([N-]n1c(=O)[n-][nH]c1=O)c1ccc([N+](=O)[O-])cc1F	ZINC000816734201	641207981	/nfs/dbraw/zinc/20/79/81/641207981.db2.gz	CSGPBWSCDOFQFC-UHFFFAOYSA-N	-2	0	283.175	0.121	20	5		CCBDRL
O=C([O-])C[C@H](O)C(=O)Oc1nc2ccc([N+](=O)[O-])cc2[n-]1	ZINC001227744229	805385808	/nfs/dbraw/zinc/38/58/08/805385808.db2.gz	FOCNSTFRYNPEKG-QMMMGPOBSA-N	-2	0	295.207	0.212	20	5		CCBDRL
C[C@H](CC(=O)[O-])NC(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC001603127689	972221160	/nfs/dbraw/zinc/22/11/60/972221160.db2.gz	RQVSWHIASNMVHB-ZCFIWIBFSA-N	-2	0	268.225	0.893	20	5		CCBDRL
O=C([O-])[C@]1(NC(=O)c2ccc([N+](=O)[O-])cc2[O-])CCOC1	ZINC001605736616	972378521	/nfs/dbraw/zinc/37/85/21/972378521.db2.gz	VPQJEVWIGOKXEY-LBPRGKRZSA-N	-2	0	296.235	0.274	20	5		CCBDRL
C[C@@H](CC(=O)[O-])NC(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC001599834120	970717143	/nfs/dbraw/zinc/71/71/43/970717143.db2.gz	RQVSWHIASNMVHB-LURJTMIESA-N	-2	0	268.225	0.893	20	5		CCBDRL
N=c1[n-]nc(CNC(=O)c2ccc([N+](=O)[O-])cc2[O-])o1	ZINC000436595557	389980514	/nfs/dbraw/zinc/98/05/14/389980514.db2.gz	MBBUQVOZMZOWBZ-UHFFFAOYSA-N	-2	0	279.212	0.026	20	5		CCBDRL
CC(C)(NC(=O)c1ccc([N+](=O)[O-])cc1[O-])c1nnn[n-]1	ZINC000436977342	389989163	/nfs/dbraw/zinc/98/91/63/389989163.db2.gz	DEIKQCGLVAZQTM-UHFFFAOYSA-N	-2	0	292.255	0.479	20	5		CCBDRL
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CCO[N-]C(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000846493194	615371996	/nfs/dbraw/zinc/37/19/96/615371996.db2.gz	REBJFXZUFLVKHC-UHFFFAOYSA-N	-2	0	283.240	0.098	20	5		CCBDRL
O=C([O-])Cn1cnc([N-]C(=O)c2ccc([N+](=O)[O-])s2)n1	ZINC001595160380	952190993	/nfs/dbraw/zinc/19/09/93/952190993.db2.gz	MHIGODNTBHILTK-UHFFFAOYSA-N	-2	0	297.252	0.585	20	5		CCBDRL
CC[C@H](NC(=O)c1cccc([O-])c1[N+](=O)[O-])C(=O)[O-]	ZINC001595270200	980285293	/nfs/dbraw/zinc/28/52/93/980285293.db2.gz	BKTUPHKUOGAWDW-ZETCQYMHSA-N	-2	0	268.225	0.893	20	5		CCBDRL
C[C@@H](NC(=O)[O-])C(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000833895405	605569992	/nfs/dbraw/zinc/56/99/92/605569992.db2.gz	UMMUDNOMGAZDFA-RXMQYKEDSA-N	-2	0	269.213	0.895	20	5		CCBDRL
O=C([O-])NCCNC(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000834242969	605691817	/nfs/dbraw/zinc/69/18/17/605691817.db2.gz	CYFMMGXAYYSRDB-UHFFFAOYSA-N	-2	0	269.213	0.298	20	5		CCBDRL
C[C@](O)(CNc1cc(C(=O)[O-])ccc1[N+](=O)[O-])C(=O)[O-]	ZINC001593417516	995205462	/nfs/dbraw/zinc/20/54/62/995205462.db2.gz	WUMKEZAMHBDAIM-NSHDSACASA-N	-2	0	284.224	0.541	20	5		CCBDRL
COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1[O-])C(=O)[O-]	ZINC001599174360	996813571	/nfs/dbraw/zinc/81/35/71/996813571.db2.gz	KKEIAAPMSBQJTP-MRVPVSSYSA-N	-2	0	284.224	0.130	20	5		CCBDRL
O=C([O-])NCCCOC(=O)c1ccc([N+](=O)[O-])[n-]1	ZINC000740654939	581536754	/nfs/dbraw/zinc/53/67/54/581536754.db2.gz	AASUNSBTHOVCDI-UHFFFAOYSA-N	-2	0	257.202	0.737	20	5		CCBDRL
O=C([O-])[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])CCO1	ZINC000821512224	598221247	/nfs/dbraw/zinc/22/12/47/598221247.db2.gz	FPKFMMZICPTMJG-SNVBAGLBSA-N	-2	0	296.235	0.226	20	5		CCBDRL
O=C([O-])c1ccc(OCc2nnn[n-]2)c([N+](=O)[O-])c1	ZINC000095152927	601349883	/nfs/dbraw/zinc/34/98/83/601349883.db2.gz	QFZIYLFDXIWPHY-UHFFFAOYSA-N	-2	0	265.185	0.385	20	5		CCBDRL
CCn1ncn([N-]C(=O)c2ccc([N+](=O)[O-])cc2[O-])c1=O	ZINC000816735410	615733871	/nfs/dbraw/zinc/73/38/71/615733871.db2.gz	FRNPEXAETAEGDJ-UHFFFAOYSA-N	-2	0	293.239	0.062	20	5		CCBDRL
Cc1cnc(NCCOP(=O)([O-])[O-])c([N+](=O)[O-])c1	ZINC001157786851	837433935	/nfs/dbraw/zinc/43/39/35/837433935.db2.gz	CEDDBDULAFBHCG-UHFFFAOYSA-N	-2	0	277.173	0.819	20	5		CCBDRL
COc1cnc(NCCOP(=O)([O-])[O-])c([N+](=O)[O-])c1	ZINC001157787349	837435388	/nfs/dbraw/zinc/43/53/88/837435388.db2.gz	HSXJGVPNSVNWME-UHFFFAOYSA-N	-2	0	293.172	0.520	20	5		CCBDRL
O=C([O-])C1CN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)C1	ZINC001594951652	954958698	/nfs/dbraw/zinc/95/86/98/954958698.db2.gz	ZDFFLVVQISSNQY-UHFFFAOYSA-N	-2	0	266.209	0.457	20	5		CCBDRL
O=C([O-])[C@H]1COCCN1C(=O)c1cccc([O-])c1[N+](=O)[O-]	ZINC001594957238	954988694	/nfs/dbraw/zinc/98/86/94/954988694.db2.gz	BIVBTBFHNCXYPM-MRVPVSSYSA-N	-2	0	296.235	0.226	20	5		CCBDRL
C[C@H](CC(=O)[O-])NC(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC001599888141	984661475	/nfs/dbraw/zinc/66/14/75/984661475.db2.gz	BQVCYMYSYPIWHT-ZCFIWIBFSA-N	-2	0	268.225	0.893	20	5		CCBDRL
Cn1c(C2CC2)n[n-]c1=NC(=O)c1ccc([N+](=O)[O-])[n-]1	ZINC000597897217	361278603	/nfs/dbraw/zinc/27/86/03/361278603.db2.gz	LFSRYQPYBIOTRI-UHFFFAOYSA-N	-2	0	276.256	0.603	20	5		CCBDRL
COc1cc(CN=c2[n-]nco2)cc([N+](=O)[O-])c1[O-]	ZINC000351550492	389612317	/nfs/dbraw/zinc/61/23/17/389612317.db2.gz	LSWRUILZRWXQGC-UHFFFAOYSA-N	-2	0	266.213	0.726	20	5		CCBDRL
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O=C([O-])NCCNC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000832657718	604111133	/nfs/dbraw/zinc/11/11/33/604111133.db2.gz	FIKUNIDOFIVRLC-UHFFFAOYSA-N	-2	0	269.213	0.298	20	5		CCBDRL
O=C([O-])[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1[O-])C1CC1	ZINC000833126021	604297309	/nfs/dbraw/zinc/29/73/09/604297309.db2.gz	WPYYSWARXWBBMO-VIFPVBQESA-N	-2	0	280.236	0.893	20	5		CCBDRL
O=C([O-])N1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000834018388	605690153	/nfs/dbraw/zinc/69/01/53/605690153.db2.gz	YXVJOLZPIABRDR-ZETCQYMHSA-N	-2	0	295.251	0.783	20	5		CCBDRL
COC[C@@](C)(NC(=O)c1cc([N+](=O)[O-])ccc1[O-])C(=O)[O-]	ZINC000833722059	617022762	/nfs/dbraw/zinc/02/27/62/617022762.db2.gz	YLVMMBPHPFQARF-GFCCVEGCSA-N	-2	0	298.251	0.520	20	5		CCBDRL
O=C([N-]N1CCCNC1=O)c1cc([O-])ccc1[N+](=O)[O-]	ZINC000803052189	640715199	/nfs/dbraw/zinc/71/51/99/640715199.db2.gz	WPTDDDUIUBMQGM-UHFFFAOYSA-N	-2	0	280.240	0.361	20	5		CCBDRL
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O=C([O-])CCNC(=O)c1cc([O-])ccc1[N+](=O)[O-]	ZINC001606196954	973448565	/nfs/dbraw/zinc/44/85/65/973448565.db2.gz	YXYYAXVJCABQDX-UHFFFAOYSA-N	-2	0	254.198	0.505	20	5		CCBDRL
C[C@H](CC(=O)[O-])Nc1ncc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC001592418275	978021133	/nfs/dbraw/zinc/02/11/33/978021133.db2.gz	IMZOLDLGWSPTHT-RXMQYKEDSA-N	-2	0	269.213	0.963	20	5		CCBDRL
C[C@@H](CNC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)C(=O)[O-]	ZINC001592693745	979144114	/nfs/dbraw/zinc/14/41/14/979144114.db2.gz	AFPXINDIDFVASQ-LURJTMIESA-N	-2	0	296.235	0.744	20	5		CCBDRL
O=C([O-])[C@H]1CCCN1C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000218481807	598208350	/nfs/dbraw/zinc/20/83/50/598208350.db2.gz	DSMKNCMQGVBGMI-SECBINFHSA-N	-2	0	280.236	0.990	20	5		CCBDRL
O=C([O-])[C@@H]1COCCN1C(=O)c1cccc([O-])c1[N+](=O)[O-]	ZINC001594957240	954988478	/nfs/dbraw/zinc/98/84/78/954988478.db2.gz	BIVBTBFHNCXYPM-QMMMGPOBSA-N	-2	0	296.235	0.226	20	5		CCBDRL
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1[O-])C(=O)[O-]	ZINC001589062582	955726134	/nfs/dbraw/zinc/72/61/34/955726134.db2.gz	FYDXAMZTBWTFAD-LURJTMIESA-N	-2	0	268.225	0.751	20	5		CCBDRL
CCN(CC(=O)[O-])C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC001596221484	983612456	/nfs/dbraw/zinc/61/24/56/983612456.db2.gz	VYHZPSXWCYIBAZ-UHFFFAOYSA-N	-2	0	268.225	0.847	20	5		CCBDRL
C[C@@H]([N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-])C(=O)[O-]	ZINC000311828362	137075750	/nfs/dbraw/zinc/07/57/50/137075750.db2.gz	DTJLOBQSBWNWNY-RXMQYKEDSA-N	-2	0	292.244	0.485	20	5		CCBDRL
O=C([N-]N1CCCCC1=O)c1cccc([O-])c1[N+](=O)[O-]	ZINC000280671036	353374592	/nfs/dbraw/zinc/37/45/92/353374592.db2.gz	BLGRPEKKVMLQNK-UHFFFAOYSA-N	-2	0	279.252	0.958	20	5		CCBDRL
O=C([O-])[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)CCO1	ZINC000588960872	359353072	/nfs/dbraw/zinc/35/30/72/359353072.db2.gz	LTRDUJGPLWXWMG-SNVBAGLBSA-N	-2	0	296.235	0.226	20	5		CCBDRL
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C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1[O-])C(=O)[O-]	ZINC000818046394	604326876	/nfs/dbraw/zinc/32/68/76/604326876.db2.gz	XEYICTMOVJIVJY-RXMQYKEDSA-N	-2	0	254.198	0.503	20	5		CCBDRL
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CCO[N-]C(=O)CNC(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000846494287	615371337	/nfs/dbraw/zinc/37/13/37/615371337.db2.gz	NXYNXHWHMXFJGU-UHFFFAOYSA-N	-2	0	283.240	0.098	20	5		CCBDRL
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COCC[C@H](NC(=O)c1cc([O-])ccc1[N+](=O)[O-])C(=O)[O-]	ZINC001599216249	997587228	/nfs/dbraw/zinc/58/72/28/997587228.db2.gz	LEVTUCCRCPKDBP-VIFPVBQESA-N	-2	0	298.251	0.520	20	5		CCBDRL
C[C@@H](CC(=O)[O-])NC(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000436847176	389985794	/nfs/dbraw/zinc/98/57/94/389985794.db2.gz	ZPESFKYACNUZHY-LURJTMIESA-N	-2	0	268.225	0.893	20	5		CCBDRL
O=C(NC1(c2nnn[n-]2)CC1)c1cccc([N+](=O)[O-])c1[O-]	ZINC000436841227	389985994	/nfs/dbraw/zinc/98/59/94/389985994.db2.gz	TUDRBAYFSCKGTJ-UHFFFAOYSA-N	-2	0	290.239	0.233	20	5		CCBDRL
O=C([O-])CC[C@@H](O)C(=O)Oc1cccc([O-])c1[N+](=O)[O-]	ZINC001225620160	805145088	/nfs/dbraw/zinc/14/50/88/805145088.db2.gz	NZFVKIAIGCFYPF-SSDOTTSWSA-N	-2	0	285.208	0.432	20	5		CCBDRL
Cc1cc([N+](=O)[O-])cnc1NCCOP(=O)([O-])[O-]	ZINC001157787543	837435394	/nfs/dbraw/zinc/43/53/94/837435394.db2.gz	MBYABMNDAOBXJO-UHFFFAOYSA-N	-2	0	277.173	0.819	20	5		CCBDRL
CC(C)(NC(=O)c1ccc([N+](=O)[O-])cc1[O-])C(=O)[O-]	ZINC001602952062	971929174	/nfs/dbraw/zinc/92/91/74/971929174.db2.gz	MBDZZDAOLWAQQA-UHFFFAOYSA-N	-2	0	268.225	0.893	20	5		CCBDRL
CN(CC(=O)[O-])C(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC001593721192	954255626	/nfs/dbraw/zinc/25/56/26/954255626.db2.gz	ZSSTUCQFQODBIN-UHFFFAOYSA-N	-2	0	254.198	0.457	20	5		CCBDRL
O=C([O-])[C@@H]1COCCN1C(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000590645291	359503755	/nfs/dbraw/zinc/50/37/55/359503755.db2.gz	LJBRVZFSNABZMF-VIFPVBQESA-N	-2	0	296.235	0.226	20	5		CCBDRL
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N=c1[n-]nc(CNC(=O)c2ccc([O-])c([N+](=O)[O-])c2)o1	ZINC000436917424	389987272	/nfs/dbraw/zinc/98/72/72/389987272.db2.gz	DOICVTWURSATNJ-UHFFFAOYSA-N	-2	0	279.212	0.026	20	5		CCBDRL
O=C([O-])[C@H]1CCN(C(=O)c2cc([O-])cc([N+](=O)[O-])c2)C1	ZINC000821510371	597654377	/nfs/dbraw/zinc/65/43/77/597654377.db2.gz	BWTBJSFXFSDMKV-ZETCQYMHSA-N	-2	0	280.236	0.847	20	5		CCBDRL
C[C@@H](NC(=O)c1cc([O-])cc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000820129922	597657379	/nfs/dbraw/zinc/65/73/79/597657379.db2.gz	SNTQZPUSGSZFRH-RXMQYKEDSA-N	-2	0	254.198	0.503	20	5		CCBDRL
O=C([O-])CCCNC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000819454200	601592431	/nfs/dbraw/zinc/59/24/31/601592431.db2.gz	PBYOOTYRZSVQGM-UHFFFAOYSA-N	-2	0	268.225	0.895	20	5		CCBDRL
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Cc1n[n-]c(=NC(=O)c2ccc([N+](=O)[O-])[n-]2)n1C	ZINC000345387360	355812533	/nfs/dbraw/zinc/81/25/33/355812533.db2.gz	YCFVHDGFJNUMPL-UHFFFAOYSA-N	-2	0	250.218	0.034	20	5		CCBDRL
C[C@H](NC(=O)c1ccc([O-])c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000436844973	389986115	/nfs/dbraw/zinc/98/61/15/389986115.db2.gz	QRMJXQDZULSVIU-YFKPBYRVSA-N	-2	0	254.198	0.503	20	5		CCBDRL
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Cc1nc(NCCOP(=O)([O-])[O-])ccc1[N+](=O)[O-]	ZINC001157787547	837435607	/nfs/dbraw/zinc/43/56/07/837435607.db2.gz	MFFVSQGEBVDMMJ-UHFFFAOYSA-N	-2	0	277.173	0.819	20	5		CCBDRL
O=C([O-])[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CCO1	ZINC001606041452	973144282	/nfs/dbraw/zinc/14/42/82/973144282.db2.gz	NYFVRSPCTCFFHW-JTQLQIEISA-N	-2	0	296.235	0.226	20	5		CCBDRL
C[C@H](C(=O)[O-])C(=O)Nc1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC001589452658	986849509	/nfs/dbraw/zinc/84/95/09/986849509.db2.gz	MDVWAZIOBFCEQQ-YFKPBYRVSA-N	-2	0	282.208	0.952	20	5		CCBDRL
CO[N-]C(=O)CNc1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC001599319856	997561757	/nfs/dbraw/zinc/56/17/57/997561757.db2.gz	BJGJQXHTPQAYCB-UHFFFAOYSA-N	-2	0	269.213	0.383	20	5		CCBDRL
Cn1ccc([N-]S(=O)(=O)c2ccc([O-])c([N+](=O)[O-])c2)n1	ZINC000028779253	348108238	/nfs/dbraw/zinc/10/82/38/348108238.db2.gz	ZWURDNMDAWNNQB-UHFFFAOYSA-N	-2	0	298.280	0.835	20	5		CCBDRL
Cc1noc(=NC(=O)c2cc([O-])cc([N+](=O)[O-])c2)[n-]1	ZINC000356335335	356748103	/nfs/dbraw/zinc/74/81/03/356748103.db2.gz	IGXGEQGHTJGHDY-UHFFFAOYSA-N	-2	0	264.197	0.666	20	5		CCBDRL
O=C([O-])N[C@H]1CCN(C(=O)c2cc([O-])cc([N+](=O)[O-])c2)C1	ZINC000834185343	605785987	/nfs/dbraw/zinc/78/59/87/605785987.db2.gz	XOZSSJLGSCEKBU-QMMMGPOBSA-N	-2	0	295.251	0.783	20	5		CCBDRL
O=C([O-])[C@@H]1CC[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])O1	ZINC000226254404	352021961	/nfs/dbraw/zinc/02/19/61/352021961.db2.gz	JTDFIVYTVFWQQC-UWVGGRQHSA-N	-2	0	296.235	0.871	20	5		CCBDRL
O=C([O-])[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)CCO1	ZINC000588960869	359352723	/nfs/dbraw/zinc/35/27/23/359352723.db2.gz	LTRDUJGPLWXWMG-JTQLQIEISA-N	-2	0	296.235	0.226	20	5		CCBDRL
N=c1[n-]nc(CNC(=O)c2cccc([N+](=O)[O-])c2[O-])o1	ZINC000436988657	389989486	/nfs/dbraw/zinc/98/94/86/389989486.db2.gz	XERHUZXZUCUVBU-UHFFFAOYSA-N	-2	0	279.212	0.026	20	5		CCBDRL
O=C([O-])CCNS(=O)(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000021504058	171306679	/nfs/dbraw/zinc/30/66/79/171306679.db2.gz	NKTFDMCQZVZHCK-UHFFFAOYSA-N	-2	0	290.253	0.053	20	5		CCBDRL
O=C([O-])N1CC(CNC(=O)c2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000834036548	605736744	/nfs/dbraw/zinc/73/67/44/605736744.db2.gz	LHDXXRVERCHVFO-UHFFFAOYSA-N	-2	0	295.251	0.640	20	5		CCBDRL
CN(CCNC(=O)c1cc([O-])cc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000828330204	616095773	/nfs/dbraw/zinc/09/57/73/616095773.db2.gz	VEEAJSOEEUHXMG-UHFFFAOYSA-N	-2	0	283.240	0.640	20	5		CCBDRL
C[C@]1(C(=O)[O-])CCN(c2nc(C(=O)[O-])ccc2[N+](=O)[O-])C1	ZINC001593801000	996522016	/nfs/dbraw/zinc/52/20/16/996522016.db2.gz	KLUSJUFKGFVWFA-LBPRGKRZSA-N	-2	0	295.251	0.989	20	5		CCBDRL
COC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1[O-])C(=O)[O-]	ZINC001599174362	996814052	/nfs/dbraw/zinc/81/40/52/996814052.db2.gz	KKEIAAPMSBQJTP-QMMMGPOBSA-N	-2	0	284.224	0.130	20	5		CCBDRL
C[C@H](NC(=O)c1ccc([N+](=O)[O-])c([O-])c1)C(=O)[O-]	ZINC000343982034	137171664	/nfs/dbraw/zinc/17/16/64/137171664.db2.gz	KNHXAERADOEYOT-YFKPBYRVSA-N	-2	0	254.198	0.503	20	5		CCBDRL
N=c1[n-]nc(CCNC(=O)c2cc([O-])cc([N+](=O)[O-])c2)o1	ZINC000355053907	356560394	/nfs/dbraw/zinc/56/03/94/356560394.db2.gz	YUZJBJBLHJEYGZ-UHFFFAOYSA-N	-2	0	293.239	0.068	20	5		CCBDRL
O=C(NCc1n[nH]c(=O)[n-]1)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000436969367	389988752	/nfs/dbraw/zinc/98/87/52/389988752.db2.gz	ZXVIJUBLHZPHKO-UHFFFAOYSA-N	-2	0	279.212	0.054	20	5		CCBDRL
O=C([O-])[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000821508964	605561256	/nfs/dbraw/zinc/56/12/56/605561256.db2.gz	JEASJXKNVRXMKL-SECBINFHSA-N	-2	0	280.236	0.990	20	5		CCBDRL
CCn1ncn([N-]C(=O)c2cc([O-])ccc2[N+](=O)[O-])c1=O	ZINC000816735261	615732959	/nfs/dbraw/zinc/73/29/59/615732959.db2.gz	YQFNFWOKTPRIPA-UHFFFAOYSA-N	-2	0	293.239	0.062	20	5		CCBDRL
O=C([O-])C[C@@H](O)C(=O)Oc1cc([O-])ccc1[N+](=O)[O-]	ZINC001225491822	805136047	/nfs/dbraw/zinc/13/60/47/805136047.db2.gz	SXQBSLJQLJSPNJ-SSDOTTSWSA-N	-2	0	271.181	0.041	20	5		CCBDRL
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1[O-])C(=O)[O-]	ZINC001589062583	955725411	/nfs/dbraw/zinc/72/54/11/955725411.db2.gz	FYDXAMZTBWTFAD-ZCFIWIBFSA-N	-2	0	268.225	0.751	20	5		CCBDRL
C[C@H](CNC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)C(=O)[O-]	ZINC001592693746	979144551	/nfs/dbraw/zinc/14/45/51/979144551.db2.gz	AFPXINDIDFVASQ-ZCFIWIBFSA-N	-2	0	296.235	0.744	20	5		CCBDRL
O=C([O-])[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])CCO1	ZINC000821512222	598221245	/nfs/dbraw/zinc/22/12/45/598221245.db2.gz	FPKFMMZICPTMJG-JTQLQIEISA-N	-2	0	296.235	0.226	20	5		CCBDRL
CC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1[O-])C(=O)[O-]	ZINC000820411416	615531480	/nfs/dbraw/zinc/53/14/80/615531480.db2.gz	PRSFJFZHVXRXTO-MRVPVSSYSA-N	-2	0	268.225	0.893	20	5		CCBDRL
O=[N+]([O-])c1c([O-])cc(O)cc1OC[C@@H]1COCO1	ZINC001228970200	805494331	/nfs/dbraw/zinc/49/43/31/805494331.db2.gz	HDRDMTVCNSZYNU-ZETCQYMHSA-N	-2	0	257.198	0.758	20	5		CCBDRL
C[C@@H](CC(=O)[O-])Nc1nccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC001592417665	978017600	/nfs/dbraw/zinc/01/76/00/978017600.db2.gz	APMSZQJRDDHUHP-YFKPBYRVSA-N	-2	0	269.213	0.963	20	5		CCBDRL
CCn1cn[n-]c1=NC(=O)c1ccc([N+](=O)[O-])[n-]1	ZINC000356184696	356718378	/nfs/dbraw/zinc/71/83/78/356718378.db2.gz	KUZALHAOTQIJKP-UHFFFAOYSA-N	-2	0	250.218	0.209	20	5		CCBDRL
C[C@@H](CNC(=O)c1ccc([O-])c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000594460318	360319639	/nfs/dbraw/zinc/31/96/39/360319639.db2.gz	MZZMCNZEOHUORU-LURJTMIESA-N	-2	0	268.225	0.751	20	5		CCBDRL
C[C@H](C(=O)[O-])N(C)C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000819888326	597652878	/nfs/dbraw/zinc/65/28/78/597652878.db2.gz	AVYIJBGZMBKLOT-ZCFIWIBFSA-N	-2	0	268.225	0.846	20	5		CCBDRL
COc1cnc(NCCOP(=O)([O-])[O-])cc1[N+](=O)[O-]	ZINC001168590025	897710301	/nfs/dbraw/zinc/71/03/01/897710301.db2.gz	SPUSQONAZIWXGD-UHFFFAOYSA-N	-2	0	293.172	0.520	20	5		CCBDRL
CC1(C(=O)[O-])CN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C1	ZINC001593804928	996533142	/nfs/dbraw/zinc/53/31/42/996533142.db2.gz	LYXWIQOVGNMLLH-UHFFFAOYSA-N	-2	0	280.236	0.847	20	5		CCBDRL
O=C([O-])N[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2[O-])C1	ZINC000832382437	605569640	/nfs/dbraw/zinc/56/96/40/605569640.db2.gz	XCROFZJCHSHUTK-ZETCQYMHSA-N	-2	0	295.251	0.783	20	5		CCBDRL
O=C([O-])Cn1cc([N-]c2ncc([N+](=O)[O-])cn2)cn1	ZINC001606341360	973780097	/nfs/dbraw/zinc/78/00/97/973780097.db2.gz	SAZFNZAUNMTPJB-UHFFFAOYSA-N	-2	0	264.201	0.410	20	5		CCBDRL
CC[C@H](NC(=O)c1ccc([N+](=O)[O-])c([O-])c1)C(=O)[O-]	ZINC000592380103	359829613	/nfs/dbraw/zinc/82/96/13/359829613.db2.gz	LTLJSGRJKVZOLQ-ZETCQYMHSA-N	-2	0	268.225	0.893	20	5		CCBDRL
CC(C)(NC(=O)c1cc([N+](=O)[O-])ccc1[O-])c1nnn[n-]1	ZINC000436973592	389989045	/nfs/dbraw/zinc/98/90/45/389989045.db2.gz	TYNGAQHPMMAUGA-UHFFFAOYSA-N	-2	0	292.255	0.479	20	5		CCBDRL
CN(CCC(=O)[O-])C(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000262831485	131265614	/nfs/dbraw/zinc/26/56/14/131265614.db2.gz	RMOXBHYBKUYHJZ-UHFFFAOYSA-N	-2	0	268.225	0.847	20	5		CCBDRL
O=C([N-]N1CCCC1=O)c1cc([O-])ccc1[N+](=O)[O-]	ZINC000803075793	640715451	/nfs/dbraw/zinc/71/54/51/640715451.db2.gz	JBNLQQCPJLOGKP-UHFFFAOYSA-N	-2	0	265.225	0.568	20	5		CCBDRL
CN(CCNC(=O)c1ccc([N+](=O)[O-])c([O-])c1)C(=O)[O-]	ZINC000739699201	581596347	/nfs/dbraw/zinc/59/63/47/581596347.db2.gz	VSJUFTODPBQDTF-UHFFFAOYSA-N	-2	0	283.240	0.640	20	5		CCBDRL
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COc1cc(NCCOP(=O)([O-])[O-])ncc1[N+](=O)[O-]	ZINC001157787535	801484234	/nfs/dbraw/zinc/48/42/34/801484234.db2.gz	LTOFHJJFZLNHKP-UHFFFAOYSA-N	-2	0	293.172	0.520	20	5		CCBDRL
CC(C)(NC(=O)c1cccc([N+](=O)[O-])c1[O-])C(=O)[O-]	ZINC001588790424	961361131	/nfs/dbraw/zinc/36/11/31/961361131.db2.gz	GLXTVJWOACPVSE-UHFFFAOYSA-N	-2	0	268.225	0.893	20	5		CCBDRL
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CCN(CC(=O)[O-])C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC001596219058	983609841	/nfs/dbraw/zinc/60/98/41/983609841.db2.gz	BLNWBCHFVGJCPF-UHFFFAOYSA-N	-2	0	268.225	0.847	20	5		CCBDRL
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CN(CCOC(=O)c1ccc([N+](=O)[O-])[n-]1)C(=O)[O-]	ZINC000737999157	581144111	/nfs/dbraw/zinc/14/41/11/581144111.db2.gz	LWVKZZYHSCZYDO-UHFFFAOYSA-N	-2	0	257.202	0.690	20	5		CCBDRL
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CN(C(=O)c1ccc([N+](=O)[O-])c([O-])c1)c1nnn[n-]1	ZINC001149219962	800237734	/nfs/dbraw/zinc/23/77/34/800237734.db2.gz	LLDFFQAUCWFIND-UHFFFAOYSA-N	-2	0	264.201	0.090	20	5		CCBDRL
Cc1ncc([N+](=O)[O-])n1C[C@H](C)OCC[P@@](=O)([O-])O	ZINC001224606018	805060019	/nfs/dbraw/zinc/06/00/19/805060019.db2.gz	LQYPAWOJASTOCS-ZETCQYMHSA-N	-2	0	293.216	0.683	20	5		CCBDRL
C[C@H](CC(=O)[O-])NC(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC001589001339	955326732	/nfs/dbraw/zinc/32/67/32/955326732.db2.gz	KRGDHOPZBJFWKZ-ZCFIWIBFSA-N	-2	0	268.225	0.893	20	5		CCBDRL
CON(C(=O)c1ccc([N+](=O)[O-])cc1[O-])[C@H](C)C(=O)[O-]	ZINC001594039556	957850250	/nfs/dbraw/zinc/85/02/50/957850250.db2.gz	NSCFDPXVIQUJLJ-ZCFIWIBFSA-N	-2	0	284.224	0.777	20	5		CCBDRL
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C[C@H](CNC(=O)c1cc([O-])cc([N+](=O)[O-])c1)C(=O)[O-]	ZINC001592693966	979146210	/nfs/dbraw/zinc/14/62/10/979146210.db2.gz	HWNDNEHKGQCHNK-ZCFIWIBFSA-N	-2	0	268.225	0.751	20	5		CCBDRL
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C[C@H](C(=O)[O-])N(C)C(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000262253183	131205697	/nfs/dbraw/zinc/20/56/97/131205697.db2.gz	DUQMUKSTIIHSOO-ZCFIWIBFSA-N	-2	0	268.225	0.846	20	5		CCBDRL
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C[C@@H]1CN(Cc2cc([O-])ccc2[N+](=O)[O-])C[C@@H](C(=O)[O-])O1	ZINC001599866749	989277753	/nfs/dbraw/zinc/27/77/53/989277753.db2.gz	PYNYVHNDQIOIKE-PELKAZGASA-N	-2	0	296.279	0.974	20	5		CCBDRL
C[C@H](CC(=O)[O-])NC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000344141027	137179660	/nfs/dbraw/zinc/17/96/60/137179660.db2.gz	ZJDOVXVASVFNMS-ZCFIWIBFSA-N	-2	0	268.225	0.893	20	5		CCBDRL
CC(C)(NC(=O)c1cc([O-])cc([N+](=O)[O-])c1)c1nnn[n-]1	ZINC000356802047	144034611	/nfs/dbraw/zinc/03/46/11/144034611.db2.gz	GFGWVLFQTRTOAG-UHFFFAOYSA-N	-2	0	292.255	0.479	20	5		CCBDRL
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Nc1ccnc(NCCOP(=O)([O-])[O-])c1[N+](=O)[O-]	ZINC001168591155	897715030	/nfs/dbraw/zinc/71/50/30/897715030.db2.gz	JKHWJMWHSVLLBX-UHFFFAOYSA-N	-2	0	278.161	0.093	20	5		CCBDRL
CC[C@H]([N-]S(=O)(=O)c1ncccc1[N+](=O)[O-])C(=O)[O-]	ZINC001597350693	987491539	/nfs/dbraw/zinc/49/15/39/987491539.db2.gz	RTRODPMWCMLFEU-LURJTMIESA-N	-2	0	289.269	0.131	20	5		CCBDRL
C[C@@](O)(CNc1cc(C(=O)[O-])ccc1[N+](=O)[O-])C(=O)[O-]	ZINC001593417514	995205535	/nfs/dbraw/zinc/20/55/35/995205535.db2.gz	WUMKEZAMHBDAIM-LLVKDONJSA-N	-2	0	284.224	0.541	20	5		CCBDRL
C[C@]1(C(=O)[O-])CCN(c2ncc(C(=O)[O-])cc2[N+](=O)[O-])C1	ZINC001593800583	996520884	/nfs/dbraw/zinc/52/08/84/996520884.db2.gz	GTHZRAKVWAHDDW-LBPRGKRZSA-N	-2	0	295.251	0.989	20	5		CCBDRL
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Cn1cc([N-]S(=O)(=O)c2ccc([O-])c([N+](=O)[O-])c2)nn1	ZINC000359471502	356827854	/nfs/dbraw/zinc/82/78/54/356827854.db2.gz	MBVFSMSUZDUAAC-UHFFFAOYSA-N	-2	0	299.268	0.230	20	5		CCBDRL
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CC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1[O-])C(=O)[O-]	ZINC000828976383	604304910	/nfs/dbraw/zinc/30/49/10/604304910.db2.gz	LXVCIVCEDPRANF-ZETCQYMHSA-N	-2	0	268.225	0.893	20	5		CCBDRL
O=C([O-])NCCNC(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000832657930	605876654	/nfs/dbraw/zinc/87/66/54/605876654.db2.gz	FWXIEEKPSZWWEG-UHFFFAOYSA-N	-2	0	269.213	0.298	20	5		CCBDRL
COCCN(CC(=O)[O-])C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000818539486	616983369	/nfs/dbraw/zinc/98/33/69/616983369.db2.gz	UHLDAHDQKOYYMD-UHFFFAOYSA-N	-2	0	298.251	0.474	20	5		CCBDRL
O=C([O-])CCNC(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC001606196934	973448374	/nfs/dbraw/zinc/44/83/74/973448374.db2.gz	VPNCOIILMXRHQA-UHFFFAOYSA-N	-2	0	254.198	0.505	20	5		CCBDRL
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Cc1c[n+]([O-])c(NCCOP(=O)([O-])[O-])cc1[N+](=O)[O-]	ZINC001168586461	897694576	/nfs/dbraw/zinc/69/45/76/897694576.db2.gz	JWXUZUGYYRMNLR-UHFFFAOYSA-N	-2	0	293.172	0.058	20	5		CCBDRL
Cc1cc(NCCOP(=O)([O-])[O-])ncc1[N+](=O)[O-]	ZINC001168591093	897713073	/nfs/dbraw/zinc/71/30/73/897713073.db2.gz	HOWDIZYJZFDZIP-UHFFFAOYSA-N	-2	0	277.173	0.819	20	5		CCBDRL
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CN(CCN(C)C(=O)c1ccc([N+](=O)[O-])c([O-])c1)C(=O)[O-]	ZINC000833872377	616082996	/nfs/dbraw/zinc/08/29/96/616082996.db2.gz	HPHSSWLAQABEMO-UHFFFAOYSA-N	-2	0	297.267	0.982	20	5		CCBDRL
Nc1nc(NCCOP(=O)([O-])[O-])ccc1[N+](=O)[O-]	ZINC001157790681	801486246	/nfs/dbraw/zinc/48/62/46/801486246.db2.gz	CXLJMCOODFAOJP-UHFFFAOYSA-N	-2	0	278.161	0.093	20	5		CCBDRL
O=[N+]([O-])c1ncccc1NCCOP(=O)([O-])[O-]	ZINC001168590997	897712215	/nfs/dbraw/zinc/71/22/15/897712215.db2.gz	GEIJIAROKGAUBZ-UHFFFAOYSA-N	-2	0	263.146	0.511	20	5		CCBDRL
CC1(C(=O)[O-])CN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])C1	ZINC001593804917	996533160	/nfs/dbraw/zinc/53/31/60/996533160.db2.gz	KNNRBWCDZJZLJV-UHFFFAOYSA-N	-2	0	280.236	0.847	20	5		CCBDRL
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C[C@@H](NC(=O)c1cccc([O-])c1[N+](=O)[O-])C(=O)[O-]	ZINC001604994073	972586688	/nfs/dbraw/zinc/58/66/88/972586688.db2.gz	NRSRRNBUQUYAST-RXMQYKEDSA-N	-2	0	254.198	0.503	20	5		CCBDRL
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C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1[O-])C(=O)[O-]	ZINC000818046395	601592390	/nfs/dbraw/zinc/59/23/90/601592390.db2.gz	XEYICTMOVJIVJY-YFKPBYRVSA-N	-2	0	254.198	0.503	20	5		CCBDRL
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C[C@@H](CC(=O)[O-])NC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000344141025	137179452	/nfs/dbraw/zinc/17/94/52/137179452.db2.gz	ZJDOVXVASVFNMS-LURJTMIESA-N	-2	0	268.225	0.893	20	5		CCBDRL
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C[C@H](CNC(=O)[O-])CNC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000833805505	605830526	/nfs/dbraw/zinc/83/05/26/605830526.db2.gz	DZKDIUVHLDXYDQ-ZETCQYMHSA-N	-2	0	297.267	0.934	20	5		CCBDRL
CN(CCN(C)C(=O)c1cccc([N+](=O)[O-])c1[O-])C(=O)[O-]	ZINC000833872481	616083377	/nfs/dbraw/zinc/08/33/77/616083377.db2.gz	JWKUMVZYUCKDOP-UHFFFAOYSA-N	-2	0	297.267	0.982	20	5		CCBDRL
COC[C@](C)(NC(=O)c1cc([N+](=O)[O-])ccc1[O-])C(=O)[O-]	ZINC000833722060	616831392	/nfs/dbraw/zinc/83/13/92/616831392.db2.gz	YLVMMBPHPFQARF-LBPRGKRZSA-N	-2	0	298.251	0.520	20	5		CCBDRL
Cc1cccc([N+](=O)[O-])c1C(=O)[N-]n1c(=O)[n-][nH]c1=O	ZINC000820292888	641493956	/nfs/dbraw/zinc/49/39/56/641493956.db2.gz	WVCJZTYKXMAZCJ-UHFFFAOYSA-N	-2	0	279.212	0.290	20	5		CCBDRL
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Cn1[n-]c(C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])cc1=O	ZINC001295970838	906829122	/nfs/dbraw/zinc/82/91/22/906829122.db2.gz	NEVYRXSGLCSKND-UHFFFAOYSA-N	-2	0	278.224	0.992	20	5		CCBDRL
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C[C@@H](CNC(=O)c1cc([O-])cc([N+](=O)[O-])c1)C(=O)[O-]	ZINC001592693965	979146198	/nfs/dbraw/zinc/14/61/98/979146198.db2.gz	HWNDNEHKGQCHNK-LURJTMIESA-N	-2	0	268.225	0.751	20	5		CCBDRL
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COCCN(CC(=O)[O-])C(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000588960839	359352279	/nfs/dbraw/zinc/35/22/79/359352279.db2.gz	KUSWCJJKIBBBBX-UHFFFAOYSA-N	-2	0	298.251	0.474	20	5		CCBDRL
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CC(C)(NC(=O)c1cc([N+](=O)[O-])ccc1[O-])C(=O)[O-]	ZINC000222412821	614168903	/nfs/dbraw/zinc/16/89/03/614168903.db2.gz	NBINNAWPGGZBCD-UHFFFAOYSA-N	-2	0	268.225	0.893	20	5		CCBDRL
CCO[N-]C(=O)CNC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000846496414	615372001	/nfs/dbraw/zinc/37/20/01/615372001.db2.gz	JYIFIMRHHSNBFT-UHFFFAOYSA-N	-2	0	283.240	0.098	20	5		CCBDRL
COc1cc(NCCOP(=O)([O-])[O-])cnc1[N+](=O)[O-]	ZINC001168591928	897718585	/nfs/dbraw/zinc/71/85/85/897718585.db2.gz	JKTLEZXPEAUJJX-UHFFFAOYSA-N	-2	0	293.172	0.520	20	5		CCBDRL
O=C([O-])CCCNC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000262274846	137034420	/nfs/dbraw/zinc/03/44/20/137034420.db2.gz	JHHFGUYVBRSVJG-UHFFFAOYSA-N	-2	0	268.225	0.895	20	5		CCBDRL
C[C@@H](NC(=O)c1ccc([O-])c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000436844972	533290521	/nfs/dbraw/zinc/29/05/21/533290521.db2.gz	QRMJXQDZULSVIU-RXMQYKEDSA-N	-2	0	254.198	0.503	20	5		CCBDRL
O=C([O-])NCCCNC(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000834236935	605780374	/nfs/dbraw/zinc/78/03/74/605780374.db2.gz	AKUVRFUKGRUEAP-UHFFFAOYSA-N	-2	0	283.240	0.688	20	5		CCBDRL
Nc1cc(NCCOP(=O)([O-])[O-])ncc1[N+](=O)[O-]	ZINC001157791148	801486377	/nfs/dbraw/zinc/48/63/77/801486377.db2.gz	KBAKOFARNFWPKR-UHFFFAOYSA-N	-2	0	278.161	0.093	20	5		CCBDRL
Cc1ccnc(NCCOP(=O)([O-])[O-])c1[N+](=O)[O-]	ZINC001157786849	837434240	/nfs/dbraw/zinc/43/42/40/837434240.db2.gz	CBBSFUTVNQHZTJ-UHFFFAOYSA-N	-2	0	277.173	0.819	20	5		CCBDRL
CON(C(=O)c1ccc([N+](=O)[O-])cc1[O-])[C@@H](C)C(=O)[O-]	ZINC001594039554	957851033	/nfs/dbraw/zinc/85/10/33/957851033.db2.gz	NSCFDPXVIQUJLJ-LURJTMIESA-N	-2	0	284.224	0.777	20	5		CCBDRL
C[C@H](CC(=O)[O-])Nc1nccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC001592417661	978018014	/nfs/dbraw/zinc/01/80/14/978018014.db2.gz	APMSZQJRDDHUHP-RXMQYKEDSA-N	-2	0	269.213	0.963	20	5		CCBDRL
C[C@H]1CN(Cc2cc([O-])ccc2[N+](=O)[O-])C[C@@H](C(=O)[O-])O1	ZINC001599930127	985297060	/nfs/dbraw/zinc/29/70/60/985297060.db2.gz	PYNYVHNDQIOIKE-UFBFGSQYSA-N	-2	0	296.279	0.974	20	5		CCBDRL
C[C@@H](CC(=O)[O-])NC(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC001599833797	988713216	/nfs/dbraw/zinc/71/32/16/988713216.db2.gz	BQVCYMYSYPIWHT-LURJTMIESA-N	-2	0	268.225	0.893	20	5		CCBDRL
C[C@H]([N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-])C(=O)[O-]	ZINC000311828363	137076200	/nfs/dbraw/zinc/07/62/00/137076200.db2.gz	DTJLOBQSBWNWNY-YFKPBYRVSA-N	-2	0	292.244	0.485	20	5		CCBDRL
O=C(NCc1n[nH]c(=O)[n-]1)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000436990535	389989962	/nfs/dbraw/zinc/98/99/62/389989962.db2.gz	QOAVSDUBTSEQEA-UHFFFAOYSA-N	-2	0	279.212	0.054	20	5		CCBDRL
O=C([O-])CCNC(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000821525439	598221264	/nfs/dbraw/zinc/22/12/64/598221264.db2.gz	UAYMLYCFRJUEEA-UHFFFAOYSA-N	-2	0	254.198	0.505	20	5		CCBDRL
O=C([O-])N1CC(NC(=O)c2ccc([O-])c([N+](=O)[O-])c2)C1	ZINC000834019144	605856394	/nfs/dbraw/zinc/85/63/94/605856394.db2.gz	OWKIQDNVCJPTMQ-UHFFFAOYSA-N	-2	0	281.224	0.392	20	5		CCBDRL
O=C([O-])NCCOCC(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000834242015	605712806	/nfs/dbraw/zinc/71/28/06/605712806.db2.gz	CNGFXHXYGWDLLA-UHFFFAOYSA-N	-2	0	299.239	0.523	20	5		CCBDRL
CN(CCC(=O)[O-])C(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000820586201	616068949	/nfs/dbraw/zinc/06/89/49/616068949.db2.gz	QFPPLJUDVIUDGJ-UHFFFAOYSA-N	-2	0	268.225	0.847	20	5		CCBDRL
Cc1c(F)cnc(NCCOP(=O)([O-])[O-])c1[N+](=O)[O-]	ZINC001168585657	897685234	/nfs/dbraw/zinc/68/52/34/897685234.db2.gz	AKPJSGRNAJJFLS-UHFFFAOYSA-N	-2	0	295.163	0.959	20	5		CCBDRL
C[C@H](C(=O)[O-])C(=O)Nc1ccc([O-])c([N+](=O)[O-])c1	ZINC001602805978	971587108	/nfs/dbraw/zinc/58/71/08/971587108.db2.gz	BLOJMESKAKOJHL-YFKPBYRVSA-N	-2	0	254.198	0.960	20	5		CCBDRL
CC[C@@H](NC(=O)c1cccc([O-])c1[N+](=O)[O-])C(=O)[O-]	ZINC001595270199	980285304	/nfs/dbraw/zinc/28/53/04/980285304.db2.gz	BKTUPHKUOGAWDW-SSDOTTSWSA-N	-2	0	268.225	0.893	20	5		CCBDRL
C[C@H](CC(=O)[O-])NC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC001599888940	984671278	/nfs/dbraw/zinc/67/12/78/984671278.db2.gz	LJAPWKSPPWXRSZ-ZCFIWIBFSA-N	-2	0	268.225	0.893	20	5		CCBDRL
O=C(NCc1n[nH]c(=O)[n-]1)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000428017533	235389858	/nfs/dbraw/zinc/38/98/58/235389858.db2.gz	NJJRGEGMJOJCNO-UHFFFAOYSA-N	-2	0	279.212	0.054	20	5		CCBDRL
N=c1[n-]nc(CNC(=O)c2cc([N+](=O)[O-])ccc2[O-])o1	ZINC000436598271	389980407	/nfs/dbraw/zinc/98/04/07/389980407.db2.gz	ZKVFJFPOVIITFV-UHFFFAOYSA-N	-2	0	279.212	0.026	20	5		CCBDRL
O=C(NC1(c2nnn[n-]2)CC1)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000357082596	144058375	/nfs/dbraw/zinc/05/83/75/144058375.db2.gz	XKQKAXHANNQORG-UHFFFAOYSA-N	-2	0	290.239	0.233	20	5		CCBDRL
O=C([O-])N1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)C1	ZINC000740404990	581676940	/nfs/dbraw/zinc/67/69/40/581676940.db2.gz	YKYRDIJRAMTXGH-QMMMGPOBSA-N	-2	0	295.251	0.783	20	5		CCBDRL
C[C@@H](CC(=O)[O-])NC(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC001589001338	955326996	/nfs/dbraw/zinc/32/69/96/955326996.db2.gz	KRGDHOPZBJFWKZ-LURJTMIESA-N	-2	0	268.225	0.893	20	5		CCBDRL
CC[C@H](NC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)C(=O)[O-]	ZINC001597338859	987477223	/nfs/dbraw/zinc/47/72/23/987477223.db2.gz	AFOUCYNHQHGFTF-VIFPVBQESA-N	-2	0	296.235	0.886	20	5		CCBDRL
O=C([O-])[C@H]1CC[C@@H](C(=O)Nc2ccc([O-])c([N+](=O)[O-])c2)O1	ZINC000571761605	291835063	/nfs/dbraw/zinc/83/50/63/291835063.db2.gz	RIBZYIYIFJNDFW-VHSXEESVSA-N	-2	0	296.235	0.871	20	5		CCBDRL
O=C(NC1(c2nnn[n-]2)CC1)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000436995840	389989553	/nfs/dbraw/zinc/98/95/53/389989553.db2.gz	JEEYJAGSOUKCNF-UHFFFAOYSA-N	-2	0	290.239	0.233	20	5		CCBDRL
O=C([O-])[C@H]1CCN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)C1	ZINC000262832288	131266138	/nfs/dbraw/zinc/26/61/38/131266138.db2.gz	RTDAYRJMNDKMGW-QMMMGPOBSA-N	-2	0	280.236	0.847	20	5		CCBDRL
O=C([O-])[C@@H]1CN(Cc2cc([O-])ccc2[N+](=O)[O-])CCO1	ZINC000821512728	598123097	/nfs/dbraw/zinc/12/30/97/598123097.db2.gz	NGISHRRMRCCFHD-NSHDSACASA-N	-2	0	282.252	0.586	20	5		CCBDRL
C[C@@H](NS(=O)(=O)c1cccc(F)c1[N+](=O)[O-])C(=O)[O-]	ZINC000123702754	602173574	/nfs/dbraw/zinc/17/35/74/602173574.db2.gz	BVZNJSHBYBYMMQ-RXMQYKEDSA-N	-2	0	292.244	0.485	20	5		CCBDRL
C[C@H](NC(=O)c1cc([O-])cc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000820129923	604368067	/nfs/dbraw/zinc/36/80/67/604368067.db2.gz	SNTQZPUSGSZFRH-YFKPBYRVSA-N	-2	0	254.198	0.503	20	5		CCBDRL
O=C([N-]n1ccccc1=O)c1cc([O-])ccc1[N+](=O)[O-]	ZINC000807199890	640819360	/nfs/dbraw/zinc/81/93/60/640819360.db2.gz	QVVNASCJEZMNOV-UHFFFAOYSA-N	-2	0	275.220	0.846	20	5		CCBDRL
COc1cc([N+](=O)[O-])cnc1NCCOP(=O)([O-])[O-]	ZINC001168587412	897700871	/nfs/dbraw/zinc/70/08/71/897700871.db2.gz	UJAGDNBEUHPQCO-UHFFFAOYSA-N	-2	0	293.172	0.520	20	5		CCBDRL
O=C([O-])[C@@H]1COCCN1Cc1cc([O-])ccc1[N+](=O)[O-]	ZINC000593288449	360061156	/nfs/dbraw/zinc/06/11/56/360061156.db2.gz	KGSKCXMWTYPWJV-NSHDSACASA-N	-2	0	282.252	0.586	20	5		CCBDRL
C[C@@H](C(=O)[O-])N(C)C(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000817762771	597265930	/nfs/dbraw/zinc/26/59/30/597265930.db2.gz	WIQLJQSTCHWYGH-LURJTMIESA-N	-2	0	268.225	0.846	20	5		CCBDRL
O=C([O-])[C@]1(F)CCN(C(=O)c2ccc([N+](=O)[O-])c([O-])c2)C1	ZINC000833357510	601758882	/nfs/dbraw/zinc/75/88/82/601758882.db2.gz	YLFNKXRUSYZSFL-LBPRGKRZSA-N	-2	0	298.226	0.939	20	5		CCBDRL
O=C([O-])CC[C@@H](O)C(=O)Oc1cc([O-])ccc1[N+](=O)[O-]	ZINC001225490815	805136297	/nfs/dbraw/zinc/13/62/97/805136297.db2.gz	LMBYEBMPCBEOLF-MRVPVSSYSA-N	-2	0	285.208	0.432	20	5		CCBDRL
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1[O-])C(=O)[O-]	ZINC001592694301	979147406	/nfs/dbraw/zinc/14/74/06/979147406.db2.gz	QKMPZCBYHKSTTO-LURJTMIESA-N	-2	0	268.225	0.751	20	5		CCBDRL
CC1(C(=O)[O-])CN(C(=O)c2cccc([N+](=O)[O-])c2[O-])C1	ZINC001593804921	996532932	/nfs/dbraw/zinc/53/29/32/996532932.db2.gz	LBUMWSJZTCAOKP-UHFFFAOYSA-N	-2	0	280.236	0.847	20	5		CCBDRL
CC(C)(NC(=O)c1ccc([O-])c([N+](=O)[O-])c1)c1nnn[n-]1	ZINC000436963077	389988315	/nfs/dbraw/zinc/98/83/15/389988315.db2.gz	CYYWDVOMKUTWHL-UHFFFAOYSA-N	-2	0	292.255	0.479	20	5		CCBDRL
C[C@@H](C(=O)[O-])N(C)C(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000262696190	131252236	/nfs/dbraw/zinc/25/22/36/131252236.db2.gz	DRFRMMHHUYTEGH-LURJTMIESA-N	-2	0	268.225	0.846	20	5		CCBDRL
CC[C@H](NC(=O)c1cc([O-])cc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000833642837	615811150	/nfs/dbraw/zinc/81/11/50/615811150.db2.gz	IMJFKWIVEWBNEZ-VIFPVBQESA-N	-2	0	268.225	0.893	20	5		CCBDRL
CC(C)(NC(=O)c1cc([O-])cc([N+](=O)[O-])c1)C(=O)[O-]	ZINC001588791403	961365527	/nfs/dbraw/zinc/36/55/27/961365527.db2.gz	YZOCBESJHDMKRT-UHFFFAOYSA-N	-2	0	268.225	0.893	20	5		CCBDRL
C[C@@H](C(=O)[O-])C(=O)Nc1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC001589452657	986849781	/nfs/dbraw/zinc/84/97/81/986849781.db2.gz	MDVWAZIOBFCEQQ-RXMQYKEDSA-N	-2	0	282.208	0.952	20	5		CCBDRL
C[C@@H](C(=O)[O-])N(C)C(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC001599830694	988668908	/nfs/dbraw/zinc/66/89/08/988668908.db2.gz	QGZDJEXPFDXUIY-LURJTMIESA-N	-2	0	268.225	0.846	20	5		CCBDRL